*HEADER    STRUCTURAL GENOMICS, UNKNOWN FUNCTION   28-FEB-10   2KUT              
*TITLE     SOLUTION STRUCTURE OF GMR58A FROM GEOBACTER METALLIREDUCENS.          
*TITLE    2 NORTHEAST STRUCTURAL GENOMICS CONSORTIUM TARGET GMR58A               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: UNCHARACTERIZED PROTEIN;                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: SEQUENCE DATABASE RESIDUES 470-583;                        
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: GEOBACTER METALLIREDUCENS;                      
*SOURCE   3 ORGANISM_TAXID: 269799;                                              
*SOURCE   4 STRAIN: GS-15 / ATCC 53774 / DSM 7210;                               
*SOURCE   5 GENE: GMET_1998;                                                     
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3)+MAGIC;                           
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR: PET 21-23C                                 
*KEYWDS    STRUCTURAL GENOMICS, PSI-2, PROTEIN STRUCTURE INITIATIVE,             
*KEYWDS   2 NORTHEAST STRUCTURAL GENOMICS CONSORTIUM, NESG, UNKNOWN              
*KEYWDS   3 FUNCTION                                                             
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    H.LEE, H.WANG, W.A.BUCHWALD, H.JANJUA, R.NAIR, B.ROST,                
*AUTHOR   2 T.B.ACTON, R.XIAO, J.K.EVERETT, G.T.MONTELIONE,                      
*AUTHOR   3 J.H.PRESTEGARD, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM             
*AUTHOR   4 (NESG)                                                               
*REVDAT   1   23-MAR-10 2KUT    0                                                


###################################################################
#       Chemical Shift Ambiguity Index Value Definitions          #
#                                                                 #
# The values other than 1 are used for those atoms with different #
# chemical shifts that cannot be assigned to stereospecific atoms #
# or to specific residues or chains.                              #
#                                                                 #
#   Index Value            Definition                             #
#                                                                 #
#      1             Unique (including isolated methyl protons,   #
#                         geminal atoms, and geminal methyl       #
#                         groups with identical chemical shifts)  #
#                         (e.g. ILE HD11, HD12, HD13 protons)     #
#      2             Ambiguity of geminal atoms or geminal methyl #
#                         proton groups (e.g. ASP HB2 and HB3     #
#                         protons, LEU CD1 and CD2 carbons, or    #
#                         LEU HD11, HD12, HD13 and HD21, HD22,    #
#                         HD23 methyl protons)                    #
#      3             Aromatic atoms on opposite sides of          #
#                         symmetrical rings (e.g. TYR HE1 and HE2 #
#                         protons)                                #
#      4             Intraresidue ambiguities (e.g. LYS HG and    #
#                         HD protons or TRP HZ2 and HZ3 protons)  #
#      5             Interresidue ambiguities (LYS 12 vs. LYS 27) #
#      6             Intermolecular ambiguities (e.g. ASP 31 CA   #
#                         in monomer 1 and ASP 31 CA in monomer 2 #
#                         of an asymmetrical homodimer, duplex    #
#                         DNA assignments, or other assignments   #
#                         that may apply to atoms in one or more  #
#                         molecule in the molecular assembly)     #
#      9             Ambiguous, specific ambiguity not defined    #
#                                                                 #
###################################################################
loop_
    _RDC.ID
    _RDC.RDC_code
    _RDC.Entity_assembly_ID_1
    _RDC.Comp_index_ID_1
    _RDC.Comp_ID_1
    _RDC.Atom_ID_1
    _RDC.Atom_type_1
    _RDC.Atom_isotope_number_1
    _RDC.Ambiguity_code_1
    _RDC.Entity_assembly_ID_2
    _RDC.Comp_index_ID_2
    _RDC.Comp_ID_2
    _RDC.Atom_ID_2
    _RDC.Atom_type_2
    _RDC.Atom_isotope_number_2
    _RDC.Ambiguity_code_2
    _RDC.Val
    _RDC.Val_min
    _RDC.Val_max
    _RDC.Val_err

    1   ?  ?  5    K  N  ?  ?  ?  ?  5    K  H  ?  ?  ?  4.1679   ?  ?  ?  
    2   ?  ?  6    G  N  ?  ?  ?  ?  6    G  H  ?  ?  ?  5.2463   ?  ?  ?  
    3   ?  ?  7    V  N  ?  ?  ?  ?  7    V  H  ?  ?  ?  3.8384   ?  ?  ?  
    4   ?  ?  8    Y  N  ?  ?  ?  ?  8    Y  H  ?  ?  ?  6.5457   ?  ?  ?  
    5   ?  ?  10   M  N  ?  ?  ?  ?  10   M  H  ?  ?  ?  3.4538   ?  ?  ?  
    6   ?  ?  14   P  N  ?  ?  ?  ?  14   P  H  ?  ?  ?  -1.0696  ?  ?  ?  
    7   ?  ?  15   N  N  ?  ?  ?  ?  15   N  H  ?  ?  ?  -3.5873  ?  ?  ?  
    8   ?  ?  16   M  N  ?  ?  ?  ?  16   M  H  ?  ?  ?  4.0056   ?  ?  ?  
    9   ?  ?  17   P  N  ?  ?  ?  ?  17   P  H  ?  ?  ?  -0.5179  ?  ?  ?  
    10  ?  ?  18   A  N  ?  ?  ?  ?  18   A  H  ?  ?  ?  3.7211   ?  ?  ?  
    11  ?  ?  19   A  N  ?  ?  ?  ?  19   A  H  ?  ?  ?  3.7669   ?  ?  ?  
    12  ?  ?  20   G  N  ?  ?  ?  ?  20   G  H  ?  ?  ?  6.2465   ?  ?  ?  
    13  ?  ?  21   R  N  ?  ?  ?  ?  21   R  H  ?  ?  ?  3.319    ?  ?  ?  
    14  ?  ?  22   L  N  ?  ?  ?  ?  22   L  H  ?  ?  ?  3.8053   ?  ?  ?  
    15  ?  ?  23   E  N  ?  ?  ?  ?  23   E  H  ?  ?  ?  -0.5955  ?  ?  ?  
    16  ?  ?  24   A  N  ?  ?  ?  ?  24   A  H  ?  ?  ?  1.242    ?  ?  ?  
    17  ?  ?  25   G  N  ?  ?  ?  ?  25   G  H  ?  ?  ?  -2.2111  ?  ?  ?  
    18  ?  ?  26   D  N  ?  ?  ?  ?  26   D  H  ?  ?  ?  1.8264   ?  ?  ?  
    19  ?  ?  27   R  N  ?  ?  ?  ?  27   R  H  ?  ?  ?  3.1379   ?  ?  ?  
    20  ?  ?  31   I  N  ?  ?  ?  ?  31   I  H  ?  ?  ?  -4.7964  ?  ?  ?  
    21  ?  ?  32   D  N  ?  ?  ?  ?  32   D  H  ?  ?  ?  2.6468   ?  ?  ?  
    22  ?  ?  37   N  N  ?  ?  ?  ?  37   N  H  ?  ?  ?  1.4929   ?  ?  ?  
    23  ?  ?  38   T  N  ?  ?  ?  ?  38   T  H  ?  ?  ?  1.1082   ?  ?  ?  
    24  ?  ?  39   S  N  ?  ?  ?  ?  39   S  H  ?  ?  ?  3.612    ?  ?  ?  
    25  ?  ?  40   E  N  ?  ?  ?  ?  40   E  H  ?  ?  ?  4.2552   ?  ?  ?  
    26  ?  ?  42   I  N  ?  ?  ?  ?  42   I  H  ?  ?  ?  5.6248   ?  ?  ?  
    27  ?  ?  49   K  N  ?  ?  ?  ?  49   K  H  ?  ?  ?  3.597    ?  ?  ?  
    28  ?  ?  51   A  N  ?  ?  ?  ?  51   A  H  ?  ?  ?  2.4985   ?  ?  ?  
    29  ?  ?  52   G  N  ?  ?  ?  ?  52   G  H  ?  ?  ?  2.5646   ?  ?  ?  
    30  ?  ?  53   D  N  ?  ?  ?  ?  53   D  H  ?  ?  ?  3.505    ?  ?  ?  
    31  ?  ?  54   R  N  ?  ?  ?  ?  54   R  H  ?  ?  ?  1.9816   ?  ?  ?  
    32  ?  ?  56   R  N  ?  ?  ?  ?  56   R  H  ?  ?  ?  0.8594   ?  ?  ?  
    33  ?  ?  57   V  N  ?  ?  ?  ?  57   V  H  ?  ?  ?  -0.5141  ?  ?  ?  
    34  ?  ?  58   T  N  ?  ?  ?  ?  58   T  H  ?  ?  ?  -1.5372  ?  ?  ?  
    35  ?  ?  59   F  N  ?  ?  ?  ?  59   F  H  ?  ?  ?  0.9699   ?  ?  ?  
    36  ?  ?  62   D  N  ?  ?  ?  ?  62   D  H  ?  ?  ?  1.9722   ?  ?  ?  
    37  ?  ?  64   K  N  ?  ?  ?  ?  64   K  H  ?  ?  ?  0.9826   ?  ?  ?  
    38  ?  ?  65   Q  N  ?  ?  ?  ?  65   Q  H  ?  ?  ?  -0.2215  ?  ?  ?  
    39  ?  ?  66   H  N  ?  ?  ?  ?  66   H  H  ?  ?  ?  -0.5341  ?  ?  ?  
    40  ?  ?  68   A  N  ?  ?  ?  ?  68   A  H  ?  ?  ?  2.5743   ?  ?  ?  
    41  ?  ?  69   E  N  ?  ?  ?  ?  69   E  H  ?  ?  ?  4.4387   ?  ?  ?  
    42  ?  ?  70   L  N  ?  ?  ?  ?  70   L  H  ?  ?  ?  4.5446   ?  ?  ?  
    43  ?  ?  71   V  N  ?  ?  ?  ?  71   V  H  ?  ?  ?  4.3464   ?  ?  ?  
    44  ?  ?  72   L  N  ?  ?  ?  ?  72   L  H  ?  ?  ?  3.9173   ?  ?  ?  
    45  ?  ?  73   K  N  ?  ?  ?  ?  73   K  H  ?  ?  ?  1.5463   ?  ?  ?  
    46  ?  ?  86   V  N  ?  ?  ?  ?  86   V  H  ?  ?  ?  1.2743   ?  ?  ?  
    47  ?  ?  90   H  N  ?  ?  ?  ?  90   H  H  ?  ?  ?  3.8703   ?  ?  ?  
    48  ?  ?  91   H  N  ?  ?  ?  ?  91   H  H  ?  ?  ?  3.6022   ?  ?  ?  
    49  ?  ?  92   H  N  ?  ?  ?  ?  92   H  H  ?  ?  ?  3.4725   ?  ?  ?  
    50  ?  ?  93   H  N  ?  ?  ?  ?  93   H  H  ?  ?  ?  0.5902   ?  ?  ?  
    51  ?  ?  100  ?  N  ?  ?  ?  ?  100  ?  H  ?  ?  ?  0.8556   ?  ?  ?  
    52  ?  ?  101  ?  N  ?  ?  ?  ?  101  ?  H  ?  ?  ?  0.6379   ?  ?  ?  
    53  ?  ?  102  ?  N  ?  ?  ?  ?  102  ?  H  ?  ?  ?  1.0654   ?  ?  ?  
    54  ?  ?  103  ?  N  ?  ?  ?  ?  103  ?  H  ?  ?  ?  -0.0497  ?  ?  ?  
    55  ?  ?  107  ?  N  ?  ?  ?  ?  107  ?  H  ?  ?  ?  4.2985   ?  ?  ?  
    56  ?  ?  108  ?  N  ?  ?  ?  ?  108  ?  H  ?  ?  ?  6.3025   ?  ?  ?  
    57  ?  ?  109  ?  N  ?  ?  ?  ?  109  ?  H  ?  ?  ?  6.3518   ?  ?  ?  
    58  ?  ?  110  ?  N  ?  ?  ?  ?  110  ?  H  ?  ?  ?  4.4198   ?  ?  ?  
    59  ?  ?  112  ?  N  ?  ?  ?  ?  112  ?  H  ?  ?  ?  4.8485   ?  ?  ?  

stop_
###################################################################
#       Chemical Shift Ambiguity Index Value Definitions          #
#                                                                 #
# The values other than 1 are used for those atoms with different #
# chemical shifts that cannot be assigned to stereospecific atoms #
# or to specific residues or chains.                              #
#                                                                 #
#   Index Value            Definition                             #
#                                                                 #
#      1             Unique (including isolated methyl protons,   #
#                         geminal atoms, and geminal methyl       #
#                         groups with identical chemical shifts)  #
#                         (e.g. ILE HD11, HD12, HD13 protons)     #
#      2             Ambiguity of geminal atoms or geminal methyl #
#                         proton groups (e.g. ASP HB2 and HB3     #
#                         protons, LEU CD1 and CD2 carbons, or    #
#                         LEU HD11, HD12, HD13 and HD21, HD22,    #
#                         HD23 methyl protons)                    #
#      3             Aromatic atoms on opposite sides of          #
#                         symmetrical rings (e.g. TYR HE1 and HE2 #
#                         protons)                                #
#      4             Intraresidue ambiguities (e.g. LYS HG and    #
#                         HD protons or TRP HZ2 and HZ3 protons)  #
#      5             Interresidue ambiguities (LYS 12 vs. LYS 27) #
#      6             Intermolecular ambiguities (e.g. ASP 31 CA   #
#                         in monomer 1 and ASP 31 CA in monomer 2 #
#                         of an asymmetrical homodimer, duplex    #
#                         DNA assignments, or other assignments   #
#                         that may apply to atoms in one or more  #
#                         molecule in the molecular assembly)     #
#      9             Ambiguous, specific ambiguity not defined    #
#                                                                 #
###################################################################
loop_
    _RDC.ID
    _RDC.RDC_code
    _RDC.Entity_assembly_ID_1
    _RDC.Comp_index_ID_1
    _RDC.Comp_ID_1
    _RDC.Atom_ID_1
    _RDC.Atom_type_1
    _RDC.Atom_isotope_number_1
    _RDC.Ambiguity_code_1
    _RDC.Entity_assembly_ID_2
    _RDC.Comp_index_ID_2
    _RDC.Comp_ID_2
    _RDC.Atom_ID_2
    _RDC.Atom_type_2
    _RDC.Atom_isotope_number_2
    _RDC.Ambiguity_code_2
    _RDC.Val
    _RDC.Val_min
    _RDC.Val_max
    _RDC.Val_err

    1   ?  ?  5    K  N  ?  ?  ?  ?  5    K  H  ?  ?  ?  -20.98   ?  ?  ?  
    2   ?  ?  6    G  N  ?  ?  ?  ?  6    G  H  ?  ?  ?  -11.368  ?  ?  ?  
    3   ?  ?  8    Y  N  ?  ?  ?  ?  8    Y  H  ?  ?  ?  -21.195  ?  ?  ?  
    4   ?  ?  10   M  N  ?  ?  ?  ?  10   M  H  ?  ?  ?  -14.404  ?  ?  ?  
    5   ?  ?  11   S  N  ?  ?  ?  ?  11   S  H  ?  ?  ?  -10.277  ?  ?  ?  
    6   ?  ?  16   M  N  ?  ?  ?  ?  16   M  H  ?  ?  ?  -16.7    ?  ?  ?  
    7   ?  ?  17   P  N  ?  ?  ?  ?  17   P  H  ?  ?  ?  7.441    ?  ?  ?  
    8   ?  ?  20   G  N  ?  ?  ?  ?  20   G  H  ?  ?  ?  -23.563  ?  ?  ?  
    9   ?  ?  21   R  N  ?  ?  ?  ?  21   R  H  ?  ?  ?  -8.863   ?  ?  ?  
    10  ?  ?  25   G  N  ?  ?  ?  ?  25   G  H  ?  ?  ?  -17.858  ?  ?  ?  
    11  ?  ?  30   A  N  ?  ?  ?  ?  30   A  H  ?  ?  ?  5.527    ?  ?  ?  
    12  ?  ?  31   I  N  ?  ?  ?  ?  31   I  H  ?  ?  ?  17.484   ?  ?  ?  
    13  ?  ?  32   D  N  ?  ?  ?  ?  32   D  H  ?  ?  ?  -0.963   ?  ?  ?  
    14  ?  ?  34   Q  N  ?  ?  ?  ?  34   Q  H  ?  ?  ?  -15.148  ?  ?  ?  
    15  ?  ?  35   P  N  ?  ?  ?  ?  35   P  H  ?  ?  ?  -13.506  ?  ?  ?  
    16  ?  ?  38   T  N  ?  ?  ?  ?  38   T  H  ?  ?  ?  -3.422   ?  ?  ?  
    17  ?  ?  43   V  N  ?  ?  ?  ?  43   V  H  ?  ?  ?  2.437    ?  ?  ?  
    18  ?  ?  52   G  N  ?  ?  ?  ?  52   G  H  ?  ?  ?  -5.303   ?  ?  ?  
    19  ?  ?  53   D  N  ?  ?  ?  ?  53   D  H  ?  ?  ?  -14.913  ?  ?  ?  
    20  ?  ?  54   R  N  ?  ?  ?  ?  54   R  H  ?  ?  ?  -5.919   ?  ?  ?  
    21  ?  ?  56   R  N  ?  ?  ?  ?  56   R  H  ?  ?  ?  -6.791   ?  ?  ?  
    22  ?  ?  58   T  N  ?  ?  ?  ?  58   T  H  ?  ?  ?  28.902   ?  ?  ?  
    23  ?  ?  61   R  N  ?  ?  ?  ?  61   R  H  ?  ?  ?  2.987    ?  ?  ?  
    24  ?  ?  62   D  N  ?  ?  ?  ?  62   D  H  ?  ?  ?  -17.988  ?  ?  ?  
    25  ?  ?  63   R  N  ?  ?  ?  ?  63   R  H  ?  ?  ?  1.381    ?  ?  ?  
    26  ?  ?  64   K  N  ?  ?  ?  ?  64   K  H  ?  ?  ?  -13.53   ?  ?  ?  
    27  ?  ?  65   Q  N  ?  ?  ?  ?  65   Q  H  ?  ?  ?  -16.913  ?  ?  ?  
    28  ?  ?  66   H  N  ?  ?  ?  ?  66   H  H  ?  ?  ?  -12.659  ?  ?  ?  
    29  ?  ?  68   A  N  ?  ?  ?  ?  68   A  H  ?  ?  ?  -7.676   ?  ?  ?  
    30  ?  ?  69   E  N  ?  ?  ?  ?  69   E  H  ?  ?  ?  -22.018  ?  ?  ?  
    31  ?  ?  70   L  N  ?  ?  ?  ?  70   L  H  ?  ?  ?  -16.661  ?  ?  ?  
    32  ?  ?  71   V  N  ?  ?  ?  ?  71   V  H  ?  ?  ?  -16.204  ?  ?  ?  
    33  ?  ?  73   K  N  ?  ?  ?  ?  73   K  H  ?  ?  ?  -15.892  ?  ?  ?  
    34  ?  ?  85   G  N  ?  ?  ?  ?  85   G  H  ?  ?  ?  -9.425   ?  ?  ?  
    35  ?  ?  91   H  N  ?  ?  ?  ?  91   H  H  ?  ?  ?  -11.593  ?  ?  ?  
    36  ?  ?  93   H  N  ?  ?  ?  ?  93   H  H  ?  ?  ?  -4.01    ?  ?  ?  
    37  ?  ?  100  ?  N  ?  ?  ?  ?  100  ?  H  ?  ?  ?  -0.841   ?  ?  ?  
    38  ?  ?  101  ?  N  ?  ?  ?  ?  101  ?  H  ?  ?  ?  -1.084   ?  ?  ?  
    39  ?  ?  102  ?  N  ?  ?  ?  ?  102  ?  H  ?  ?  ?  -3.033   ?  ?  ?  
    40  ?  ?  103  ?  N  ?  ?  ?  ?  103  ?  H  ?  ?  ?  -1.034   ?  ?  ?  
    41  ?  ?  104  ?  N  ?  ?  ?  ?  104  ?  H  ?  ?  ?  5.969    ?  ?  ?  
    42  ?  ?  105  ?  N  ?  ?  ?  ?  105  ?  H  ?  ?  ?  4.87     ?  ?  ?  
    43  ?  ?  107  ?  N  ?  ?  ?  ?  107  ?  H  ?  ?  ?  -8.894   ?  ?  ?  

stop_
###################################################################
#       Chemical Shift Ambiguity Index Value Definitions          #
#                                                                 #
# The values other than 1 are used for those atoms with different #
# chemical shifts that cannot be assigned to stereospecific atoms #
# or to specific residues or chains.                              #
#                                                                 #
#   Index Value            Definition                             #
#                                                                 #
#      1             Unique (including isolated methyl protons,   #
#                         geminal atoms, and geminal methyl       #
#                         groups with identical chemical shifts)  #
#                         (e.g. ILE HD11, HD12, HD13 protons)     #
#      2             Ambiguity of geminal atoms or geminal methyl #
#                         proton groups (e.g. ASP HB2 and HB3     #
#                         protons, LEU CD1 and CD2 carbons, or    #
#                         LEU HD11, HD12, HD13 and HD21, HD22,    #
#                         HD23 methyl protons)                    #
#      3             Aromatic atoms on opposite sides of          #
#                         symmetrical rings (e.g. TYR HE1 and HE2 #
#                         protons)                                #
#      4             Intraresidue ambiguities (e.g. LYS HG and    #
#                         HD protons or TRP HZ2 and HZ3 protons)  #
#      5             Interresidue ambiguities (LYS 12 vs. LYS 27) #
#      6             Intermolecular ambiguities (e.g. ASP 31 CA   #
#                         in monomer 1 and ASP 31 CA in monomer 2 #
#                         of an asymmetrical homodimer, duplex    #
#                         DNA assignments, or other assignments   #
#                         that may apply to atoms in one or more  #
#                         molecule in the molecular assembly)     #
#      9             Ambiguous, specific ambiguity not defined    #
#                                                                 #
###################################################################
loop_
    _RDC.ID
    _RDC.RDC_code
    _RDC.Entity_assembly_ID_1
    _RDC.Comp_index_ID_1
    _RDC.Comp_ID_1
    _RDC.Atom_ID_1
    _RDC.Atom_type_1
    _RDC.Atom_isotope_number_1
    _RDC.Ambiguity_code_1
    _RDC.Entity_assembly_ID_2
    _RDC.Comp_index_ID_2
    _RDC.Comp_ID_2
    _RDC.Atom_ID_2
    _RDC.Atom_type_2
    _RDC.Atom_isotope_number_2
    _RDC.Ambiguity_code_2
    _RDC.Val
    _RDC.Val_min
    _RDC.Val_max
    _RDC.Val_err

    1   ?  ?  6    G  N  ?  ?  ?  ?  6    G  H  ?  ?  ?  -16.359  ?  ?  ?  
    2   ?  ?  8    Y  N  ?  ?  ?  ?  8    Y  H  ?  ?  ?  -24.536  ?  ?  ?  
    3   ?  ?  11   S  N  ?  ?  ?  ?  11   S  H  ?  ?  ?  -14.659  ?  ?  ?  
    4   ?  ?  14   P  N  ?  ?  ?  ?  14   P  H  ?  ?  ?  2.522    ?  ?  ?  
    5   ?  ?  15   N  N  ?  ?  ?  ?  15   N  H  ?  ?  ?  23.209   ?  ?  ?  
    6   ?  ?  17   P  N  ?  ?  ?  ?  17   P  H  ?  ?  ?  -0.53    ?  ?  ?  
    7   ?  ?  20   G  N  ?  ?  ?  ?  20   G  H  ?  ?  ?  -33.541  ?  ?  ?  
    8   ?  ?  21   R  N  ?  ?  ?  ?  21   R  H  ?  ?  ?  -15.278  ?  ?  ?  
    9   ?  ?  22   L  N  ?  ?  ?  ?  22   L  H  ?  ?  ?  -29.092  ?  ?  ?  
    10  ?  ?  23   E  N  ?  ?  ?  ?  23   E  H  ?  ?  ?  -6.454   ?  ?  ?  
    11  ?  ?  25   G  N  ?  ?  ?  ?  25   G  H  ?  ?  ?  -14.937  ?  ?  ?  
    12  ?  ?  30   A  N  ?  ?  ?  ?  30   A  H  ?  ?  ?  20.031   ?  ?  ?  
    13  ?  ?  31   I  N  ?  ?  ?  ?  31   I  H  ?  ?  ?  31.402   ?  ?  ?  
    14  ?  ?  32   D  N  ?  ?  ?  ?  32   D  H  ?  ?  ?  -4.36    ?  ?  ?  
    15  ?  ?  33   G  N  ?  ?  ?  ?  33   G  H  ?  ?  ?  -1.019   ?  ?  ?  
    16  ?  ?  35   P  N  ?  ?  ?  ?  35   P  H  ?  ?  ?  -16.295  ?  ?  ?  
    17  ?  ?  37   N  N  ?  ?  ?  ?  37   N  H  ?  ?  ?  -20.18   ?  ?  ?  
    18  ?  ?  38   T  N  ?  ?  ?  ?  38   T  H  ?  ?  ?  -13.684  ?  ?  ?  
    19  ?  ?  39   S  N  ?  ?  ?  ?  39   S  H  ?  ?  ?  -27.602  ?  ?  ?  
    20  ?  ?  40   E  N  ?  ?  ?  ?  40   E  H  ?  ?  ?  -28.243  ?  ?  ?  
    21  ?  ?  42   I  N  ?  ?  ?  ?  42   I  H  ?  ?  ?  -24.412  ?  ?  ?  
    22  ?  ?  43   V  N  ?  ?  ?  ?  43   V  H  ?  ?  ?  12.058   ?  ?  ?  
    23  ?  ?  51   A  N  ?  ?  ?  ?  51   A  H  ?  ?  ?  -4.548   ?  ?  ?  
    24  ?  ?  52   G  N  ?  ?  ?  ?  52   G  H  ?  ?  ?  -17.519  ?  ?  ?  
    25  ?  ?  53   D  N  ?  ?  ?  ?  53   D  H  ?  ?  ?  -27.954  ?  ?  ?  
    26  ?  ?  54   R  N  ?  ?  ?  ?  54   R  H  ?  ?  ?  -18.085  ?  ?  ?  
    27  ?  ?  56   R  N  ?  ?  ?  ?  56   R  H  ?  ?  ?  -16.714  ?  ?  ?  
    28  ?  ?  57   V  N  ?  ?  ?  ?  57   V  H  ?  ?  ?  21.387   ?  ?  ?  
    29  ?  ?  61   R  N  ?  ?  ?  ?  61   R  H  ?  ?  ?  12.598   ?  ?  ?  
    30  ?  ?  62   D  N  ?  ?  ?  ?  62   D  H  ?  ?  ?  -17.416  ?  ?  ?  
    31  ?  ?  63   R  N  ?  ?  ?  ?  63   R  H  ?  ?  ?  -2.213   ?  ?  ?  
    32  ?  ?  64   K  N  ?  ?  ?  ?  64   K  H  ?  ?  ?  -19.627  ?  ?  ?  
    33  ?  ?  65   Q  N  ?  ?  ?  ?  65   Q  H  ?  ?  ?  -19.353  ?  ?  ?  
    34  ?  ?  68   A  N  ?  ?  ?  ?  68   A  H  ?  ?  ?  -11.772  ?  ?  ?  
    35  ?  ?  69   E  N  ?  ?  ?  ?  69   E  H  ?  ?  ?  -31.13   ?  ?  ?  
    36  ?  ?  70   L  N  ?  ?  ?  ?  70   L  H  ?  ?  ?  -22.751  ?  ?  ?  
    37  ?  ?  72   L  N  ?  ?  ?  ?  72   L  H  ?  ?  ?  -13.569  ?  ?  ?  
    38  ?  ?  85   G  N  ?  ?  ?  ?  85   G  H  ?  ?  ?  -10.017  ?  ?  ?  
    39  ?  ?  86   V  N  ?  ?  ?  ?  86   V  H  ?  ?  ?  -18.74   ?  ?  ?  
    40  ?  ?  91   H  N  ?  ?  ?  ?  91   H  H  ?  ?  ?  -22.997  ?  ?  ?  
    41  ?  ?  93   H  N  ?  ?  ?  ?  93   H  H  ?  ?  ?  -12.329  ?  ?  ?  
    42  ?  ?  100  ?  N  ?  ?  ?  ?  100  ?  H  ?  ?  ?  -2.632   ?  ?  ?  
    43  ?  ?  101  ?  N  ?  ?  ?  ?  101  ?  H  ?  ?  ?  -2.087   ?  ?  ?  
    44  ?  ?  102  ?  N  ?  ?  ?  ?  102  ?  H  ?  ?  ?  -4.169   ?  ?  ?  
    45  ?  ?  103  ?  N  ?  ?  ?  ?  103  ?  H  ?  ?  ?  -1.511   ?  ?  ?  
    46  ?  ?  104  ?  N  ?  ?  ?  ?  104  ?  H  ?  ?  ?  7.252    ?  ?  ?  
    47  ?  ?  105  ?  N  ?  ?  ?  ?  105  ?  H  ?  ?  ?  5.81     ?  ?  ?  
    48  ?  ?  106  ?  N  ?  ?  ?  ?  106  ?  H  ?  ?  ?  -8.079   ?  ?  ?  
    49  ?  ?  107  ?  N  ?  ?  ?  ?  107  ?  H  ?  ?  ?  -20.824  ?  ?  ?  
    50  ?  ?  108  ?  N  ?  ?  ?  ?  108  ?  H  ?  ?  ?  -32.076  ?  ?  ?  
    51  ?  ?  109  ?  N  ?  ?  ?  ?  109  ?  H  ?  ?  ?  -29.442  ?  ?  ?  
    52  ?  ?  110  ?  N  ?  ?  ?  ?  110  ?  H  ?  ?  ?  -31.942  ?  ?  ?  
    53  ?  ?  112  ?  N  ?  ?  ?  ?  112  ?  H  ?  ?  ?  -23.209  ?  ?  ?  

stop_
assign ( resid    2 and name    HA ) ( resid    3 and name    HN )  3.47  1.67  0.00
assign ( resid    2 and name    HN ) ( resid    3 and name    HN )  4.30  2.50  0.50
assign ( resid    2 and name   HB# ) ( resid    3 and name    HN )  4.81  3.01  0.00
assign ( resid    3 and name    HA ) ( resid    3 and name    HG )  3.78  1.98  0.00
assign ( resid    3 and name    HA ) ( resid    3 and name   HD# )  3.29  1.49  0.00
assign ( resid    3 and name    HA ) ( resid    4 and name   HD1 )  3.51  1.71  0.00
assign ( resid    3 and name    HA ) ( resid    4 and name   HD2 )  3.71  1.91  0.00
assign ( resid    3 and name    HA ) ( resid    4 and name   HG# )  4.59  2.79  0.00
assign ( resid    3 and name    HG ) ( resid    4 and name   HD1 )  3.96  2.16  1.00
assign ( resid    3 and name    HG ) ( resid    4 and name   HD2 )  3.91  2.11  0.50
assign ( resid    3 and name    HG ) ( resid    5 and name    HN )  5.96  4.16  0.00
assign ( resid    3 and name    HN ) ( resid    3 and name   HB# )  3.26  1.46  0.00
assign ( resid    3 and name    HN ) ( resid    3 and name   HD# )  4.58  2.78  0.00
assign ( resid    3 and name    HN ) ( resid    4 and name   HD1 )  5.30  3.50  0.00
assign ( resid    3 and name    HN ) ( resid    4 and name   HD2 )  5.78  3.98  0.00
assign ( resid    3 and name   HB# ) ( resid    5 and name    HN )  3.30  1.50  0.00
assign ( resid    3 and name   HB1 ) ( resid    4 and name   HD1 )  4.22  2.42  0.00
assign ( resid    3 and name   HB2 ) ( resid    4 and name   HD1 )  4.22  2.42  1.00 !C4V975 +1
assign ( resid    3 and name   HD# ) ( resid    4 and name   HD1 )  4.03  2.23  0.50
assign ( resid    3 and name   HD# ) ( resid    4 and name   HD2 )  4.49  2.69  0.00
assign ( resid    3 and name   HD# ) ( resid    4 and name   HG# )  5.57  3.77  0.00
assign ( resid    3 and name   HD# ) ( resid    5 and name    HN )  5.92  4.12  0.00
assign ( resid    4 and name    HA ) ( resid   23 and name   HB# )  3.41  1.61  0.50
assign ( resid    4 and name    HA ) ( resid   23 and name   HD# )  4.02  2.22  0.20
assign ( resid    4 and name   HB2 ) ( resid  108 and name   HB# )  4.35  2.55  0.00
assign ( resid    4 and name   HB2 ) ( resid  108 and name   HD# )  4.26  2.46  0.00
assign ( resid    4 and name   HB2 ) ( resid  109 and name    HN )  5.34  3.54  0.00
assign ( resid    4 and name   HD1 ) ( resid    5 and name    HN )  4.10  2.30  0.00
assign ( resid    4 and name   HD1 ) ( resid    5 and name  HD1# )  4.43  2.63  1.50 !+1.0
assign ( resid    4 and name   HD1 ) ( resid  108 and name   HB# )  4.80  3.00  0.50
assign ( resid    4 and name   HD1 ) ( resid  108 and name   HD# )  4.12  2.32  1.00 !C3 +1
assign ( resid    4 and name   HD# ) ( resid  109 and name    HN )  6.00  4.20  0.00
assign ( resid    4 and name   HD2 ) ( resid    5 and name    HN )  4.73  2.93  0.00
assign ( resid    4 and name   HG# ) ( resid    5 and name    HN )  3.77  1.97  0.00
assign ( resid    4 and name   HG# ) ( resid  108 and name   HB# )  4.57  2.77  0.00
assign ( resid    5 and name    HA ) ( resid    5 and name  HD1# )  3.68  1.88  0.50
assign ( resid    5 and name    HA ) ( resid    5 and name  HG2# )  3.67  1.87  0.00
assign ( resid    5 and name    HA ) ( resid    6 and name    HN )  3.03  1.23  0.00
assign ( resid    5 and name    HA ) ( resid   23 and name   HG# )  4.26  2.46  0.00
assign ( resid    5 and name    HB ) ( resid  109 and name    HA )  4.73  2.93  0.30
assign ( resid    5 and name    HN ) ( resid    5 and name    HB )  4.07  2.27  0.00
assign ( resid    5 and name    HN ) ( resid    5 and name  HD1# )  3.94  2.14  0.00
assign ( resid    5 and name    HN ) ( resid    5 and name  HG2# )  4.19  2.39  0.00
assign ( resid    5 and name    HN ) ( resid    6 and name    HN )  4.66  2.86  0.00
assign ( resid    5 and name    HN ) ( resid   23 and name   HG# )  5.50  3.70  0.00
assign ( resid    5 and name    HN ) ( resid  110 and name   HD# )  4.92  3.12  0.00
assign ( resid    5 and name  HD1# ) ( resid    6 and name    HN )  4.11  2.31  1.00
assign ( resid    5 and name  HD1# ) ( resid   89 and name    HA )  4.42  2.62  0.00
assign ( resid    5 and name  HD1# ) ( resid   90 and name    HA )  3.95  2.15  1.50  !+1.0
assign ( resid    5 and name  HD1# ) ( resid   90 and name    HN )  3.80  2.00  0.50
assign ( resid    5 and name  HD1# ) ( resid  108 and name   HB1 )  4.01  2.21  0.00
assign ( resid  115 and name   HB# ) ( resid  116 and name    HN )  3.62  1.82  0.00
assign ( resid    5 and name  HD1# ) ( resid  108 and name   HB2 )  4.01  2.21  0.00
assign ( resid    5 and name  HD1# ) ( resid  108 and name   HD# )  4.63  2.83  0.00
assign ( resid    5 and name  HD1# ) ( resid  109 and name    HA )  4.27  2.47  0.00
assign ( resid    5 and name  HD1# ) ( resid  109 and name    HN )  4.51  2.71  0.00
assign ( resid    5 and name  HG1# ) ( resid   22 and name    HA )  4.46  2.66  0.00
assign ( resid    5 and name  HG2# ) ( resid    6 and name    HA )  4.27  2.47  0.00
assign ( resid    5 and name  HG2# ) ( resid    6 and name    HN )  3.64  1.84  0.00
assign ( resid    5 and name  HG2# ) ( resid    7 and name    HN )  4.64  2.84  0.00
assign ( resid    5 and name  HG2# ) ( resid    7 and name   HD# )  3.83  2.03  0.00
assign ( resid    5 and name  HG2# ) ( resid   21 and name   HB# )  5.81  4.01  0.00
assign ( resid    5 and name  HG2# ) ( resid  110 and name   HD# )  4.00  2.20  0.00
assign ( resid    6 and name    HA ) ( resid    6 and name  HG2# )  3.22  1.42  0.00
assign ( resid    6 and name    HA ) ( resid    7 and name    HN )  3.16  1.36  0.00
assign ( resid    6 and name    HA ) ( resid    7 and name   HB# )  5.46  3.66  0.00
assign ( resid    6 and name    HA ) ( resid  110 and name   HD# )  5.32  3.52  0.00
assign ( resid    6 and name    HB ) ( resid    7 and name    HN )  3.48  1.68  0.80
assign ( resid    6 and name    HB ) ( resid    7 and name   HB# )  5.43  3.63  0.50
assign ( resid    6 and name    HN ) ( resid    6 and name  HG2# )  3.73  1.93  0.50
assign ( resid    6 and name    HN ) ( resid    7 and name    HN )  4.59  2.79  0.00
assign ( resid    6 and name    HN ) ( resid   21 and name    HA )  5.45  3.65  0.00
assign ( resid    6 and name    HN ) ( resid   21 and name   HB1 )  5.01  3.21  0.00
assign ( resid    6 and name    HN ) ( resid   21 and name   HB2 )  5.01  3.21  0.80
assign ( resid    6 and name    HN ) ( resid   22 and name    HA )  4.63  2.83  0.00
assign ( resid    6 and name    HN ) ( resid   23 and name   HG# )  4.37  2.57  1.00 !+1.0
assign ( resid    6 and name  HG2# ) ( resid    7 and name    HN )  3.66  1.86  1.00 !C4V975 +1
assign ( resid    7 and name    HA ) ( resid    7 and name   HD# )  3.39  1.59  0.00
assign ( resid    7 and name    HA ) ( resid    8 and name    HN )  3.22  1.42  0.00
assign ( resid    7 and name    HA ) ( resid   18 and name  HD1# )  4.50  2.70  1.00
assign ( resid    7 and name    HA ) ( resid   20 and name    HA )  3.96  2.16  0.00
assign ( resid    7 and name    HA ) ( resid   21 and name    HN )  4.10  2.30  0.00
assign ( resid    7 and name    HG ) ( resid   20 and name    HA )  4.09  2.29  1.50 !+1.0
assign ( resid    7 and name    HG ) ( resid  110 and name   HD# )  4.23  2.43  0.50
assign ( resid    7 and name    HN ) ( resid    7 and name    HG )  4.72  2.92  0.00
assign ( resid    7 and name    HN ) ( resid    7 and name   HB# )  3.27  1.47  0.00
assign ( resid    7 and name    HN ) ( resid    7 and name   HD# )  3.92  2.12  0.00
assign ( resid    7 and name   HB# ) ( resid    8 and name    HN )  3.63  1.83  0.00
assign ( resid    7 and name   HB# ) ( resid   18 and name  HD1# )  3.76  1.96  0.00
assign ( resid    7 and name   HB# ) ( resid   20 and name    HA )  5.65  3.85  0.00
assign ( resid    7 and name   HB# ) ( resid   21 and name    HN )  5.17  3.37  0.50
assign ( resid    7 and name   HD# ) ( resid    8 and name    HN )  3.89  2.09  1.00
assign ( resid    7 and name   HD# ) ( resid   18 and name    HB )  4.66  2.86  0.00
assign ( resid    7 and name   HD# ) ( resid   20 and name    HA )  3.47  1.67  0.00
assign ( resid    7 and name   HD# ) ( resid   20 and name   HG# )  3.94  2.14  0.00
assign ( resid    7 and name   HD# ) ( resid   21 and name    HN )  3.88  2.08  0.50
assign ( resid    7 and name   HD# ) ( resid  110 and name   HD# )  5.06  3.26  0.00
assign ( resid    8 and name    HA ) ( resid   19 and name    HB )  5.15  3.35  0.00
assign ( resid    8 and name    HA ) ( resid   19 and name    HN )  5.56  3.76  0.40
assign ( resid    8 and name    HN ) ( resid   18 and name    HA )  5.39  3.59  0.00
assign ( resid    8 and name    HN ) ( resid   18 and name    HB )  4.42  2.62  0.00
assign ( resid    8 and name    HN ) ( resid   18 and name  HD1# )  4.13  2.33  1.00 !C3 +0.5
assign ( resid    8 and name    HN ) ( resid   19 and name    HB )  4.22  2.42  0.00
assign ( resid    8 and name    HN ) ( resid   19 and name    HN )  3.99  2.19  0.00
assign ( resid    8 and name    HN ) ( resid   20 and name    HA )  4.29  2.49  0.50
assign ( resid    8 and name    HN ) ( resid   21 and name    HN )  5.07  3.27  0.90
assign ( resid    9 and name    HA ) ( resid   10 and name    HN )  3.06  1.26  0.00
assign ( resid    9 and name    HA ) ( resid   11 and name    HN )  4.68  2.88  0.00
assign ( resid    9 and name   HB# ) ( resid   10 and name    HN )  3.87  2.07  0.50
assign ( resid    9 and name   HB# ) ( resid   11 and name    HN )  4.52  2.72  0.50
assign ( resid    9 and name   HB# ) ( resid   18 and name    HA )  4.39  2.59  1.00
assign ( resid    9 and name   HB# ) ( resid   18 and name    HB )  4.32  2.52  0.00
assign ( resid    9 and name   HB# ) ( resid   18 and name  HG2# )  3.02  1.22  0.50
assign ( resid    9 and name   HB# ) ( resid   19 and name    HN )  4.65  2.85  1.00
assign ( resid   10 and name    HA ) ( resid   10 and name   HG# )  4.08  2.28  0.00
assign ( resid   10 and name    HN ) ( resid   10 and name   HB# )  3.07  1.27  0.00
assign ( resid   10 and name    HN ) ( resid   10 and name   HG# )  3.63  1.83  0.50
assign ( resid   10 and name    HN ) ( resid   11 and name    HA )  5.54  3.74  0.00
assign ( resid   10 and name    HN ) ( resid   11 and name    HN )  3.41  1.61  0.00
assign ( resid   10 and name   HB# ) ( resid   11 and name    HN )  3.81  2.01  0.00
assign ( resid   10 and name   HG# ) ( resid   11 and name  HG2# )  3.66  1.86  0.50
assign ( resid   11 and name    HA ) ( resid   11 and name  HG2# )  3.44  1.64  0.00
assign ( resid   11 and name    HA ) ( resid   12 and name   HD# )  3.95  2.15  0.00
assign ( resid   11 and name    HN ) ( resid   11 and name  HG2# )  3.90  2.10  0.00
assign ( resid   11 and name    HN ) ( resid   12 and name   HD# )  4.66  2.86  0.00
assign ( resid   12 and name    HA ) ( resid   13 and name    HN )  3.19  1.39  0.00
assign ( resid   12 and name    HA ) ( resid   13 and name   HB# )  5.06  3.26  0.00
assign ( resid   12 and name    HA ) ( resid  114 and name    HB )  3.36  1.56  2.00
assign ( resid   12 and name    HA ) ( resid  114 and name   HG# )  4.22  2.42  0.00
assign ( resid   12 and name   HB# ) ( resid   13 and name    HN )  4.07  2.27  0.00
assign ( resid   12 and name   HB# ) ( resid  114 and name    HA )  4.38  2.58  0.00
assign ( resid   13 and name    HA ) ( resid   14 and name    HN )  3.19  1.39  0.00
assign ( resid   13 and name    HA ) ( resid   14 and name   HB# )  4.60  2.80  0.00
assign ( resid   13 and name    HA ) ( resid  115 and name    HN )  5.05  3.25  0.00
assign ( resid   13 and name    HN ) ( resid   13 and name   HB# )  3.35  1.55  0.00
assign ( resid   13 and name    HN ) ( resid   13 and name   HD# )  4.48  2.68  0.00
assign ( resid   13 and name    HN ) ( resid   14 and name    HN )  4.43  2.63  0.00
assign ( resid   13 and name    HN ) ( resid  114 and name    HB )  4.34  2.54  1.00
assign ( resid   13 and name    HN ) ( resid  114 and name   HG# )  4.56  2.76  0.00
assign ( resid   13 and name   HB# ) ( resid   14 and name    HN )  4.09  2.29  0.00
assign ( resid   13 and name   HB# ) ( resid   16 and name    HN )  5.13  3.33  0.00
assign ( resid   13 and name   HB# ) ( resid   16 and name   HB# )  4.43  2.63  0.00
assign ( resid   14 and name    HA ) ( resid   15 and name    HN )  3.21  1.41  0.00
assign ( resid   14 and name    HA ) ( resid   16 and name    HN )  4.17  2.37  0.00
assign ( resid   14 and name    HA ) ( resid  114 and name   HG# )  3.97  2.17  0.00
assign ( resid   14 and name    HN ) ( resid   14 and name   HB# )  3.26  1.46  0.00
assign ( resid   14 and name    HN ) ( resid   14 and name   HG# )  4.17  2.37  0.00
assign ( resid   14 and name    HN ) ( resid   15 and name    HN )  4.98  3.18  0.00
assign ( resid   14 and name    HN ) ( resid  114 and name   HG# )  4.16  2.36  0.00
assign ( resid   14 and name    HN ) ( resid  115 and name    HN )  4.22  2.42  1.50
assign ( resid   14 and name   HB# ) ( resid   15 and name    HN )  4.47  2.67  0.50
assign ( resid   14 and name   HG# ) ( resid  114 and name   HG# )  4.88  3.08  0.00
assign ( resid   15 and name    HN ) ( resid   16 and name    HN )  3.65  1.85  0.00
assign ( resid   15 and name    HN ) ( resid   73 and name    HN )  4.21  2.41  0.80
assign ( resid   15 and name    HN ) ( resid   73 and name   HB# )  4.07  2.27  0.00
assign ( resid   15 and name    HN ) ( resid  114 and name   HG# )  5.54  3.74  0.00
assign ( resid   15 and name   HA1 ) ( resid   72 and name   HG# )  4.67  2.87  0.50
assign ( resid   15 and name   HA1 ) ( resid   73 and name    HN )  5.06  3.26  0.50
assign ( resid   16 and name    HA ) ( resid   17 and name    HN )  2.89  1.09  0.00
assign ( resid   16 and name    HA ) ( resid   17 and name   HG# )  5.12  3.32  0.50 !+0.5
assign ( resid   16 and name    HN ) ( resid   16 and name   HB# )  3.29  1.49  0.00
assign ( resid   16 and name    HN ) ( resid   17 and name    HN )  4.75  2.95  0.00
assign ( resid   16 and name    HN ) ( resid   73 and name    HN )  4.44  2.64  0.50
assign ( resid   16 and name   HB1 ) ( resid   17 and name    HN )  4.07  2.27  0.50
assign ( resid   16 and name   HB2 ) ( resid   17 and name    HN )  4.07  2.27  1.00
assign ( resid   17 and name    HA ) ( resid   17 and name   HG# )  3.94  2.14  0.00
assign ( resid   17 and name    HA ) ( resid   18 and name    HN )  3.18  1.38  0.00
assign ( resid   17 and name    HA ) ( resid   72 and name    HA )  3.46  1.66  0.00
assign ( resid   17 and name    HA ) ( resid   73 and name    HN )  3.85  2.05  0.00
assign ( resid   17 and name    HN ) ( resid   17 and name   HB# )  3.11  1.31  0.00
assign ( resid   17 and name    HN ) ( resid   17 and name   HG# )  4.17  2.37  0.00
assign ( resid   17 and name    HN ) ( resid   18 and name    HN )  4.49  2.69  0.00
assign ( resid   17 and name    HN ) ( resid   73 and name    HN )  5.00  3.20  0.60
assign ( resid   17 and name   HG# ) ( resid   18 and name    HN )  3.81  2.01  0.00
assign ( resid   17 and name   HG# ) ( resid   71 and name    HN )  3.57  1.77  0.00
assign ( resid   17 and name   HG# ) ( resid   72 and name    HA )  4.36  2.56  0.00
assign ( resid   17 and name   HG# ) ( resid   72 and name    HN )  4.07  2.27  0.00
assign ( resid   18 and name    HA ) ( resid   18 and name  HD1# )  4.06  2.26  0.00
assign ( resid   18 and name    HA ) ( resid   18 and name  HG2# )  3.44  1.64  0.00
assign ( resid   18 and name    HA ) ( resid   19 and name    HN )  3.42  1.62  0.00
assign ( resid   18 and name    HB ) ( resid   18 and name  HD1# )  3.49  1.69  0.00
assign ( resid   18 and name    HB ) ( resid   19 and name    HA )  4.77  2.97  0.00
assign ( resid   18 and name    HB ) ( resid   19 and name    HN )  3.58  1.78  0.00
assign ( resid   18 and name    HB ) ( resid   71 and name    HN )  5.67  3.87  0.00
assign ( resid   18 and name    HN ) ( resid   18 and name  HD1# )  4.29  2.49  0.00
assign ( resid   18 and name    HN ) ( resid   18 and name  HG2# )  3.95  2.15  0.00
assign ( resid   18 and name    HN ) ( resid   19 and name    HN )  5.09  3.29  0.00
assign ( resid   18 and name    HN ) ( resid   72 and name    HA )  4.06  2.26  0.00
assign ( resid   18 and name    HN ) ( resid   73 and name    HN )  4.63  2.83  0.00
assign ( resid   18 and name  HD1# ) ( resid   19 and name    HN )  4.16  2.36  0.50
assign ( resid   18 and name  HD1# ) ( resid   20 and name    HA )  4.54  2.74  1.00
assign ( resid   18 and name  HD1# ) ( resid   71 and name    HN )  4.80  3.00  0.50
assign ( resid   18 and name  HD1# ) ( resid   71 and name   HB1 )  4.69  2.89  0.00
assign ( resid   18 and name  HD1# ) ( resid   71 and name   HB2 )  4.25  2.45  1.00
assign ( resid   18 and name  HD1# ) ( resid   71 and name   HE3 )  3.64  1.84  0.00
assign ( resid   18 and name  HG2# ) ( resid   19 and name    HN )  4.01  2.21  0.00
assign ( resid   18 and name  HG2# ) ( resid   71 and name    HN )  5.59  3.79  0.00
assign ( resid   19 and name    HA ) ( resid   19 and name  HG2# )  3.35  1.55  0.00
assign ( resid   19 and name    HA ) ( resid   20 and name    HN )  3.32  1.52  0.00
assign ( resid   19 and name    HA ) ( resid   69 and name    HN )  4.70  2.90  0.00
assign ( resid   19 and name    HB ) ( resid   20 and name    HN )  5.02  3.22  0.00
assign ( resid   19 and name    HN ) ( resid   19 and name    HB )  3.81  2.01  0.00
assign ( resid   19 and name  HG2# ) ( resid   20 and name    HN )  3.60  1.80  0.00
assign ( resid   19 and name  HG2# ) ( resid   21 and name    HN )  6.00  4.20  0.00
assign ( resid   19 and name  HG2# ) ( resid   68 and name    HA )  4.38  2.58  0.00
assign ( resid   19 and name  HG2# ) ( resid   68 and name   HD# )  3.68  1.88  0.00
assign ( resid   19 and name  HG2# ) ( resid   69 and name    HN )  3.99  2.19  0.00
assign ( resid   20 and name    HA ) ( resid   20 and name  HG1# )  3.58  1.78  0.00
assign ( resid   20 and name    HA ) ( resid   20 and name  HG2# )  3.58  1.78  0.00
assign ( resid   20 and name    HA ) ( resid   21 and name    HN )  3.08  1.28  0.00
assign ( resid   20 and name    HB ) ( resid   21 and name    HN )  4.74  2.94  0.00
assign ( resid   20 and name    HB ) ( resid   39 and name   HG# )  3.09  1.29  0.50
assign ( resid   20 and name    HB ) ( resid   69 and name    HN )  4.28  2.48  0.00
assign ( resid   20 and name    HN ) ( resid   20 and name    HB )  3.68  1.88  0.00
assign ( resid   20 and name    HN ) ( resid   20 and name   HG# )  3.72  1.92  0.00
assign ( resid   20 and name    HN ) ( resid   69 and name    HN )  3.81  2.01  0.00
assign ( resid   20 and name    HN ) ( resid   69 and name   HG# )  4.28  2.48  0.00
assign ( resid   20 and name    HN ) ( resid   70 and name    HN )  5.25  3.45  0.00
assign ( resid   20 and name    HN ) ( resid   71 and name    HN )  4.74  2.94  0.00
assign ( resid   20 and name   HG# ) ( resid   71 and name    HN )  5.82  4.02  0.00
assign ( resid   20 and name   HG# ) ( resid   71 and name   HB1 )  4.36  2.56  0.00
assign ( resid   20 and name   HG# ) ( resid   71 and name   HB2 )  3.79  1.99  0.00
assign ( resid   20 and name   HG# ) ( resid   71 and name   HE3 )  4.09  2.29  0.00
assign ( resid   21 and name    HA ) ( resid   22 and name    HN )  3.05  1.25  0.00
assign ( resid   21 and name    HA ) ( resid   22 and name   HB# )  4.45  2.65  0.00
assign ( resid   21 and name    HA ) ( resid   66 and name  HD1# )  5.75  3.95  0.50
assign ( resid   21 and name    HA ) ( resid   66 and name  HD2# )  5.75  3.95  0.00
assign ( resid   21 and name    HA ) ( resid   67 and name    HN )  4.83  3.03  0.00
assign ( resid   21 and name    HA ) ( resid   68 and name    HA )  3.88  2.08  0.00
assign ( resid   21 and name    HA ) ( resid   68 and name   HG# )  6.00  4.20  0.00
assign ( resid   21 and name    HA ) ( resid   69 and name    HN )  4.26  2.46  0.00
assign ( resid   21 and name    HN ) ( resid   21 and name   HB1 )  4.16  2.36  1.00
assign ( resid   21 and name    HN ) ( resid   21 and name   HB2 )  4.16  2.36  1.00
assign ( resid   21 and name   HB1 ) ( resid   22 and name    HN )  4.44  2.64  0.00
assign ( resid   21 and name   HB1 ) ( resid   66 and name  HD1# )  4.95  3.15  0.00
assign ( resid   21 and name   HB1 ) ( resid   66 and name  HD2# )  4.95  3.15  0.00
assign ( resid   21 and name   HB2 ) ( resid   22 and name    HN )  4.44  2.64  0.00
assign ( resid   21 and name   HB2 ) ( resid   66 and name  HD1# )  4.95  3.15  0.00
assign ( resid   21 and name   HB2 ) ( resid   66 and name  HD2# )  4.95  3.15  0.00
assign ( resid   22 and name    HA ) ( resid   23 and name    HN )  3.16  1.36  0.00
assign ( resid   22 and name    HA ) ( resid   23 and name   HG# )  4.08  2.28  0.00
assign ( resid   22 and name    HN ) ( resid   22 and name   HB# )  3.39  1.59  0.00
assign ( resid   22 and name    HN ) ( resid   23 and name    HN )  4.84  3.04  0.00
assign ( resid   22 and name    HN ) ( resid   66 and name   HD# )  4.12  2.32  0.00
assign ( resid   22 and name    HN ) ( resid   67 and name    HN )  3.69  1.89  0.00
assign ( resid   22 and name    HN ) ( resid   67 and name   HB# )  4.07  2.27  0.00
assign ( resid   22 and name    HN ) ( resid   68 and name    HA )  5.34  3.54  0.00
assign ( resid   22 and name   HB# ) ( resid   23 and name    HN )  3.90  2.10  0.00
assign ( resid   22 and name   HB# ) ( resid   67 and name    HN )  4.43  2.63  0.30
assign ( resid   23 and name    HA ) ( resid   24 and name    HN )  3.08  1.28  0.00
assign ( resid   23 and name    HA ) ( resid   64 and name    HB )  4.88  3.08  0.00
assign ( resid   23 and name    HA ) ( resid   66 and name  HD1# )  3.83  2.03  1.00
assign ( resid   23 and name    HA ) ( resid   66 and name  HD2# )  3.83  2.03  0.00
assign ( resid   23 and name    HN ) ( resid   23 and name   HB# )  3.42  1.62  0.00
assign ( resid   23 and name    HN ) ( resid   23 and name   HD# )  5.09  3.29  0.00
assign ( resid   23 and name    HN ) ( resid   23 and name   HG# )  3.94  2.14  0.00
assign ( resid   23 and name    HN ) ( resid  108 and name   HD# )  5.16  3.36  0.00
assign ( resid   23 and name   HB# ) ( resid   23 and name   HD# )  4.21  2.41  0.00
assign ( resid   23 and name   HB# ) ( resid   64 and name  HG2# )  3.90  2.10  0.50
assign ( resid   23 and name   HB# ) ( resid   66 and name   HD# )  3.96  2.16  0.50
assign ( resid   23 and name   HB# ) ( resid  108 and name   HB# )  5.79  3.99  0.50
assign ( resid   23 and name   HB# ) ( resid  108 and name   HD# )  4.46  2.66  1.50
assign ( resid   23 and name   HD# ) ( resid   64 and name    HB )  5.55  3.75  0.00
assign ( resid   23 and name   HD# ) ( resid   66 and name  HD1# )  4.87  3.07  1.00
assign ( resid   23 and name   HD# ) ( resid   66 and name  HD2# )  4.87  3.07  0.00
assign ( resid   23 and name   HG# ) ( resid   64 and name    HB )  5.00  3.20  0.00
assign ( resid   24 and name    HA ) ( resid   24 and name   HG# )  3.14  1.34  0.00
assign ( resid   24 and name    HA ) ( resid   25 and name    HB )  5.03  3.23  0.00
assign ( resid   24 and name    HA ) ( resid   25 and name    HN )  2.97  1.17  0.00
assign ( resid   24 and name    HB ) ( resid   25 and name    HN )  4.49  2.69  0.00
assign ( resid   24 and name    HB ) ( resid   65 and name    HN )  4.23  2.43  0.00
assign ( resid   24 and name    HN ) ( resid   24 and name    HB )  3.92  2.12  0.00
assign ( resid   24 and name    HN ) ( resid   24 and name   HG# )  3.48  1.68  0.00
assign ( resid   24 and name    HN ) ( resid   56 and name  HD1# )  4.57  2.77  1.00
assign ( resid   24 and name    HN ) ( resid   64 and name  HG2# )  4.16  2.36  1.00
assign ( resid   24 and name    HN ) ( resid   65 and name    HN )  3.85  2.05  0.00
assign ( resid   24 and name    HN ) ( resid   66 and name    HA )  4.32  2.52  0.00
assign ( resid   24 and name    HN ) ( resid   66 and name  HD1# )  5.02  3.22  0.80
assign ( resid   24 and name    HN ) ( resid   66 and name  HD2# )  5.02  3.22  0.00
assign ( resid   24 and name   HG# ) ( resid   25 and name    HN )  3.48  1.68  0.00
assign ( resid   24 and name   HG# ) ( resid   65 and name   HA# )  3.85  2.05  0.00
assign ( resid   24 and name   HG# ) ( resid   66 and name    HN )  3.48  1.68  1.50
assign ( resid   25 and name    HA ) ( resid   25 and name  HG2# )  3.28  1.48  0.00
assign ( resid   25 and name    HA ) ( resid   26 and name    HN )  3.12  1.32  0.00
assign ( resid   25 and name    HA ) ( resid   64 and name    HA )  3.78  1.98  0.00
assign ( resid   25 and name    HA ) ( resid   65 and name    HN )  4.15  2.35  0.00
assign ( resid   25 and name    HB ) ( resid   26 and name    HA )  4.84  3.04  0.50
assign ( resid   25 and name    HB ) ( resid   26 and name    HN )  4.35  2.55  0.00
assign ( resid   25 and name    HB ) ( resid   27 and name   HG# )  4.37  2.57  0.00
assign ( resid   25 and name    HN ) ( resid   25 and name    HB )  3.42  1.62  0.00
assign ( resid   25 and name    HN ) ( resid   25 and name  HG2# )  3.98  2.18  0.00
assign ( resid   25 and name    HN ) ( resid   26 and name    HN )  4.51  2.71  0.00
assign ( resid   25 and name  HG2# ) ( resid   26 and name    HN )  3.41  1.61  0.00
assign ( resid   25 and name  HG2# ) ( resid   27 and name   HD# )  3.65  1.85  0.00
assign ( resid   25 and name  HG2# ) ( resid   27 and name   HG# )  2.97  1.17  0.00
assign ( resid   26 and name    HA ) ( resid   27 and name    HN )  3.36  1.56  0.00
assign ( resid   26 and name    HN ) ( resid   26 and name   HB1 )  3.67  1.87  0.00
assign ( resid   26 and name    HN ) ( resid   26 and name   HB2 )  3.67  1.87  0.00
assign ( resid   26 and name    HN ) ( resid   59 and name  HG2# )  3.93  2.13  0.00
assign ( resid   26 and name    HN ) ( resid   64 and name    HA )  4.02  2.22  0.00
assign ( resid   26 and name    HN ) ( resid   64 and name  HG2# )  3.96  2.16  0.00
assign ( resid   26 and name    HN ) ( resid   65 and name    HN )  5.26  3.46  0.00
assign ( resid   26 and name   HB# ) ( resid   32 and name    HN )  4.80  3.00  0.00
assign ( resid   26 and name   HB# ) ( resid   32 and name   HB# )  4.46  2.66  0.00
assign ( resid   26 and name   HB# ) ( resid   59 and name    HB )  4.17  2.37  0.00
assign ( resid   26 and name   HB# ) ( resid   59 and name  HD1# )  4.91  3.11  0.00
assign ( resid   26 and name   HB# ) ( resid   62 and name    HN )  4.45  2.65  0.00
assign ( resid   26 and name   HB# ) ( resid   63 and name    HN )  4.45  2.65  0.00
assign ( resid   26 and name   HB1 ) ( resid   59 and name  HG2# )  3.97  2.17  0.00
assign ( resid   26 and name   HB2 ) ( resid   59 and name  HG2# )  3.97  2.17  0.00
assign ( resid   27 and name    HA ) ( resid   62 and name    HN )  4.61  2.81  0.30
assign ( resid   27 and name    HN ) ( resid   28 and name    HN )  3.39  1.59  1.00
assign ( resid   27 and name   HB# ) ( resid   28 and name    HN )  4.19  2.39  0.00
assign ( resid   28 and name   HA# ) ( resid   29 and name    HN )  3.10  1.30  0.00
assign ( resid   28 and name   HA# ) ( resid   29 and name   HB# )  4.56  2.76  0.00
assign ( resid   28 and name   HA# ) ( resid   30 and name    HN )  3.87  2.07  0.00
assign ( resid   29 and name    HA ) ( resid   30 and name    HN )  3.52  1.72  0.00
assign ( resid   29 and name    HA ) ( resid   61 and name   HG# )  4.03  2.23  1.00
assign ( resid   29 and name    HN ) ( resid   29 and name   HB# )  3.14  1.34  0.00
assign ( resid   29 and name    HN ) ( resid   30 and name    HN )  3.21  1.41  1.50
assign ( resid   29 and name    HN ) ( resid   30 and name   HB# )  4.81  3.01  0.00
assign ( resid   29 and name   HB# ) ( resid   30 and name    HN )  3.73  1.93  0.00
assign ( resid   30 and name    HA ) ( resid   31 and name    HN )  3.28  1.48  0.00
assign ( resid   30 and name    HA ) ( resid   61 and name   HG# )  3.73  1.93  0.00
assign ( resid   30 and name    HN ) ( resid   30 and name   HB# )  2.93  1.13  0.00
assign ( resid   30 and name    HN ) ( resid   31 and name    HN )  4.86  3.06  0.00
assign ( resid   30 and name    HN ) ( resid   61 and name   HG# )  3.73  1.93  0.00
assign ( resid   30 and name   HB# ) ( resid   31 and name    HA )  4.55  2.75  0.00
assign ( resid   30 and name   HB# ) ( resid   31 and name    HN )  3.53  1.73  0.00
assign ( resid   31 and name    HA ) ( resid   31 and name   HG# )  3.52  1.72  0.00
assign ( resid   31 and name    HA ) ( resid   32 and name    HN )  3.15  1.35  0.00
assign ( resid   31 and name    HA ) ( resid   32 and name   HB# )  4.05  2.25  0.00
assign ( resid   31 and name    HA ) ( resid   60 and name    HA )  3.92  2.12  0.00
assign ( resid   31 and name    HA ) ( resid   60 and name   HB# )  3.96  2.16  1.50
assign ( resid   31 and name    HA ) ( resid   61 and name    HN )  4.17  2.37  0.00
assign ( resid   31 and name    HA ) ( resid   61 and name   HG# )  4.34  2.54  0.00
assign ( resid   31 and name    HN ) ( resid   31 and name   HG# )  3.46  1.66  0.00
assign ( resid   31 and name    HN ) ( resid   32 and name    HN )  4.83  3.03  0.00
assign ( resid   31 and name    HN ) ( resid   61 and name   HG# )  4.04  2.24  0.00
assign ( resid   31 and name   HB# ) ( resid   32 and name   HB# )  4.81  3.01  0.00
assign ( resid   31 and name   HG# ) ( resid   32 and name    HN )  4.18  2.38  0.00
assign ( resid   31 and name   HG# ) ( resid   32 and name    HN )  4.82  3.02  0.00
assign ( resid   32 and name    HA ) ( resid   33 and name    HN )  2.90  1.10  0.00
assign ( resid   32 and name    HN ) ( resid   32 and name   HB# )  3.36  1.56  0.00
assign ( resid   32 and name    HN ) ( resid   33 and name    HA )  5.75  3.95  0.00
assign ( resid   32 and name    HN ) ( resid   33 and name    HN )  4.84  3.04  0.00
assign ( resid   32 and name    HN ) ( resid   35 and name  HG2# )  5.20  3.40  0.00
assign ( resid   32 and name    HN ) ( resid   59 and name    HB )  4.40  2.60  0.50
assign ( resid   32 and name    HN ) ( resid   59 and name    HN )  3.67  1.87  1.50
assign ( resid   32 and name    HN ) ( resid   59 and name  HD1# )  4.98  3.18  1.00
assign ( resid   32 and name    HN ) ( resid   61 and name    HN )  5.04  3.24  0.50
assign ( resid   32 and name   HB# ) ( resid   33 and name    HN )  3.43  1.63  0.00
assign ( resid   32 and name   HB# ) ( resid   59 and name    HB )  3.34  1.54  0.00
assign ( resid   33 and name    HA ) ( resid   33 and name   HD2 )  4.27  2.47  0.50
assign ( resid   33 and name    HA ) ( resid   34 and name    HA )  4.82  3.02  0.00
assign ( resid   33 and name    HA ) ( resid   34 and name    HN )  3.01  1.21  0.00
assign ( resid   33 and name    HA ) ( resid   35 and name    HN )  4.51  2.71  0.00
assign ( resid   33 and name    HN ) ( resid   33 and name   HD2 )  4.89  3.09  1.00
assign ( resid   33 and name   HB# ) ( resid   33 and name   HD2 )  3.86  2.06  0.00
assign ( resid   33 and name   HD2 ) ( resid   58 and name    HA )  4.46  2.66  0.00
assign ( resid   34 and name    HA ) ( resid   35 and name    HN )  3.22  1.42  0.00
assign ( resid   34 and name    HA ) ( resid   55 and name  HG2# )  3.65  1.85  0.00
assign ( resid   34 and name    HN ) ( resid   35 and name    HB )  4.88  3.08  0.50
assign ( resid   34 and name    HN ) ( resid   35 and name    HN )  3.69  1.89  0.00
assign ( resid   34 and name    HN ) ( resid   55 and name  HG2# )  3.81  2.01  1.00 !C3 +0.5
assign ( resid   34 and name   HB# ) ( resid   55 and name  HG2# )  3.77  1.97  0.00
assign ( resid   34 and name   HB1 ) ( resid   35 and name    HN )  4.87  3.07  0.00
assign ( resid   34 and name   HB2 ) ( resid   35 and name    HN )  4.87  3.07  0.00
assign ( resid   35 and name    HA ) ( resid   35 and name  HG1# )  3.19  1.39  0.00
assign ( resid   35 and name    HB ) ( resid   56 and name    HB )  3.79  1.99  0.00
assign ( resid   35 and name    HB ) ( resid   56 and name    HN )  4.22  2.42  0.50
assign ( resid   35 and name    HB ) ( resid   56 and name  HD1# )  3.99  2.19  1.00
assign ( resid   35 and name    HB ) ( resid   56 and name  HG2# )  4.33  2.53  0.50
assign ( resid   35 and name    HN ) ( resid   35 and name    HB )  3.40  1.60  0.00
assign ( resid   35 and name    HN ) ( resid   55 and name  HG2# )  3.03  1.23  0.50
assign ( resid   35 and name    HN ) ( resid   56 and name    HB )  3.71  1.91  0.50
assign ( resid   35 and name    HN ) ( resid   56 and name    HN )  3.74  1.94  0.00
assign ( resid   36 and name    HA ) ( resid   37 and name    HN )  3.10  1.30  0.00
assign ( resid   36 and name    HA ) ( resid   55 and name    HA )  3.69  1.89  0.00
assign ( resid   36 and name    HA ) ( resid   56 and name    HN )  4.23  2.43  0.00
assign ( resid   36 and name    HA ) ( resid   56 and name  HG1# )  4.48  2.68  0.00
assign ( resid   36 and name   HB# ) ( resid   37 and name    HN )  4.02  2.22  0.00
assign ( resid   36 and name   HB# ) ( resid   56 and name    HN )  6.00  4.20  0.00
assign ( resid   36 and name   HG# ) ( resid   93 and name    HA )  4.16  2.36  0.50
assign ( resid   37 and name    HA ) ( resid   37 and name  HG1# )  3.51  1.71  0.00
assign ( resid   37 and name    HA ) ( resid   37 and name  HG2# )  3.51  1.71  0.00
assign ( resid   37 and name    HA ) ( resid   38 and name    HN )  3.16  1.36  0.00
assign ( resid   37 and name    HA ) ( resid   38 and name   HB# )  4.32  2.52  0.00
assign ( resid   37 and name    HA ) ( resid   92 and name    HA )  3.98  2.18  0.00
assign ( resid   37 and name    HA ) ( resid   93 and name    HN )  4.12  2.32  0.00
assign ( resid   37 and name    HB ) ( resid   38 and name    HN )  3.96  2.16  0.00
assign ( resid   37 and name    HB ) ( resid   54 and name    HN )  4.46  2.66  1.00
assign ( resid   37 and name    HB ) ( resid   67 and name   HB# )  3.44  1.64  0.50
assign ( resid   37 and name    HN ) ( resid   37 and name    HB )  3.49  1.69  0.00
assign ( resid   37 and name    HN ) ( resid   37 and name   HG# )  3.49  1.69  0.00
assign ( resid   37 and name    HN ) ( resid   37 and name  HG1# )  4.22  2.42  0.00
assign ( resid   37 and name    HN ) ( resid   37 and name  HG2# )  4.22  2.42  0.00
assign ( resid   37 and name    HN ) ( resid   55 and name    HA )  3.88  2.08  0.50
assign ( resid   37 and name    HN ) ( resid   55 and name    HN )  5.10  3.30  0.50
assign ( resid   37 and name    HN ) ( resid   56 and name    HN )  5.64  3.84  0.00
assign ( resid   37 and name    HN ) ( resid   67 and name   HB# )  4.53  2.73  0.50 !C3 +0.5
assign ( resid   37 and name    HN ) ( resid   93 and name    HN )  5.33  3.53  0.50
assign ( resid   37 and name   HG# ) ( resid   38 and name    HA )  3.93  2.13  0.00
assign ( resid   37 and name   HG# ) ( resid   38 and name    HN )  3.42  1.62  0.00
assign ( resid   37 and name   HG# ) ( resid   38 and name   HB# )  4.23  2.43  0.00
assign ( resid   37 and name   HG# ) ( resid   40 and name   HD# )  5.92  4.12  0.00
assign ( resid   37 and name   HG# ) ( resid   90 and name    HA )  3.97  2.17  0.50
assign ( resid   37 and name   HG# ) ( resid   91 and name    HN )  3.68  1.88  0.00
assign ( resid   37 and name   HG# ) ( resid   92 and name    HA )  3.61  1.81  0.00
assign ( resid   37 and name   HG# ) ( resid   92 and name   HG# )  4.36  2.56  0.00
assign ( resid   37 and name   HG# ) ( resid   93 and name    HN )  4.03  2.23  0.00
assign ( resid   37 and name  HG1# ) ( resid   39 and name    HN )  5.48  3.68  0.00
assign ( resid   37 and name  HG2# ) ( resid   39 and name    HN )  5.48  3.68  0.50
assign ( resid   38 and name    HA ) ( resid   39 and name    HN )  3.04  1.24  0.00
assign ( resid   38 and name    HA ) ( resid   50 and name   HG# )  4.95  3.15  0.00
assign ( resid   38 and name    HA ) ( resid   53 and name    HA )  3.78  1.98  0.50
assign ( resid   38 and name    HA ) ( resid   53 and name   HB1 )  4.51  2.71  0.00
assign ( resid   38 and name    HA ) ( resid   53 and name   HB2 )  4.51  2.71  0.00
assign ( resid   38 and name    HA ) ( resid   53 and name   HG# )  5.22  3.42  0.00
assign ( resid   38 and name    HA ) ( resid   54 and name    HN )  5.14  3.34  0.50
assign ( resid   38 and name    HN ) ( resid   38 and name   HB# )  3.52  1.72  0.00
assign ( resid   38 and name    HN ) ( resid   90 and name    HA )  5.02  3.22  0.80 !C3 +0.5
assign ( resid   38 and name    HN ) ( resid   91 and name    HB )  4.31  2.51  0.50
assign ( resid   38 and name    HN ) ( resid   91 and name    HN )  4.05  2.25  0.00
assign ( resid   38 and name    HN ) ( resid   91 and name   HG# )  3.81  2.01  1.00
assign ( resid   38 and name    HN ) ( resid   92 and name    HA )  4.34  2.54  0.00
assign ( resid   38 and name    HN ) ( resid   93 and name    HN )  4.89  3.09  0.00
assign ( resid   38 and name   HB# ) ( resid   39 and name    HN )  3.64  1.84  0.00
assign ( resid   38 and name   HB# ) ( resid   40 and name   HE# )  3.52  1.72  0.50
assign ( resid   38 and name   HB# ) ( resid   50 and name   HG# )  4.25  2.45  0.00
assign ( resid   38 and name   HB# ) ( resid   91 and name    HB )  3.88  2.08  0.00
assign ( resid   38 and name   HB# ) ( resid   91 and name    HN )  4.54  2.74  0.00
assign ( resid   39 and name    HA ) ( resid   40 and name    HN )  3.47  1.67  0.00
assign ( resid   39 and name    HA ) ( resid   40 and name   HD# )  3.94  2.14  0.00
assign ( resid   39 and name    HA ) ( resid   40 and name   HE# )  4.62  2.82  0.00
assign ( resid   39 and name    HA ) ( resid   90 and name    HA )  3.83  2.03  0.00
assign ( resid   39 and name    HA ) ( resid   90 and name   HB# )  3.82  2.02  0.00
assign ( resid   39 and name    HA ) ( resid   91 and name    HN )  4.17  2.37  0.00
assign ( resid   39 and name    HB ) ( resid   52 and name    HN )  4.67  2.87  0.00
assign ( resid   39 and name    HB ) ( resid   69 and name   HG# )  3.75  1.95  0.00
assign ( resid   39 and name    HB ) ( resid   90 and name    HA )  5.13  3.33  0.50
assign ( resid   39 and name    HN ) ( resid   39 and name    HB )  3.38  1.58  0.00
assign ( resid   39 and name    HN ) ( resid   39 and name   HG# )  3.45  1.65  0.00
assign ( resid   39 and name    HN ) ( resid   39 and name  HG1# )  4.04  2.24  0.00
assign ( resid   39 and name    HN ) ( resid   39 and name  HG2# )  4.04  2.24  0.00
assign ( resid   39 and name    HN ) ( resid   40 and name    HN )  5.09  3.29  0.00
assign ( resid   39 and name    HN ) ( resid   52 and name    HN )  3.90  2.10  0.00
assign ( resid   39 and name    HN ) ( resid   53 and name    HA )  3.97  2.17  0.50
assign ( resid   39 and name    HN ) ( resid   53 and name   HB1 )  4.78  2.98  0.00
assign ( resid   39 and name    HN ) ( resid   53 and name   HB2 )  4.78  2.98  1.00
assign ( resid   39 and name    HN ) ( resid   69 and name   HG# )  4.88  3.08  0.00
assign ( resid   39 and name   HG# ) ( resid   40 and name    HN )  3.67  1.87  0.00
assign ( resid   39 and name   HG# ) ( resid   51 and name  HD1# )  3.56  1.76  0.00
assign ( resid   39 and name   HG# ) ( resid   52 and name    HN )  3.98  2.18  0.50
assign ( resid   39 and name   HG# ) ( resid   69 and name    HB )  3.10  1.30  1.00
assign ( resid   39 and name   HG# ) ( resid   91 and name    HN )  3.87  2.07  0.50
assign ( resid   39 and name   HG# ) ( resid   53 and name    HA )  4.79  2.99  1.00 !+0.5 C3 +1
assign ( resid   40 and name    HA ) ( resid   41 and name    HN )  3.40  1.60  0.00
assign ( resid   40 and name    HA ) ( resid   50 and name    HA )  3.83  2.03  0.00
assign ( resid   40 and name    HA ) ( resid   51 and name    HN )  4.09  2.29  0.00
assign ( resid   40 and name    HA ) ( resid   51 and name  HD1# )  4.38  2.58  0.00
assign ( resid   40 and name    HA ) ( resid   52 and name    HN )  4.84  3.04  0.50
assign ( resid   40 and name    HN ) ( resid   40 and name   HB# )  4.05  2.25  0.00
assign ( resid   40 and name    HN ) ( resid   40 and name   HD# )  4.15  2.35  0.00
assign ( resid   40 and name    HN ) ( resid   40 and name   HE# )  4.66  2.86  0.00
assign ( resid   40 and name    HN ) ( resid   51 and name  HD1# )  5.24  3.44  0.00
assign ( resid   40 and name    HN ) ( resid   89 and name    HN )  4.24  2.44  0.50
assign ( resid   40 and name    HN ) ( resid   89 and name   HB# )  4.61  2.81  0.00
assign ( resid   40 and name    HN ) ( resid   90 and name    HA )  4.42  2.62  0.00
assign ( resid   40 and name    HN ) ( resid   91 and name    HN )  4.90  3.10  0.00
assign ( resid   40 and name   HB# ) ( resid   41 and name    HN )  3.94  2.14  0.00
assign ( resid   40 and name   HB# ) ( resid   89 and name   HB# )  4.87  3.07  1.00
assign ( resid   40 and name   HD# ) ( resid   41 and name    HN )  4.53  2.73  0.00
assign ( resid   40 and name   HD# ) ( resid   44 and name    HA )  5.27  3.47  0.00
assign ( resid   40 and name   HD# ) ( resid   44 and name   HB# )  5.62  3.82  0.00
assign ( resid   40 and name   HD# ) ( resid   49 and name    HA )  5.32  3.52  0.50
assign ( resid   40 and name   HD# ) ( resid   50 and name    HA )  4.25  2.45  0.00
assign ( resid   40 and name   HD# ) ( resid   90 and name    HA )  4.88  3.08  0.00
assign ( resid   40 and name   HD# ) ( resid   91 and name   HG# )  4.23  2.43  1.70
assign ( resid   40 and name   HE# ) ( resid   44 and name   HD# )  5.21  3.41  0.00
assign ( resid   40 and name   HE# ) ( resid   89 and name   HB1 )  4.19  2.39  0.00
assign ( resid   40 and name   HE# ) ( resid   89 and name   HB2 )  4.19  2.39  0.00
assign ( resid   40 and name   HE# ) ( resid   91 and name    HB )  3.29  1.49  1.00 !C3 +1
assign ( resid   40 and name   HE# ) ( resid   91 and name    HN )  4.21  2.41  0.00
assign ( resid   40 and name   HE# ) ( resid   91 and name   HG# )  3.25  1.45  0.00
assign ( resid   41 and name    HA ) ( resid   41 and name   HD# )  3.38  1.58  0.00
assign ( resid   41 and name    HA ) ( resid   42 and name    HN )  3.21  1.41  0.00
assign ( resid   41 and name    HA ) ( resid   51 and name  HD1# )  4.55  2.75  0.00
assign ( resid   41 and name    HG ) ( resid   42 and name    HN )  4.07  2.27  0.00
assign ( resid   41 and name    HG ) ( resid   42 and name   HA# )  5.13  3.33  0.00
assign ( resid   41 and name    HG ) ( resid   87 and name   HG# )  4.10  2.30  0.50
assign ( resid   41 and name    HN ) ( resid   41 and name   HB1 )  3.80  2.00  0.00
assign ( resid   41 and name    HN ) ( resid   41 and name   HB2 )  3.80  2.00  0.00
assign ( resid   41 and name    HN ) ( resid   41 and name   HD# )  4.02  2.22  0.00
assign ( resid   41 and name    HN ) ( resid   42 and name    HN )  4.58  2.78  0.00
assign ( resid   41 and name    HN ) ( resid   49 and name    HN )  4.37  2.57  0.00
assign ( resid   41 and name    HN ) ( resid   49 and name   HG# )  4.59  2.79  0.00
assign ( resid   41 and name    HN ) ( resid   50 and name    HA )  4.43  2.63  1.00 !+1.0
assign ( resid   41 and name    HN ) ( resid   51 and name    HN )  4.61  2.81  1.00 !C3 +0.5
assign ( resid   41 and name    HN ) ( resid   51 and name  HD1# )  4.71  2.91  0.00
assign ( resid   41 and name   HB1 ) ( resid   42 and name    HN )  4.59  2.79  0.00
assign ( resid   41 and name   HB1 ) ( resid   51 and name  HD1# )  4.79  2.99  0.00
assign ( resid   41 and name   HB2 ) ( resid   51 and name  HD1# )  4.79  2.99  0.00
assign ( resid   41 and name   HD# ) ( resid   42 and name    HN )  4.93  3.13  0.00
assign ( resid   41 and name   HD# ) ( resid   71 and name   HE1 )  5.03  3.23  0.00
assign ( resid   41 and name   HD# ) ( resid   71 and name   HE3 )  3.63  1.83  0.00
assign ( resid   41 and name   HD# ) ( resid   71 and name   HH2 )  3.29  1.49  0.00
assign ( resid   41 and name   HD# ) ( resid   71 and name   HZ2 )  3.71  1.91  0.00
assign ( resid   41 and name   HD# ) ( resid   74 and name    HN )  5.89  4.09  0.00
assign ( resid   41 and name   HD# ) ( resid   87 and name   HG# )  4.63  2.83  0.00
assign ( resid   42 and name    HN ) ( resid   43 and name    HN )  4.60  2.80  0.00
assign ( resid   42 and name    HN ) ( resid   87 and name   HB# )  4.99  3.19  0.50
assign ( resid   42 and name    HN ) ( resid   87 and name   HG# )  4.31  2.51  0.00
assign ( resid   42 and name    HN ) ( resid   89 and name   HD# )  4.62  2.82  0.00
assign ( resid   42 and name   HA# ) ( resid   87 and name   HB# )  5.57  3.77  0.00
assign ( resid   42 and name   HA# ) ( resid   87 and name   HG# )  4.25  2.45  0.00
assign ( resid   42 and name   HA# ) ( resid   89 and name   HE# )  5.33  3.53  0.00
assign ( resid   43 and name    HN ) ( resid   46 and name    HN )  4.49  2.69  0.00
assign ( resid   43 and name    HN ) ( resid   46 and name   HB# )  4.70  2.90  0.00
assign ( resid   44 and name    HA ) ( resid   46 and name    HN )  4.56  2.76  0.00
assign ( resid   44 and name    HA ) ( resid   48 and name    HN )  3.40  1.60  1.00
assign ( resid   44 and name    HA ) ( resid   48 and name   HA1 )  4.17  2.37  0.00
assign ( resid   44 and name    HA ) ( resid   48 and name   HA2 )  4.17  2.37  0.50
assign ( resid   44 and name   HB# ) ( resid   48 and name    HN )  4.64  2.84  0.50
assign ( resid   44 and name   HD# ) ( resid   45 and name    HN )  3.73  1.93  0.00
assign ( resid   44 and name   HD1 ) ( resid   45 and name    HN )  4.25  2.45  0.00
assign ( resid   44 and name   HD2 ) ( resid   45 and name    HN )  4.25  2.45  0.00
assign ( resid   44 and name   HG# ) ( resid   45 and name    HN )  4.29  2.49  0.00
assign ( resid   45 and name    HN ) ( resid   45 and name   HB# )  2.88  1.08  0.00
assign ( resid   45 and name    HN ) ( resid   46 and name    HA )  5.39  3.59  0.00
assign ( resid   45 and name    HN ) ( resid   46 and name   HB# )  4.74  2.94  0.00
assign ( resid   45 and name    HN ) ( resid   47 and name    HN )  4.97  3.17  0.00
assign ( resid   45 and name   HB# ) ( resid   46 and name    HN )  3.53  1.73  0.00
assign ( resid   45 and name   HB# ) ( resid   47 and name    HN )  5.21  3.41  0.00
assign ( resid   46 and name    HN ) ( resid   46 and name   HB1 )  3.76  1.96  0.00
assign ( resid   46 and name    HN ) ( resid   46 and name   HB2 )  3.76  1.96  0.50
assign ( resid   46 and name    HN ) ( resid   47 and name    HN )  3.66  1.86  0.00
assign ( resid   46 and name    HN ) ( resid   47 and name   HA# )  5.07  3.27  0.00
assign ( resid   46 and name    HN ) ( resid   48 and name    HN )  3.63  1.83  1.50
assign ( resid   48 and name    HN ) ( resid   49 and name    HN )  4.70  2.90  0.00
assign ( resid   48 and name   HA# ) ( resid   49 and name    HN )  3.07  1.27  0.00
assign ( resid   48 and name   HA# ) ( resid   49 and name   HG# )  4.53  2.73  0.00
assign ( resid   48 and name   HA# ) ( resid   50 and name    HN )  5.81  4.01  0.00
assign ( resid   49 and name    HA ) ( resid   49 and name  HG1# )  3.46  1.66  0.00
assign ( resid   49 and name    HA ) ( resid   49 and name  HG2# )  3.46  1.66  0.00
assign ( resid   49 and name    HA ) ( resid   50 and name    HN )  2.91  1.11  0.00
assign ( resid   49 and name    HB ) ( resid   50 and name    HN )  3.89  2.09  0.50
assign ( resid   49 and name    HN ) ( resid   49 and name    HB )  3.52  1.72  0.00
assign ( resid   49 and name    HN ) ( resid   49 and name   HG# )  3.49  1.69  0.00
assign ( resid   49 and name    HN ) ( resid   50 and name    HN )  5.09  3.29  0.00
assign ( resid   49 and name  HG1# ) ( resid   50 and name    HN )  4.95  3.15  0.00
assign ( resid   49 and name  HG2# ) ( resid   50 and name    HN )  4.95  3.15  0.00
assign ( resid   50 and name    HA ) ( resid   50 and name   HG# )  4.13  2.33  0.00
assign ( resid   50 and name    HA ) ( resid   51 and name  HG1# )  4.66  2.86  0.00
assign ( resid   50 and name    HA ) ( resid   51 and name  HG2# )  5.39  3.59  0.50
assign ( resid   50 and name    HA ) ( resid   52 and name    HN )  4.14  2.34  0.00
assign ( resid   50 and name    HN ) ( resid   50 and name   HB# )  3.06  1.26  0.00
assign ( resid   50 and name    HN ) ( resid   50 and name   HG# )  4.62  2.82  0.00
assign ( resid   50 and name    HN ) ( resid   51 and name    HA )  6.00  4.20  0.00
assign ( resid   50 and name    HN ) ( resid   51 and name    HN )  5.67  3.87  0.00
assign ( resid   50 and name   HG# ) ( resid   51 and name    HN )  4.45  2.65  0.00
assign ( resid   50 and name   HG# ) ( resid   52 and name    HN )  3.30  1.50  0.00
assign ( resid   51 and name    HA ) ( resid   51 and name  HD1# )  4.32  2.52  0.00
assign ( resid   51 and name    HA ) ( resid   51 and name  HG2# )  3.08  1.28  0.00
assign ( resid   51 and name    HA ) ( resid   71 and name   HD1 )  5.56  3.76  0.00
assign ( resid   51 and name    HB ) ( resid   51 and name  HD1# )  3.48  1.68  0.00
assign ( resid   51 and name    HB ) ( resid   52 and name    HN )  4.34  2.54  0.00
assign ( resid   51 and name    HB ) ( resid   71 and name   HD1 )  4.07  2.27  1.00 !+1.0
assign ( resid   51 and name    HN ) ( resid   51 and name    HB )  4.19  2.39  0.00
assign ( resid   51 and name    HN ) ( resid   51 and name  HD1# )  4.46  2.66  0.00
assign ( resid   51 and name    HN ) ( resid   51 and name  HG1# )  4.34  2.54  0.00
assign ( resid   51 and name    HN ) ( resid   51 and name  HG2# )  4.19  2.39  0.00
assign ( resid   51 and name    HN ) ( resid   52 and name    HN )  3.37  1.57  0.00
assign ( resid   51 and name  HD1# ) ( resid   52 and name    HN )  4.97  3.17  0.00
assign ( resid   51 and name  HD1# ) ( resid   71 and name   HB1 )  4.38  2.58  0.00
assign ( resid   51 and name  HD1# ) ( resid   71 and name   HB2 )  4.67  2.87  0.00
assign ( resid   51 and name  HD1# ) ( resid   71 and name   HD1 )  4.17  2.37  0.00
assign ( resid   51 and name  HD1# ) ( resid   71 and name   HE1 )  4.44  2.64  0.00
assign ( resid   51 and name  HG1# ) ( resid   52 and name    HN )  4.08  2.28  0.00
assign ( resid   51 and name  HG1# ) ( resid   52 and name   HA# )  5.12  3.32  0.00
assign ( resid   51 and name  HG2# ) ( resid   51 and name  HD1# )  3.07  1.27  0.00
assign ( resid   51 and name  HG2# ) ( resid   52 and name    HN )  4.29  2.49  0.00
assign ( resid   51 and name  HG2# ) ( resid   71 and name   HB1 )  3.98  2.18  0.00
assign ( resid   51 and name  HG2# ) ( resid   71 and name   HD1 )  3.41  1.61  0.00
assign ( resid   51 and name  HG2# ) ( resid   71 and name   HE1 )  3.68  1.88  0.00
assign ( resid   51 and name  HG2# ) ( resid   72 and name    HN )  5.71  3.91  0.00
assign ( resid   52 and name    HN ) ( resid   53 and name    HN )  4.45  2.65  0.00
assign ( resid   52 and name    HN ) ( resid   69 and name   HG# )  4.63  2.83  0.00
assign ( resid   52 and name   HA# ) ( resid   53 and name    HN )  2.94  1.14  0.00
assign ( resid   53 and name    HA ) ( resid   53 and name   HG# )  4.18  2.38  0.00
assign ( resid   53 and name    HA ) ( resid   54 and name    HN )  3.06  1.26  0.00
assign ( resid   53 and name    HA ) ( resid   69 and name    HB )  6.00  4.20  0.00
assign ( resid   53 and name    HA ) ( resid   69 and name   HG# )  4.01  2.21  0.00
assign ( resid   53 and name    HN ) ( resid   53 and name   HB# )  3.56  1.76  0.00
assign ( resid   53 and name    HN ) ( resid   53 and name   HG# )  4.21  2.41  0.00
assign ( resid   53 and name    HN ) ( resid   54 and name    HA )  4.96  3.16  0.00
assign ( resid   53 and name    HN ) ( resid   54 and name    HN )  4.34  2.54  0.00
assign ( resid   53 and name   HB# ) ( resid   54 and name    HN )  3.65  1.85  0.00
assign ( resid   53 and name   HG# ) ( resid   54 and name    HA )  4.25  2.45  0.00
assign ( resid   53 and name   HG# ) ( resid   55 and name    HN )  4.43  2.63  0.50
assign ( resid   54 and name    HA ) ( resid   55 and name    HN )  2.88  1.08  0.00
assign ( resid   54 and name    HA ) ( resid   55 and name  HG2# )  5.58  3.78  0.00
assign ( resid   54 and name    HN ) ( resid   54 and name   HB1 )  3.99  2.19  0.00
assign ( resid   54 and name    HN ) ( resid   54 and name   HB2 )  3.99  2.19  0.00
assign ( resid   54 and name    HN ) ( resid   55 and name    HN )  4.35  2.55  0.00
assign ( resid   54 and name    HN ) ( resid   67 and name   HB# )  4.37  2.57  0.00
assign ( resid   54 and name   HB# ) ( resid   55 and name    HN )  4.11  2.31  0.00
assign ( resid   54 and name   HB# ) ( resid   69 and name   HG# )  3.85  2.05  0.00
assign ( resid   54 and name   HB1 ) ( resid   67 and name   HB# )  4.18  2.38  0.50
assign ( resid   54 and name   HB1 ) ( resid   68 and name    HN )  4.04  2.24  0.50
assign ( resid   54 and name   HB2 ) ( resid   67 and name   HB# )  4.18  2.38  0.00
assign ( resid   54 and name   HB2 ) ( resid   68 and name    HN )  4.04  2.24  0.00
assign ( resid   55 and name    HA ) ( resid   55 and name  HG2# )  3.33  1.53  0.00
assign ( resid   55 and name    HA ) ( resid   56 and name    HN )  3.30  1.50  0.00
assign ( resid   55 and name    HB ) ( resid   56 and name    HN )  4.96  3.16  0.00
assign ( resid   55 and name    HN ) ( resid   55 and name    HB )  3.29  1.49  0.00
assign ( resid   55 and name    HN ) ( resid   55 and name  HG2# )  3.95  2.15  0.00
assign ( resid   55 and name    HN ) ( resid   56 and name    HN )  4.78  2.98  0.00
assign ( resid   55 and name  HG2# ) ( resid   56 and name    HN )  3.39  1.59  0.00
assign ( resid   56 and name    HA ) ( resid   56 and name  HD1# )  4.27  2.47  0.00
assign ( resid   56 and name    HA ) ( resid   56 and name  HG2# )  3.37  1.57  0.00
assign ( resid   56 and name    HA ) ( resid   57 and name    HN )  2.93  1.13  0.00
assign ( resid   56 and name    HB ) ( resid   56 and name  HD1# )  3.34  1.54  0.00
assign ( resid   56 and name    HB ) ( resid   57 and name    HN )  4.11  2.31  0.00
assign ( resid   56 and name    HB ) ( resid   59 and name  HD1# )  3.33  1.53  0.00
assign ( resid   56 and name    HN ) ( resid   56 and name    HB )  3.39  1.59  0.00
assign ( resid   56 and name    HN ) ( resid   56 and name  HD1# )  4.23  2.43  0.00
assign ( resid   56 and name    HN ) ( resid   56 and name  HG1# )  4.71  2.91  0.00
assign ( resid   56 and name  HD1# ) ( resid   65 and name    HN )  5.15  3.35  0.00
assign ( resid   56 and name  HD1# ) ( resid   65 and name   HA# )  4.17  2.37  0.00
assign ( resid   56 and name  HD1# ) ( resid   66 and name    HA )  4.28  2.48  0.00
assign ( resid   56 and name  HD1# ) ( resid   66 and name    HN )  4.47  2.67  0.00
assign ( resid   56 and name  HD1# ) ( resid   67 and name    HA )  4.61  2.81  0.00
assign ( resid   56 and name  HD1# ) ( resid   67 and name    HN )  4.22  2.42  0.00
assign ( resid   56 and name  HD1# ) ( resid   67 and name   HB# )  3.38  1.58  0.00
assign ( resid   56 and name  HG2# ) ( resid   57 and name    HN )  3.59  1.79  0.00
assign ( resid   56 and name  HG2# ) ( resid   58 and name    HA )  4.32  2.52  0.00
assign ( resid   56 and name  HG2# ) ( resid   58 and name    HN )  3.29  1.49  0.00
assign ( resid   56 and name  HG2# ) ( resid   59 and name    HN )  4.41  2.61  0.00
assign ( resid   56 and name  HG2# ) ( resid   65 and name   HA# )  3.28  1.48  0.00
assign ( resid   56 and name  HG2# ) ( resid   65 and name   HA1 )  3.80  2.00  0.00
assign ( resid   56 and name  HG2# ) ( resid   65 and name   HA2 )  3.80  2.00  0.00
assign ( resid   56 and name  HG2# ) ( resid   66 and name    HN )  3.91  2.11  0.00
assign ( resid   57 and name    HN ) ( resid   58 and name    HN )  3.65  1.85  0.00
assign ( resid   58 and name    HA ) ( resid   58 and name   HG# )  4.08  2.28  0.00
assign ( resid   58 and name    HA ) ( resid   59 and name    HN )  2.98  1.18  0.00
assign ( resid   58 and name    HA ) ( resid   59 and name  HD1# )  4.07  2.27  1.00
assign ( resid   58 and name    HN ) ( resid   58 and name   HB# )  3.35  1.55  0.00
assign ( resid   58 and name    HN ) ( resid   58 and name   HD# )  4.86  3.06  0.50
assign ( resid   58 and name    HN ) ( resid   58 and name   HG# )  3.87  2.07  0.50
assign ( resid   58 and name    HN ) ( resid   59 and name    HN )  4.26  2.46  0.00
assign ( resid   58 and name   HB# ) ( resid   58 and name   HD# )  3.90  2.10  0.00
assign ( resid   58 and name   HB# ) ( resid   59 and name    HN )  3.75  1.95  0.00
assign ( resid   58 and name   HG# ) ( resid   59 and name    HA )  4.22  2.42  0.00
assign ( resid   58 and name   HG# ) ( resid   59 and name    HN )  3.51  1.71  0.50
assign ( resid   59 and name    HA ) ( resid   59 and name  HD1# )  4.00  2.20  0.00
assign ( resid   59 and name    HA ) ( resid   59 and name  HG2# )  3.42  1.62  0.00
assign ( resid   59 and name    HA ) ( resid   60 and name   HD# )  3.38  1.58  0.00
assign ( resid   59 and name    HB ) ( resid   59 and name  HD1# )  3.64  1.84  0.00
assign ( resid   59 and name    HB ) ( resid   60 and name   HD# )  5.17  3.37  0.00
assign ( resid   59 and name    HN ) ( resid   59 and name    HB )  4.01  2.21  0.00
assign ( resid   59 and name    HN ) ( resid   59 and name  HD1# )  3.74  1.94  0.50
assign ( resid   59 and name    HN ) ( resid   60 and name   HD# )  4.39  2.59  0.00
assign ( resid   59 and name  HD1# ) ( resid   60 and name   HD# )  4.80  3.00  0.00
assign ( resid   59 and name  HD1# ) ( resid   65 and name    HN )  5.73  3.93  0.00
assign ( resid   59 and name  HD1# ) ( resid   65 and name   HA# )  3.93  2.13  0.00
assign ( resid   59 and name  HD1# ) ( resid   66 and name    HN )  4.86  3.06  0.50
assign ( resid   59 and name  HG2# ) ( resid   60 and name   HD# )  3.57  1.77  0.00
assign ( resid   59 and name  HG2# ) ( resid   63 and name    HN )  3.82  2.02  0.50
assign ( resid   59 and name  HG2# ) ( resid   64 and name    HA )  3.96  2.16  0.00
assign ( resid   59 and name  HG2# ) ( resid   64 and name    HN )  4.11  2.31  0.00
assign ( resid   60 and name    HA ) ( resid   61 and name    HN )  3.05  1.25  0.00
assign ( resid   60 and name   HB# ) ( resid   61 and name    HN )  3.58  1.78  0.00
assign ( resid   60 and name   HB# ) ( resid   63 and name    HN )  5.50  3.70  0.00
assign ( resid   60 and name   HG# ) ( resid   61 and name    HN )  4.73  2.93  0.00
assign ( resid   60 and name   HG# ) ( resid   63 and name    HN )  4.63  2.83  0.00
assign ( resid   60 and name   HG# ) ( resid   63 and name   HA1 )  5.53  3.73  0.00
assign ( resid   60 and name   HG# ) ( resid   63 and name   HA2 )  3.73  1.93  0.50
assign ( resid   60 and name   HG# ) ( resid   64 and name    HN )  5.57  3.77  0.00
assign ( resid   61 and name    HA ) ( resid   61 and name  HG1# )  3.24  1.44  0.00
assign ( resid   61 and name    HA ) ( resid   61 and name  HG2# )  3.24  1.44  0.00
assign ( resid   61 and name    HA ) ( resid   62 and name    HN )  2.97  1.17  0.00
assign ( resid   61 and name    HA ) ( resid   62 and name   HA1 )  4.51  2.71  0.00
assign ( resid   61 and name    HA ) ( resid   62 and name   HA2 )  4.51  2.71  0.00
assign ( resid   61 and name    HA ) ( resid   63 and name    HN )  3.68  1.88  0.00
assign ( resid   61 and name    HB ) ( resid   62 and name    HN )  4.49  2.69  0.00
assign ( resid   61 and name    HB ) ( resid   63 and name    HN )  6.00  4.20  0.00
assign ( resid   61 and name    HN ) ( resid   61 and name    HB )  2.88  1.08  0.30
assign ( resid   61 and name    HN ) ( resid   61 and name   HG# )  2.99  1.19  0.00
assign ( resid   61 and name   HG# ) ( resid   62 and name   HA# )  4.85  3.05  0.00
assign ( resid   61 and name   HG# ) ( resid   63 and name    HN )  5.34  3.54  0.00
assign ( resid   61 and name  HG1# ) ( resid   62 and name    HN )  4.09  2.29  0.00
assign ( resid   61 and name  HG2# ) ( resid   62 and name    HN )  4.09  2.29  0.00
assign ( resid   62 and name    HN ) ( resid   63 and name    HN )  3.46  1.66  0.00
assign ( resid   63 and name   HA1 ) ( resid   64 and name    HN )  3.25  1.45  0.00
assign ( resid   63 and name   HA2 ) ( resid   64 and name    HN )  3.19  1.39  0.00
assign ( resid   64 and name    HA ) ( resid   64 and name  HG2# )  3.49  1.69  0.00
assign ( resid   64 and name    HA ) ( resid   65 and name    HN )  3.24  1.44  0.00
assign ( resid   64 and name    HB ) ( resid   65 and name    HN )  3.89  2.09  0.00
assign ( resid   64 and name    HN ) ( resid   64 and name    HB )  3.72  1.92  0.50
assign ( resid   64 and name    HN ) ( resid   64 and name  HG2# )  3.99  2.19  0.00
assign ( resid   64 and name    HN ) ( resid   65 and name    HN )  4.78  2.98  0.00
assign ( resid   64 and name  HG2# ) ( resid   65 and name    HN )  3.57  1.77  0.50
assign ( resid   65 and name    HN ) ( resid   66 and name    HN )  4.77  2.97  0.00
assign ( resid   65 and name    HN ) ( resid   66 and name   HD# )  5.80  4.00  0.00
assign ( resid   65 and name   HA# ) ( resid   66 and name    HN )  2.97  1.17  0.00
assign ( resid   65 and name   HA1 ) ( resid   66 and name    HN )  3.44  1.64  0.00
assign ( resid   65 and name   HA2 ) ( resid   66 and name    HN )  3.44  1.64  0.00
assign ( resid   66 and name    HA ) ( resid   66 and name  HD1# )  3.56  1.76  0.50
assign ( resid   66 and name    HA ) ( resid   66 and name  HD2# )  3.56  1.76  0.00
assign ( resid   66 and name    HA ) ( resid   67 and name    HN )  3.04  1.24  0.00
assign ( resid   66 and name    HN ) ( resid   66 and name   HB# )  3.14  1.34  0.00
assign ( resid   66 and name    HN ) ( resid   66 and name   HD# )  4.36  2.56  0.00
assign ( resid   66 and name    HN ) ( resid   67 and name    HN )  4.49  2.69  0.00
assign ( resid   66 and name   HB# ) ( resid   66 and name  HD1# )  2.93  1.13  0.00
assign ( resid   66 and name   HB# ) ( resid   66 and name  HD2# )  2.93  1.13  0.00
assign ( resid   66 and name   HB# ) ( resid   67 and name    HN )  4.83  3.03  0.00
assign ( resid   66 and name   HD# ) ( resid   67 and name    HN )  3.63  1.83  0.00
assign ( resid   67 and name    HA ) ( resid   68 and name    HN )  3.05  1.25  0.00
assign ( resid   67 and name    HN ) ( resid   67 and name   HB# )  3.30  1.50  0.00
assign ( resid   67 and name    HN ) ( resid   68 and name    HN )  4.77  2.97  0.00
assign ( resid   67 and name   HB# ) ( resid   68 and name    HN )  3.62  1.82  0.00
assign ( resid   68 and name    HA ) ( resid   68 and name   HD# )  4.28  2.48  0.00
assign ( resid   68 and name    HA ) ( resid   68 and name   HG# )  3.79  1.99  0.00
assign ( resid   68 and name    HA ) ( resid   69 and name    HB )  6.00  4.20  0.00
assign ( resid   68 and name    HA ) ( resid   69 and name    HN )  3.03  1.23  0.00
assign ( resid   68 and name    HA ) ( resid   69 and name   HG# )  4.41  2.61  0.00
assign ( resid   68 and name    HN ) ( resid   68 and name   HD# )  4.62  2.82  0.50
assign ( resid   68 and name    HN ) ( resid   68 and name   HG# )  4.32  2.52  0.00
assign ( resid   68 and name    HN ) ( resid   69 and name    HN )  4.45  2.65  0.00
assign ( resid   68 and name   HB# ) ( resid   68 and name   HD# )  3.35  1.55  0.00
assign ( resid   68 and name   HD# ) ( resid   69 and name    HN )  5.35  3.55  0.00
assign ( resid   68 and name   HG# ) ( resid   69 and name    HN )  3.99  2.19  0.00
assign ( resid   68 and name   HG# ) ( resid   70 and name    HN )  5.40  3.60  0.00
assign ( resid   69 and name    HA ) ( resid   70 and name    HN )  2.95  1.15  0.00
assign ( resid   69 and name    HN ) ( resid   69 and name    HB )  3.96  2.16  0.00
assign ( resid   69 and name    HN ) ( resid   69 and name   HG# )  3.38  1.58  0.00
assign ( resid   69 and name    HN ) ( resid   70 and name    HN )  4.65  2.85  0.00
assign ( resid   69 and name   HG# ) ( resid   70 and name    HN )  4.01  2.21  0.00
assign ( resid   70 and name    HA ) ( resid   71 and name    HN )  3.08  1.28  0.00
assign ( resid   70 and name    HN ) ( resid   70 and name   HB# )  3.19  1.39  0.00
assign ( resid   70 and name    HN ) ( resid   70 and name   HG# )  3.43  1.63  0.00
assign ( resid   70 and name    HN ) ( resid   70 and name   HG1 )  4.07  2.27  0.00
assign ( resid   70 and name    HN ) ( resid   70 and name   HG2 )  4.07  2.27  0.00
assign ( resid   70 and name    HN ) ( resid   71 and name    HN )  4.91  3.11  0.00
assign ( resid   70 and name   HG# ) ( resid   71 and name    HN )  4.66  2.86  0.00
assign ( resid   71 and name    HA ) ( resid   71 and name   HD1 )  3.49  1.69  0.00
assign ( resid   71 and name    HA ) ( resid   71 and name   HE1 )  5.41  3.61  0.00
assign ( resid   71 and name    HA ) ( resid   72 and name    HN )  3.07  1.27  0.00
assign ( resid   71 and name    HN ) ( resid   71 and name   HB1 )  4.04  2.24  0.00
assign ( resid   71 and name    HN ) ( resid   71 and name   HB2 )  3.89  2.09  0.00
assign ( resid   71 and name    HN ) ( resid   72 and name    HN )  4.67  2.87  0.00
assign ( resid   71 and name   HB1 ) ( resid   72 and name    HN )  4.57  2.77  0.00
assign ( resid   71 and name   HB2 ) ( resid   71 and name   HE3 )  4.07  2.27  0.00
assign ( resid   71 and name   HB2 ) ( resid   72 and name    HN )  4.93  3.13  0.00
assign ( resid   71 and name   HD1 ) ( resid   72 and name    HN )  3.60  1.80  0.00
assign ( resid   71 and name   HE1 ) ( resid   74 and name    HN )  5.63  3.83  0.00
assign ( resid   71 and name   HE1 ) ( resid   74 and name  HG2# )  3.89  2.09  0.00
assign ( resid   71 and name   HH2 ) ( resid   73 and name    HA )  4.74  2.94  0.00
assign ( resid   71 and name   HH2 ) ( resid   74 and name    HN )  4.35  2.55  0.00
assign ( resid   71 and name   HH2 ) ( resid   86 and name   HG# )  3.94  2.14  0.00
assign ( resid   71 and name   HH2 ) ( resid   86 and name  HG1# )  4.88  3.08  0.00
assign ( resid   71 and name   HH2 ) ( resid   86 and name  HG2# )  4.88  3.08  0.00
assign ( resid   71 and name   HZ2 ) ( resid   73 and name    HA )  4.59  2.79  0.00
assign ( resid   71 and name   HZ2 ) ( resid   74 and name    HN )  3.76  1.96  0.00
assign ( resid   71 and name   HZ2 ) ( resid   74 and name  HG2# )  3.67  1.87  0.00
assign ( resid   72 and name    HA ) ( resid   73 and name    HN )  3.04  1.24  0.00
assign ( resid   72 and name    HN ) ( resid   72 and name   HB# )  3.39  1.59  0.00
assign ( resid   72 and name    HN ) ( resid   72 and name   HG# )  4.51  2.71  0.00
assign ( resid   72 and name    HN ) ( resid   73 and name    HA )  6.00  4.20  0.00
assign ( resid   72 and name    HN ) ( resid   73 and name    HN )  4.59  2.79  0.00
assign ( resid   72 and name   HB# ) ( resid   73 and name    HN )  4.16  2.36  0.00
assign ( resid   72 and name   HG# ) ( resid   73 and name    HN )  4.37  2.57  0.00
assign ( resid   73 and name    HN ) ( resid   73 and name   HB# )  3.55  1.75  0.00
assign ( resid   73 and name    HN ) ( resid   74 and name    HN )  4.82  3.02  0.00
assign ( resid   73 and name   HB# ) ( resid   74 and name    HN )  3.01  1.21  0.50
assign ( resid   74 and name    HA ) ( resid   75 and name    HN )  3.56  1.76  0.00
assign ( resid   74 and name    HB ) ( resid   75 and name    HN )  4.53  2.73  0.00
assign ( resid   74 and name    HN ) ( resid   74 and name  HG2# )  3.73  1.93  0.00
assign ( resid   74 and name    HN ) ( resid   75 and name    HN )  4.89  3.09  0.00
assign ( resid   74 and name  HG2# ) ( resid   75 and name    HN )  4.49  2.69  0.00
assign ( resid   75 and name    HN ) ( resid   76 and name    HN )  3.65  1.85  1.00 !C3 +1
assign ( resid   75 and name    HN ) ( resid   76 and name   HB# )  3.73  1.93  1.50
assign ( resid   76 and name    HA ) ( resid   76 and name   HG# )  3.92  2.12  0.00
assign ( resid   76 and name    HA ) ( resid   77 and name    HN )  3.11  1.31  0.00
assign ( resid   76 and name    HN ) ( resid   76 and name   HB# )  3.27  1.47  0.00
assign ( resid   76 and name    HN ) ( resid   76 and name   HE# )  4.93  3.13  1.30
assign ( resid   76 and name    HN ) ( resid   76 and name   HG# )  4.41  2.61  0.30
assign ( resid   76 and name   HB# ) ( resid   76 and name   HE# )  4.15  2.35  0.00
assign ( resid   76 and name   HD# ) ( resid   76 and name   HE# )  2.82  1.02  0.00
assign ( resid   76 and name   HG# ) ( resid   76 and name   HE# )  3.26  1.46  0.00
assign ( resid   76 and name   HG# ) ( resid   77 and name    HA )  4.96  3.16  0.50
assign ( resid   76 and name   HG# ) ( resid   77 and name    HN )  4.11  2.31  0.00
assign ( resid   77 and name    HA ) ( resid   77 and name  HD1# )  4.37  2.57  0.00
assign ( resid   77 and name    HA ) ( resid   77 and name  HD2# )  4.37  2.57  0.00
assign ( resid   77 and name    HA ) ( resid   78 and name    HN )  3.38  1.58  0.00
assign ( resid   77 and name    HN ) ( resid   77 and name   HB# )  3.43  1.63  0.00
assign ( resid   77 and name    HN ) ( resid   77 and name   HD# )  4.09  2.29  0.00
assign ( resid   77 and name    HN ) ( resid   78 and name    HN )  4.31  2.51  0.00
assign ( resid   77 and name  HD1# ) ( resid   78 and name    HN )  5.67  3.87  0.00
assign ( resid   77 and name  HD2# ) ( resid   78 and name    HN )  5.67  3.87  0.00
assign ( resid   78 and name    HN ) ( resid   78 and name   HB# )  3.58  1.78  0.00
assign ( resid   78 and name   HB# ) ( resid   79 and name    HN )  4.56  2.76  0.00
assign ( resid   79 and name    HN ) ( resid   80 and name    HN )  4.90  3.10  0.00
assign ( resid   80 and name    HA ) ( resid   80 and name   HG# )  3.69  1.89  0.00
assign ( resid   80 and name    HN ) ( resid   80 and name   HG# )  4.48  2.68  0.00
assign ( resid   80 and name    HN ) ( resid   81 and name    HN )  4.45  2.65  0.00
assign ( resid   80 and name    HN ) ( resid   81 and name   HB# )  6.00  4.20  0.00
assign ( resid   80 and name   HG# ) ( resid   80 and name   HD# )  3.01  1.21  0.00
assign ( resid   80 and name   HG# ) ( resid   81 and name    HN )  4.89  3.09  0.00
assign ( resid   81 and name    HN ) ( resid   81 and name   HB# )  3.81  2.01  0.00
assign ( resid   82 and name    HN ) ( resid   82 and name   HB# )  3.38  1.58  0.00
assign ( resid   82 and name   HB# ) ( resid   83 and name    HN )  3.71  1.91  0.00
assign ( resid   83 and name    HA ) ( resid   84 and name   HD# )  3.22  1.42  0.00
assign ( resid   83 and name    HN ) ( resid   83 and name   HB# )  3.62  1.82  0.00
assign ( resid   83 and name    HN ) ( resid   84 and name   HD# )  4.53  2.73  0.00
assign ( resid   83 and name   HB# ) ( resid   84 and name   HD# )  3.92  2.12  0.00
assign ( resid   83 and name   HB1 ) ( resid   84 and name   HD# )  4.46  2.66  0.00
assign ( resid   83 and name   HB2 ) ( resid   84 and name   HD# )  4.46  2.66  0.00
assign ( resid   84 and name   HG# ) ( resid   85 and name    HN )  4.59  2.79  0.00
assign ( resid   85 and name    HN ) ( resid   86 and name    HN )  4.73  2.93  0.00
assign ( resid   85 and name   HA# ) ( resid   86 and name    HB )  5.40  3.60  0.50
assign ( resid   85 and name   HA# ) ( resid   86 and name   HG# )  4.33  2.53  0.00
assign ( resid   86 and name    HN ) ( resid   86 and name    HB )  3.92  2.12  0.00
assign ( resid   86 and name    HN ) ( resid   86 and name   HG# )  3.66  1.86  0.00
assign ( resid   86 and name    HN ) ( resid  111 and name  HG2# )  4.10  2.30  0.50
assign ( resid   86 and name    HN ) ( resid  112 and name    HN )  4.02  2.22  1.00
assign ( resid   86 and name    HN ) ( resid  112 and name   HG# )  4.36  2.56  0.50
assign ( resid   86 and name   HG# ) ( resid  112 and name    HN )  5.07  3.27  0.00
assign ( resid   86 and name   HG# ) ( resid  114 and name    HN )  4.94  3.14  0.00
assign ( resid   87 and name    HA ) ( resid   88 and name    HN )  3.37  1.57  0.00
assign ( resid   87 and name    HA ) ( resid  111 and name    HA )  3.95  2.15  0.00
assign ( resid   87 and name    HA ) ( resid  111 and name  HD1# )  4.00  2.20  0.00
assign ( resid   87 and name    HA ) ( resid  111 and name  HG2# )  5.18  3.38  0.00
assign ( resid   87 and name    HA ) ( resid  112 and name    HN )  4.72  2.92  0.00
assign ( resid   87 and name   HB# ) ( resid   88 and name    HN )  4.11  2.31  0.00
assign ( resid   87 and name   HB# ) ( resid   89 and name   HE# )  3.65  1.85  0.00
assign ( resid   87 and name   HB# ) ( resid  111 and name  HD1# )  3.82  2.02  0.00
assign ( resid   87 and name   HB2 ) ( resid   89 and name   HE# )  4.25  2.45  0.00
assign ( resid   87 and name   HD1 ) ( resid   89 and name   HE# )  4.25  2.45  1.00 !+1.0
assign ( resid   88 and name    HN ) ( resid  111 and name    HA )  4.27  2.47  0.00
assign ( resid   88 and name    HN ) ( resid  111 and name  HD1# )  4.84  3.04  0.00
assign ( resid   88 and name    HN ) ( resid  112 and name    HN )  5.69  3.89  0.00
assign ( resid   89 and name    HA ) ( resid   89 and name   HD# )  4.55  2.75  0.00
assign ( resid   89 and name    HA ) ( resid   90 and name    HN )  3.10  1.30  0.00
assign ( resid   89 and name    HA ) ( resid   90 and name   HB# )  4.16  2.36  0.00
assign ( resid   89 and name    HA ) ( resid  107 and name   HG# )  4.57  2.77  0.00
assign ( resid   89 and name    HN ) ( resid   89 and name   HB# )  3.66  1.86  0.00
assign ( resid   89 and name    HN ) ( resid   89 and name   HD# )  4.56  2.76  0.00
assign ( resid   89 and name   HB# ) ( resid   90 and name    HN )  3.99  2.19  0.00
assign ( resid   89 and name   HB# ) ( resid  107 and name   HG# )  4.26  2.46  0.00
assign ( resid   89 and name   HD# ) ( resid   90 and name    HN )  5.20  3.40  0.00
assign ( resid   89 and name   HD# ) ( resid  107 and name   HG# )  3.32  1.52  0.00
assign ( resid   89 and name   HE# ) ( resid  107 and name   HG# )  4.08  2.28  0.00
assign ( resid   89 and name   HE# ) ( resid  109 and name   HB1 )  4.01  2.21  0.00
assign ( resid   89 and name   HE# ) ( resid  109 and name   HB2 )  4.01  2.21  1.00
assign ( resid   90 and name    HA ) ( resid   91 and name    HN )  3.13  1.33  0.00
assign ( resid   90 and name    HN ) ( resid   90 and name   HB# )  3.43  1.63  0.00
assign ( resid   90 and name    HN ) ( resid  108 and name    HN )  3.87  2.07  0.00
assign ( resid   90 and name   HB# ) ( resid   91 and name    HN )  3.91  2.11  0.00
assign ( resid   90 and name   HB# ) ( resid  108 and name   HB1 )  4.61  2.81  0.50
assign ( resid   90 and name   HB# ) ( resid  108 and name   HB2 )  4.61  2.81  0.00
assign ( resid   90 and name   HB# ) ( resid  108 and name   HD# )  4.16  2.36  0.00
assign ( resid   91 and name    HA ) ( resid   92 and name    HN )  3.24  1.44  0.00
assign ( resid   91 and name    HN ) ( resid   91 and name    HB )  3.69  1.89  0.00
assign ( resid   91 and name    HN ) ( resid   91 and name   HG# )  3.46  1.66  0.00
assign ( resid   91 and name    HN ) ( resid   92 and name    HA )  5.14  3.34  0.00
assign ( resid   91 and name    HN ) ( resid   92 and name    HN )  4.55  2.75  0.00
assign ( resid   91 and name   HG# ) ( resid   92 and name    HN )  3.45  1.65  0.00
assign ( resid   92 and name    HA ) ( resid   92 and name  HG1# )  3.50  1.70  0.00
assign ( resid   92 and name    HA ) ( resid   92 and name  HG2# )  3.50  1.70  0.00
assign ( resid   92 and name    HA ) ( resid   93 and name    HN )  3.46  1.66  0.00
assign ( resid   92 and name    HB ) ( resid   93 and name    HN )  4.61  2.81  0.00
assign ( resid   92 and name    HB ) ( resid  106 and name   HB# )  4.49  2.69  0.00
assign ( resid   92 and name    HN ) ( resid   92 and name    HB )  3.76  1.96  0.00
assign ( resid   92 and name    HN ) ( resid   92 and name  HG1# )  3.81  2.01  0.00
assign ( resid   92 and name    HN ) ( resid   92 and name  HG2# )  3.81  2.01  0.00
assign ( resid   92 and name    HN ) ( resid  106 and name   HB# )  4.32  2.52  0.50
assign ( resid   92 and name   HG# ) ( resid   93 and name    HN )  3.87  2.07  0.00
assign ( resid   92 and name   HG# ) ( resid   93 and name   HB# )  4.77  2.97  0.00
assign ( resid   92 and name   HG# ) ( resid  106 and name    HN )  3.85  2.05  1.50 !+0.5 C3 +1
assign ( resid   93 and name    HA ) ( resid   94 and name   HD# )  3.56  1.76  0.00
assign ( resid   93 and name    HN ) ( resid   93 and name   HB# )  4.05  2.25  0.00
assign ( resid   93 and name    HN ) ( resid   94 and name   HD# )  4.04  2.24  0.50
assign ( resid   94 and name    HA ) ( resid   96 and name    HN )  4.48  2.68  0.00
assign ( resid   94 and name   HD# ) ( resid   95 and name    HN )  4.52  2.72  0.50 !C3 +0.5
assign ( resid   94 and name   HG# ) ( resid   95 and name    HN )  4.70  2.90  0.00
assign ( resid   95 and name    HN ) ( resid   95 and name   HB1 )  3.74  1.94  0.00
assign ( resid   95 and name    HN ) ( resid   95 and name   HB2 )  3.74  1.94  1.00
assign ( resid   95 and name    HN ) ( resid   96 and name    HN )  3.29  1.49  0.00
assign ( resid   95 and name    HN ) ( resid   97 and name    HN )  4.94  3.14  0.00
assign ( resid   96 and name    HA ) ( resid   97 and name    HA )  4.77  2.97  0.50
assign ( resid   96 and name    HA ) ( resid   97 and name   HB# )  4.63  2.83  0.30
assign ( resid   96 and name    HA ) ( resid   97 and name   HG# )  4.15  2.35  0.00
assign ( resid   96 and name    HA ) ( resid   98 and name    HN )  4.06  2.26  1.00
assign ( resid   96 and name    HN ) ( resid   96 and name   HB1 )  3.92  2.12  0.00
assign ( resid   96 and name    HN ) ( resid   96 and name   HB2 )  3.92  2.12  1.00
assign ( resid   96 and name    HN ) ( resid   97 and name    HN )  3.90  2.10  0.00
assign ( resid   96 and name    HN ) ( resid   97 and name   HG# )  4.98  3.18  0.00
assign ( resid   97 and name    HA ) ( resid   97 and name   HD# )  3.69  1.89  0.50
assign ( resid   97 and name    HA ) ( resid   97 and name   HG# )  3.83  2.03  0.00
assign ( resid   97 and name    HA ) ( resid   98 and name    HB )  4.82  3.02  1.00
assign ( resid   97 and name    HA ) ( resid   98 and name    HN )  3.24  1.44  0.50 !C3 +0.5
assign ( resid   97 and name    HN ) ( resid   97 and name   HB# )  4.14  2.34  0.00
assign ( resid   97 and name   HB# ) ( resid   98 and name    HN )  3.95  2.15  0.00
assign ( resid   97 and name   HG# ) ( resid   98 and name    HN )  4.57  2.77  0.00
assign ( resid   98 and name    HA ) ( resid   98 and name  HG1# )  3.31  1.51  0.00
assign ( resid   98 and name    HA ) ( resid   99 and name    HN )  3.25  1.45  0.50 !C3 +0.5
assign ( resid   98 and name    HB ) ( resid   99 and name    HN )  3.64  1.84  0.50
assign ( resid   98 and name    HN ) ( resid   98 and name    HB )  3.45  1.65  0.00
assign ( resid   98 and name    HN ) ( resid   98 and name  HG1# )  3.43  1.63  0.50
assign ( resid   98 and name  HG1# ) ( resid   99 and name    HA )  4.99  3.19  0.00
assign ( resid   98 and name  HG1# ) ( resid   99 and name    HN )  3.25  1.45  0.50
assign ( resid   98 and name  HG1# ) ( resid  100 and name    HN )  4.97  3.17  0.50
assign ( resid   99 and name    HA ) ( resid  100 and name    HN )  2.91  1.11  0.50
assign ( resid   99 and name    HN ) ( resid   99 and name   HB# )  3.06  1.26  0.00
assign ( resid   99 and name    HN ) ( resid  102 and name   HB# )  4.84  3.04  0.00
assign ( resid   99 and name   HB# ) ( resid  100 and name    HA )  4.15  2.35  0.50
assign ( resid   99 and name   HB# ) ( resid  100 and name    HN )  3.18  1.38  0.50
assign ( resid   99 and name   HB# ) ( resid  102 and name   HB# )  4.24  2.44  0.00
assign ( resid  100 and name    HA ) ( resid  100 and name   HG# )  3.56  1.76  0.00
assign ( resid  100 and name    HN ) ( resid  100 and name   HB# )  3.35  1.55  0.00
assign ( resid  100 and name    HN ) ( resid  100 and name   HG# )  3.68  1.88  0.50
assign ( resid  100 and name    HN ) ( resid  101 and name    HN )  3.92  2.12  0.00
assign ( resid  100 and name   HB# ) ( resid  101 and name    HN )  4.28  2.48  0.00
assign ( resid  100 and name   HG# ) ( resid  101 and name    HN )  4.66  2.86  0.00
assign ( resid  101 and name    HN ) ( resid  101 and name   HB# )  3.68  1.88  0.00
assign ( resid  101 and name   HB# ) ( resid  102 and name    HN )  4.10  2.30  0.00
assign ( resid  102 and name    HN ) ( resid  102 and name   HB# )  3.41  1.61  0.00
assign ( resid  102 and name   HB# ) ( resid  103 and name    HN )  4.22  2.42  0.00
assign ( resid  102 and name   HB# ) ( resid  104 and name    HN )  4.73  2.93  0.50
assign ( resid  103 and name    HA ) ( resid  106 and name    HN )  5.83  4.03  0.00
assign ( resid  103 and name    HN ) ( resid  103 and name   HD# )  5.45  3.65  0.00
assign ( resid  103 and name    HN ) ( resid  103 and name   HE# )  5.02  3.22  0.50
assign ( resid  103 and name   HB# ) ( resid  104 and name    HN )  3.98  2.18  0.00
assign ( resid  103 and name   HD# ) ( resid  104 and name    HN )  5.71  3.91  0.00
assign ( resid  104 and name    HN ) ( resid  104 and name   HB# )  3.08  1.28  0.00
assign ( resid  104 and name   HB# ) ( resid  105 and name    HN )  4.09  2.29  0.00
assign ( resid  104 and name   HB# ) ( resid  107 and name    HN )  4.75  2.95  1.00
assign ( resid  105 and name    HN ) ( resid  107 and name    HN )  5.09  3.29  0.00
assign ( resid  106 and name    HA ) ( resid  107 and name    HN )  3.50  1.70  0.00
assign ( resid  106 and name    HN ) ( resid  107 and name    HB )  5.41  3.61  0.00
assign ( resid  106 and name    HN ) ( resid  107 and name    HN )  3.29  1.49  0.50
assign ( resid  106 and name    HN ) ( resid  107 and name   HG# )  4.99  3.19  0.00
assign ( resid  107 and name    HA ) ( resid  107 and name   HG# )  3.06  1.26  0.00
assign ( resid  107 and name    HA ) ( resid  107 and name  HG1# )  3.65  1.85  0.00
assign ( resid  107 and name    HA ) ( resid  107 and name  HG2# )  3.65  1.85  0.00
assign ( resid  107 and name    HA ) ( resid  108 and name    HN )  3.30  1.50  0.00
assign ( resid  107 and name    HB ) ( resid  108 and name    HN )  4.87  3.07  0.00
assign ( resid  107 and name    HN ) ( resid  107 and name    HB )  3.54  1.74  0.00
assign ( resid  107 and name    HN ) ( resid  107 and name   HG# )  3.50  1.70  0.00
assign ( resid  107 and name    HN ) ( resid  108 and name    HN )  4.47  2.67  0.00
assign ( resid  107 and name   HG# ) ( resid  108 and name    HN )  3.59  1.79  0.00
assign ( resid  107 and name   HG# ) ( resid  109 and name    HN )  5.11  3.31  0.00
assign ( resid  108 and name    HA ) ( resid  108 and name   HD# )  3.95  2.15  0.00
assign ( resid  108 and name    HA ) ( resid  109 and name    HN )  3.07  1.27  0.00
assign ( resid  108 and name    HN ) ( resid  109 and name    HN )  4.67  2.87  0.00
assign ( resid  108 and name   HB1 ) ( resid  109 and name    HN )  3.97  2.17  0.00
assign ( resid  108 and name   HB2 ) ( resid  109 and name    HN )  3.97  2.17  0.00
assign ( resid  108 and name   HD# ) ( resid  109 and name    HN )  5.19  3.39  0.00
assign ( resid  109 and name    HA ) ( resid  110 and name    HN )  3.15  1.35  0.00
assign ( resid  109 and name   HB1 ) ( resid  110 and name    HN )  4.33  2.53  0.00
assign ( resid  109 and name   HB2 ) ( resid  110 and name    HN )  4.33  2.53  1.00
assign ( resid  110 and name    HA ) ( resid  111 and name    HN )  3.07  1.27  0.00
assign ( resid  110 and name    HN ) ( resid  110 and name   HB# )  4.00  2.20  0.00
assign ( resid  110 and name    HN ) ( resid  110 and name   HG# )  4.24  2.44  0.00
assign ( resid  110 and name   HD# ) ( resid  111 and name    HA )  5.94  4.14  0.00
assign ( resid  110 and name   HD# ) ( resid  112 and name   HG# )  4.01  2.21  0.00
assign ( resid  110 and name   HD# ) ( resid  112 and name  HG1# )  4.97  3.17  0.00
assign ( resid  110 and name   HD# ) ( resid  112 and name  HG2# )  4.97  3.17  0.00
assign ( resid  110 and name   HG# ) ( resid  111 and name    HB )  3.77  1.97  1.50
assign ( resid  110 and name   HG# ) ( resid  111 and name    HN )  3.49  1.69  0.00
assign ( resid  110 and name   HG# ) ( resid  111 and name  HD1# )  4.89  3.09  0.00
assign ( resid  111 and name    HA ) ( resid  111 and name  HD1# )  3.62  1.82  0.00
assign ( resid  111 and name    HA ) ( resid  111 and name  HG2# )  3.57  1.77  0.00
assign ( resid  111 and name    HA ) ( resid  112 and name    HN )  3.47  1.67  0.00
assign ( resid  111 and name    HB ) ( resid  111 and name  HD1# )  3.91  2.11  0.00
assign ( resid  111 and name    HN ) ( resid  111 and name    HB )  3.16  1.36  0.00
assign ( resid  111 and name    HN ) ( resid  111 and name  HD1# )  4.39  2.59  0.00
assign ( resid  111 and name    HN ) ( resid  111 and name  HG1# )  3.88  2.08  0.00
assign ( resid  111 and name    HN ) ( resid  112 and name    HN )  4.94  3.14  0.00
assign ( resid  111 and name  HD1# ) ( resid  112 and name    HN )  4.64  2.84  0.00
assign ( resid  111 and name  HG1# ) ( resid  112 and name    HN )  5.69  3.89  0.00
assign ( resid  111 and name  HG2# ) ( resid  111 and name  HG1# )  3.67  1.87  0.00
assign ( resid  111 and name  HG2# ) ( resid  112 and name    HN )  4.05  2.25  0.00
assign ( resid  111 and name  HG2# ) ( resid  113 and name    HN )  5.14  3.34  0.00
assign ( resid  111 and name  HG2# ) ( resid  113 and name   HE# )  5.15  3.35  0.00
assign ( resid  112 and name    HA ) ( resid  112 and name  HG1# )  3.30  1.50  0.00
assign ( resid  112 and name    HA ) ( resid  112 and name  HG2# )  3.30  1.50  0.00
assign ( resid  112 and name    HA ) ( resid  113 and name    HN )  3.37  1.57  0.00
assign ( resid  112 and name    HB ) ( resid  113 and name    HN )  4.85  3.05  0.00
assign ( resid  112 and name    HN ) ( resid  112 and name    HB )  4.00  2.20  0.00
assign ( resid  112 and name    HN ) ( resid  112 and name   HG# )  3.64  1.84  0.00
assign ( resid  112 and name    HN ) ( resid  112 and name  HG1# )  4.21  2.41  0.00
assign ( resid  112 and name    HN ) ( resid  112 and name  HG2# )  4.21  2.41  0.00
assign ( resid  112 and name   HG# ) ( resid  113 and name    HN )  3.86  2.06  0.00
assign ( resid  113 and name    HA ) ( resid  114 and name    HN )  3.19  1.39  0.00
assign ( resid  113 and name    HN ) ( resid  113 and name   HB# )  3.58  1.78  0.00
assign ( resid  113 and name    HN ) ( resid  113 and name   HD# )  5.31  3.51  0.00
assign ( resid  113 and name    HN ) ( resid  114 and name    HN )  4.83  3.03  0.00
assign ( resid  113 and name   HB# ) ( resid  113 and name   HE# )  4.23  2.43  0.00
assign ( resid  113 and name   HB# ) ( resid  114 and name    HA )  3.68  1.88  1.00 !+1.0
assign ( resid  113 and name   HB# ) ( resid  114 and name    HN )  3.47  1.67  0.50
assign ( resid  114 and name    HA ) ( resid  115 and name    HN )  3.29  1.49  0.00
assign ( resid  114 and name    HN ) ( resid  114 and name    HB )  3.98  2.18  0.00
assign ( resid  114 and name    HN ) ( resid  114 and name   HG# )  3.48  1.68  0.00
assign ( resid  114 and name    HN ) ( resid  114 and name  HG1# )  4.44  2.64  0.00
assign ( resid  114 and name    HN ) ( resid  114 and name  HG2# )  4.44  2.64  0.00
assign ( resid  114 and name   HG# ) ( resid  115 and name    HN )  4.49  2.69  0.00
assign ( resid  115 and name    HA ) ( resid  115 and name   HD# )  3.60  1.80  0.00
assign ( resid  115 and name    HA ) ( resid  116 and name    HN )  3.42  1.62  0.00
assign ( resid  115 and name    HN ) ( resid  115 and name    HG )  5.13  3.33  0.00
assign ( resid  115 and name    HN ) ( resid  115 and name   HB1 )  3.93  2.13  0.00
assign ( resid  115 and name    HN ) ( resid  115 and name   HB2 )  3.93  2.13  1.00
assign ( resid  115 and name    HN ) ( resid  115 and name   HD# )  5.07  3.27  0.00
assign ( resid  115 and name   HB1 ) ( resid  116 and name    HN )  4.21  2.41  0.00
assign ( resid  115 and name   HB2 ) ( resid  116 and name    HN )  4.21  2.41  1.00
assign ( resid  115 and name   HD# ) ( resid  116 and name    HN )  4.13  2.33  0.00
assign (resid    2 and name C    ) (resid    3 and name N    )
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assign (resid    3 and name N    ) (resid    3 and name CA   )
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assign (resid    4 and name C    ) (resid    5 and name N    )
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assign (resid    5 and name N    ) (resid    5 and name CA   )
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assign (resid    5 and name C    ) (resid    6 and name N    )
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assign (resid    6 and name N    ) (resid    6 and name CA   )
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assign (resid    6 and name C    ) (resid    7 and name N    )
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assign (resid    7 and name N    ) (resid    7 and name CA   )
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assign (resid    8 and name C    ) (resid    9 and name N    )
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assign (resid    9 and name N    ) (resid    9 and name CA   )
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assign (resid    9 and name C    ) (resid   10 and name N    )
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assign (resid   10 and name N    ) (resid   10 and name CA   )
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assign (resid   10 and name C    ) (resid   11 and name N    )
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assign (resid   11 and name N    ) (resid   11 and name CA   )
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assign (resid   13 and name C    ) (resid   14 and name N    )
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assign (resid   14 and name N    ) (resid   14 and name CA   )
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assign (resid   14 and name C    ) (resid   15 and name N    )
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assign (resid   15 and name N    ) (resid   15 and name CA   )
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assign (resid   15 and name C    ) (resid   16 and name N    )
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assign (resid   16 and name C    ) (resid   17 and name N    )
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assign (resid   17 and name C    ) (resid   18 and name N    )
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assign (resid   18 and name N    ) (resid   18 and name CA   )
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assign (resid   18 and name C    ) (resid   19 and name N    )
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assign (resid   19 and name N    ) (resid   19 and name CA   )
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assign (resid   19 and name C    ) (resid   20 and name N    )
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assign (resid   20 and name N    ) (resid   20 and name CA   )
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assign (resid   20 and name C    ) (resid   21 and name N    )
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assign (resid   21 and name N    ) (resid   21 and name CA   )
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assign (resid   21 and name C    ) (resid   22 and name N    )
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assign (resid   22 and name N    ) (resid   22 and name CA   )
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assign (resid   22 and name C    ) (resid   23 and name N    )
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assign (resid   23 and name N    ) (resid   23 and name CA   )
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assign (resid   23 and name C    ) (resid   24 and name N    )
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assign (resid   24 and name N    ) (resid   24 and name CA   )
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assign (resid   24 and name C    ) (resid   25 and name N    )
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assign (resid   25 and name N    ) (resid   25 and name CA   )
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assign (resid   25 and name C    ) (resid   26 and name N    )
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assign (resid   26 and name N    ) (resid   26 and name CA   )
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assign (resid   26 and name C    ) (resid   27 and name N    )
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assign (resid   27 and name N    ) (resid   27 and name CA   )
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assign (resid   29 and name C    ) (resid   30 and name N    )
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assign (resid   30 and name N    ) (resid   30 and name CA   )
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assign (resid   30 and name C    ) (resid   31 and name N    )
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assign (resid   31 and name N    ) (resid   31 and name CA   )
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assign (resid   31 and name C    ) (resid   32 and name N    )
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assign (resid   32 and name N    ) (resid   32 and name CA   )
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assign (resid   32 and name C    ) (resid   33 and name N    )
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assign (resid   33 and name N    ) (resid   33 and name CA   )
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assign (resid   34 and name C    ) (resid   35 and name N    )
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assign (resid   35 and name N    ) (resid   35 and name CA   )
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assign (resid   36 and name C    ) (resid   37 and name N    )
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assign (resid   37 and name N    ) (resid   37 and name CA   )
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assign (resid   37 and name C    ) (resid   38 and name N    )
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assign (resid   38 and name N    ) (resid   38 and name CA   )
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assign (resid   38 and name C    ) (resid   39 and name N    )
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assign (resid   39 and name N    ) (resid   39 and name CA   )
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assign (resid   39 and name C    ) (resid   40 and name N    )
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assign (resid   40 and name N    ) (resid   40 and name CA   )
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assign (resid   40 and name C    ) (resid   41 and name N    )
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assign (resid   41 and name N    ) (resid   41 and name CA   )
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assign (resid   41 and name C    ) (resid   42 and name N    )
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assign (resid   42 and name N    ) (resid   42 and name CA   )
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assign (resid   42 and name C    ) (resid   43 and name N    )
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assign (resid   43 and name N    ) (resid   43 and name CA   )
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assign (resid   44 and name C    ) (resid   45 and name N    )
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assign (resid   45 and name N    ) (resid   45 and name CA   )
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assign (resid   48 and name C    ) (resid   49 and name N    )
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assign (resid   49 and name N    ) (resid   49 and name CA   )
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assign (resid   49 and name C    ) (resid   50 and name N    )
       (resid   50 and name CA   ) (resid   50 and name C    )    1.0  -75.9   16.7 2
assign (resid   50 and name N    ) (resid   50 and name CA   )
       (resid   50 and name C    ) (resid   51 and name N    )    1.0  124.9   18.8 2
assign (resid   50 and name C    ) (resid   51 and name N    )
       (resid   51 and name CA   ) (resid   51 and name C    )    1.0  -90.0   19.0 2
assign (resid   51 and name N    ) (resid   51 and name CA   )
       (resid   51 and name C    ) (resid   52 and name N    )    1.0  -38.4   19.6 2
assign (resid   51 and name C    ) (resid   52 and name N    )
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assign (resid   52 and name N    ) (resid   52 and name CA   )
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assign (resid   52 and name C    ) (resid   53 and name N    )
       (resid   53 and name CA   ) (resid   53 and name C    )    1.0 -145.8   24.6 2
assign (resid   53 and name N    ) (resid   53 and name CA   )
       (resid   53 and name C    ) (resid   54 and name N    )    1.0  154.2   14.4 2
assign (resid   53 and name C    ) (resid   54 and name N    )
       (resid   54 and name CA   ) (resid   54 and name C    )    1.0 -142.8   34.4 2
assign (resid   54 and name N    ) (resid   54 and name CA   )
       (resid   54 and name C    ) (resid   55 and name N    )    1.0  138.9   22.7 2
assign (resid   54 and name C    ) (resid   55 and name N    )
       (resid   55 and name CA   ) (resid   55 and name C    )    1.0 -110.8   33.1 2
assign (resid   55 and name N    ) (resid   55 and name CA   )
       (resid   55 and name C    ) (resid   56 and name N    )    1.0  126.2   18.7 2
assign (resid   55 and name C    ) (resid   56 and name N    )
       (resid   56 and name CA   ) (resid   56 and name C    )    1.0  -79.7   29.1 2
assign (resid   56 and name N    ) (resid   56 and name CA   )
       (resid   56 and name C    ) (resid   57 and name N    )    1.0  128.7   49.5 2
assign (resid   56 and name C    ) (resid   57 and name N    )
       (resid   57 and name CA   ) (resid   57 and name C    )    1.0  -78.3   26.7 2
assign (resid   57 and name N    ) (resid   57 and name CA   )
       (resid   57 and name C    ) (resid   58 and name N    )    1.0  -38.0   10.8 2
assign (resid   58 and name C    ) (resid   59 and name N    )
       (resid   59 and name CA   ) (resid   59 and name C    )    1.0 -122.2   52.3 2
assign (resid   59 and name N    ) (resid   59 and name CA   )
       (resid   59 and name C    ) (resid   60 and name N    )    1.0  130.4   60.2 2
assign (resid   60 and name C    ) (resid   61 and name N    )
       (resid   61 and name CA   ) (resid   61 and name C    )    1.0  -56.1   12.7 2
assign (resid   61 and name N    ) (resid   61 and name CA   )
       (resid   61 and name C    ) (resid   62 and name N    )    1.0  132.5   10.0 2
assign (resid   61 and name C    ) (resid   62 and name N    )
       (resid   62 and name CA   ) (resid   62 and name C    )    1.0   90.5   24.4 2
assign (resid   62 and name N    ) (resid   62 and name CA   )
       (resid   62 and name C    ) (resid   63 and name N    )    1.0  -12.3   30.2 2
assign (resid   62 and name C    ) (resid   63 and name N    )
       (resid   63 and name CA   ) (resid   63 and name C    )    1.0  -99.5   60.6 2
assign (resid   63 and name N    ) (resid   63 and name CA   )
       (resid   63 and name C    ) (resid   64 and name N    )    1.0  149.1   54.5 2
assign (resid   63 and name C    ) (resid   64 and name N    )
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assign (resid   64 and name N    ) (resid   64 and name CA   )
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assign (resid   64 and name C    ) (resid   65 and name N    )
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assign (resid   65 and name N    ) (resid   65 and name CA   )
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assign (resid   65 and name C    ) (resid   66 and name N    )
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assign (resid   66 and name N    ) (resid   66 and name CA   )
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assign (resid   66 and name C    ) (resid   67 and name N    )
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assign (resid   67 and name N    ) (resid   67 and name CA   )
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assign (resid   67 and name C    ) (resid   68 and name N    )
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assign (resid   68 and name N    ) (resid   68 and name CA   )
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assign (resid   68 and name C    ) (resid   69 and name N    )
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assign (resid   69 and name N    ) (resid   69 and name CA   )
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assign (resid   69 and name C    ) (resid   70 and name N    )
       (resid   70 and name CA   ) (resid   70 and name C    )    1.0  -99.4   32.4 2
assign (resid   70 and name N    ) (resid   70 and name CA   )
       (resid   70 and name C    ) (resid   71 and name N    )    1.0  137.3   21.2 2
assign (resid   70 and name C    ) (resid   71 and name N    )
       (resid   71 and name CA   ) (resid   71 and name C    )    1.0 -122.9   29.3 2
assign (resid   71 and name N    ) (resid   71 and name CA   )
       (resid   71 and name C    ) (resid   72 and name N    )    1.0  126.6   16.3 2
assign (resid   71 and name C    ) (resid   72 and name N    )
       (resid   72 and name CA   ) (resid   72 and name C    )    1.0 -110.6   37.8 2
assign (resid   72 and name N    ) (resid   72 and name CA   )
       (resid   72 and name C    ) (resid   73 and name N    )    1.0  113.7   10.0 2
assign (resid   72 and name C    ) (resid   73 and name N    )
       (resid   73 and name CA   ) (resid   73 and name C    )    1.0 -106.2   33.2 2
assign (resid   73 and name N    ) (resid   73 and name CA   )
       (resid   73 and name C    ) (resid   74 and name N    )    1.0  122.8   25.8 2
assign (resid   73 and name C    ) (resid   74 and name N    )
       (resid   74 and name CA   ) (resid   74 and name C    )    1.0 -145.4   38.8 2
assign (resid   74 and name N    ) (resid   74 and name CA   )
       (resid   74 and name C    ) (resid   75 and name N    )    1.0  161.7   38.6 2
assign (resid   75 and name C    ) (resid   76 and name N    )
       (resid   76 and name CA   ) (resid   76 and name C    )    1.0 -107.0  127.4 2
assign (resid   76 and name N    ) (resid   76 and name CA   )
       (resid   76 and name C    ) (resid   77 and name N    )    1.0  134.8   54.7 2
assign (resid   84 and name C    ) (resid   85 and name N    )
       (resid   85 and name CA   ) (resid   85 and name C    )    1.0   79.2   28.5 2
assign (resid   85 and name N    ) (resid   85 and name CA   )
       (resid   85 and name C    ) (resid   86 and name N    )    1.0   10.9   67.0 2
assign (resid   85 and name C    ) (resid   86 and name N    )
       (resid   86 and name CA   ) (resid   86 and name C    )    1.0 -113.2   36.7 2
assign (resid   86 and name N    ) (resid   86 and name CA   )
       (resid   86 and name C    ) (resid   87 and name N    )    1.0  121.7   54.3 2
assign (resid   87 and name C    ) (resid   88 and name N    )
       (resid   88 and name CA   ) (resid   88 and name C    )    1.0 -112.4   46.4 2
assign (resid   88 and name N    ) (resid   88 and name CA   )
       (resid   88 and name C    ) (resid   89 and name N    )    1.0  131.8   27.3 2
assign (resid   88 and name C    ) (resid   89 and name N    )
       (resid   89 and name CA   ) (resid   89 and name C    )    1.0 -132.1   23.7 2
assign (resid   89 and name N    ) (resid   89 and name CA   )
       (resid   89 and name C    ) (resid   90 and name N    )    1.0  153.1   27.4 2
assign (resid   89 and name C    ) (resid   90 and name N    )
       (resid   90 and name CA   ) (resid   90 and name C    )    1.0 -129.8   38.9 2
assign (resid   90 and name N    ) (resid   90 and name CA   )
       (resid   90 and name C    ) (resid   91 and name N    )    1.0  145.4   23.5 2
assign (resid   90 and name C    ) (resid   91 and name N    )
       (resid   91 and name CA   ) (resid   91 and name C    )    1.0 -130.4   10.0 2
assign (resid   91 and name N    ) (resid   91 and name CA   )
       (resid   91 and name C    ) (resid   92 and name N    )    1.0  137.4   19.9 2
assign (resid   91 and name C    ) (resid   92 and name N    )
       (resid   92 and name CA   ) (resid   92 and name C    )    1.0  -78.5   31.4 2
assign (resid   92 and name N    ) (resid   92 and name CA   )
       (resid   92 and name C    ) (resid   93 and name N    )    1.0  132.2   24.1 2
assign (resid   92 and name C    ) (resid   93 and name N    )
       (resid   93 and name CA   ) (resid   93 and name C    )    1.0  -81.3   60.0 2
assign (resid   93 and name N    ) (resid   93 and name CA   )
       (resid   93 and name C    ) (resid   94 and name N    )    1.0  131.2   47.0 2
assign (resid   94 and name C    ) (resid   95 and name N    )
       (resid   95 and name CA   ) (resid   95 and name C    )    1.0  -78.9   30.0 2
assign (resid   95 and name N    ) (resid   95 and name CA   )
       (resid   95 and name C    ) (resid   96 and name N    )    1.0  -10.2   30.7 2
assign (resid   99 and name C    ) (resid  100 and name N    )
       (resid  100 and name CA   ) (resid  100 and name C    )    1.0  -68.7   30.2 2
assign (resid  100 and name N    ) (resid  100 and name CA   )
       (resid  100 and name C    ) (resid  101 and name N    )    1.0  -33.0   48.8 2
assign (resid  100 and name C    ) (resid  101 and name N    )
       (resid  101 and name CA   ) (resid  101 and name C    )    1.0  -68.4   20.6 2
assign (resid  101 and name N    ) (resid  101 and name CA   )
       (resid  101 and name C    ) (resid  102 and name N    )    1.0  -37.6   30.0 2
assign (resid  101 and name C    ) (resid  102 and name N    )
       (resid  102 and name CA   ) (resid  102 and name C    )    1.0  -70.6   20.7 2
assign (resid  102 and name N    ) (resid  102 and name CA   )
       (resid  102 and name C    ) (resid  103 and name N    )    1.0  -28.8   42.2 2
assign (resid  102 and name C    ) (resid  103 and name N    )
       (resid  103 and name CA   ) (resid  103 and name C    )    1.0  -68.4   24.1 2
assign (resid  103 and name N    ) (resid  103 and name CA   )
       (resid  103 and name C    ) (resid  104 and name N    )    1.0  -34.0   47.1 2
assign (resid  103 and name C    ) (resid  104 and name N    )
       (resid  104 and name CA   ) (resid  104 and name C    )    1.0  -73.1   28.1 2
assign (resid  104 and name N    ) (resid  104 and name CA   )
       (resid  104 and name C    ) (resid  105 and name N    )    1.0  -26.5   58.6 2
assign (resid  104 and name C    ) (resid  105 and name N    )
       (resid  105 and name CA   ) (resid  105 and name C    )    1.0  -92.7   38.7 2
assign (resid  105 and name N    ) (resid  105 and name CA   )
       (resid  105 and name C    ) (resid  106 and name N    )    1.0  -12.3   50.0 2
assign (resid  106 and name C    ) (resid  107 and name N    )
       (resid  107 and name CA   ) (resid  107 and name C    )    1.0 -125.8   42.3 2
assign (resid  107 and name N    ) (resid  107 and name CA   )
       (resid  107 and name C    ) (resid  108 and name N    )    1.0  139.3   33.1 2
assign (resid  107 and name C    ) (resid  108 and name N    )
       (resid  108 and name CA   ) (resid  108 and name C    )    1.0 -125.9   37.7 2
assign (resid  108 and name N    ) (resid  108 and name CA   )
       (resid  108 and name C    ) (resid  109 and name N    )    1.0  157.5   26.7 2
assign (resid  108 and name C    ) (resid  109 and name N    )
       (resid  109 and name CA   ) (resid  109 and name C    )    1.0 -126.8   54.5 2
assign (resid  109 and name N    ) (resid  109 and name CA   )
       (resid  109 and name C    ) (resid  110 and name N    )    1.0  156.9   25.2 2
assign (resid  109 and name C    ) (resid  110 and name N    )
       (resid  110 and name CA   ) (resid  110 and name C    )    1.0 -143.3   26.4 2
assign (resid  110 and name N    ) (resid  110 and name CA   )
       (resid  110 and name C    ) (resid  111 and name N    )    1.0  146.1   21.9 2
assign (resid  110 and name C    ) (resid  111 and name N    )
       (resid  111 and name CA   ) (resid  111 and name C    )    1.0  -96.3   13.6 2
assign (resid  111 and name N    ) (resid  111 and name CA   )
       (resid  111 and name C    ) (resid  112 and name N    )    1.0  117.6   28.9 2
assign (resid  111 and name C    ) (resid  112 and name N    )
       (resid  112 and name CA   ) (resid  112 and name C    )    1.0 -111.7   35.9 2
assign (resid  112 and name N    ) (resid  112 and name CA   )
       (resid  112 and name C    ) (resid  113 and name N    )    1.0  123.1   19.9 2
assign (resid  112 and name C    ) (resid  113 and name N    )
       (resid  113 and name CA   ) (resid  113 and name C    )    1.0 -111.7   28.0 2
assign (resid  113 and name N    ) (resid  113 and name CA   )
       (resid  113 and name C    ) (resid  114 and name N    )    1.0  131.8   28.3 2
assign (resid  113 and name C    ) (resid  114 and name N    )
       (resid  114 and name CA   ) (resid  114 and name C    )    1.0 -109.4   18.3 2
assign (resid  114 and name N    ) (resid  114 and name CA   )
       (resid  114 and name C    ) (resid  115 and name N    )    1.0  115.2   20.3 2
assign (resid  114 and name C    ) (resid  115 and name N    )
       (resid  115 and name CA   ) (resid  115 and name C    )    1.0  -95.3   54.7 2
assign (resid  115 and name N    ) (resid  115 and name CA   )
       (resid  115 and name C    ) (resid  116 and name N    )    1.0  148.1   31.1 2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           1H       MET   1  10.337  13.887   3.007
    2    H2   MET   1           2H       MET   1   9.695  12.722   4.063
    3    H3   MET   1           3H       MET   1   9.350  12.649   2.402
    4    HA   MET   1           HA       MET   1  11.889  12.455   2.122
    5    HB2  MET   1           1HB      MET   1  11.433  11.532   4.991
    6    HB3  MET   1           2HB      MET   1  12.927  11.298   4.085
    7    HG2  MET   1           1HG      MET   1  11.728  14.029   4.711
    8    HG3  MET   1           2HG      MET   1  13.011  13.271   5.651
    9    HE1  MET   1           3HE      MET   1  14.398  15.495   5.267
   10    HE2  MET   1           1HE      MET   1  13.055  16.119   4.298
   11    HE3  MET   1           2HE      MET   1  14.703  16.198   3.681
   12    H    ASP   2           H        ASP   2  10.184  11.364   0.703
   13    HA   ASP   2           HA       ASP   2   9.225   9.482  -0.200
   14    HB2  ASP   2           1HB      ASP   2  11.665   8.865  -0.184
   15    HB3  ASP   2           2HB      ASP   2  11.419   8.046   1.354
   16    H    LEU   3           H        LEU   3   7.260   9.738   0.997
   17    HA   LEU   3           HA       LEU   3   6.851   8.708   3.575
   18    HB2  LEU   3           1HB      LEU   3   5.051   9.625   1.344
   19    HB3  LEU   3           2HB      LEU   3   4.290   8.723   2.653
   20    HG   LEU   3           HG       LEU   3   5.199  10.379   4.295
   21   HD11  LEU   3          1HD1      LEU   3   6.242  11.799   1.814
   22   HD12  LEU   3          2HD1      LEU   3   7.206  11.130   3.130
   23   HD13  LEU   3          3HD1      LEU   3   6.176  12.526   3.422
   24   HD21  LEU   3          3HD2      LEU   3   2.940  10.712   3.325
   25   HD22  LEU   3          1HD2      LEU   3   3.642  11.654   2.009
   26   HD23  LEU   3          2HD2      LEU   3   3.715  12.258   3.664
   27    HA   PRO   4           HA       PRO   4   6.468   4.287   3.141
   28    HB2  PRO   4           1HB      PRO   4   3.699   4.500   4.384
   29    HB3  PRO   4           2HB      PRO   4   5.036   3.411   4.833
   30    HG2  PRO   4           1HG      PRO   4   4.576   5.531   6.326
   31    HG3  PRO   4           2HG      PRO   4   6.248   5.162   5.864
   32    HD2  PRO   4           1HD      PRO   4   4.372   7.231   4.660
   33    HD3  PRO   4           2HD      PRO   4   6.069   7.393   5.146
   34    H    ILE   5           H        ILE   5   3.773   6.259   2.087
   35    HA   ILE   5           HA       ILE   5   3.041   4.268  -0.032
   36    HB   ILE   5           HB       ILE   5   1.259   6.329   1.341
   37   HG12  ILE   5          1HG1      ILE   5   1.118   3.268   1.491
   38   HG13  ILE   5          2HG1      ILE   5   1.894   4.249   2.724
   39   HG21  ILE   5          1HG2      ILE   5  -0.580   5.156   0.029
   40   HG22  ILE   5          2HG2      ILE   5   0.663   4.241  -0.817
   41   HG23  ILE   5          3HG2      ILE   5   0.567   5.989  -1.014
   42   HD11  ILE   5          3HD1      ILE   5  -0.443   3.655   3.317
   43   HD12  ILE   5          1HD1      ILE   5  -1.016   4.549   1.912
   44   HD13  ILE   5          2HD1      ILE   5  -0.184   5.395   3.219
   45    H    THR   6           H        THR   6   3.325   4.921  -2.047
   46    HA   THR   6           HA       THR   6   3.451   7.845  -2.703
   47    HB   THR   6           HB       THR   6   5.306   7.395  -4.246
   48    HG1  THR   6           HG1      THR   6   4.512   4.938  -4.043
   49   HG21  THR   6          3HG2      THR   6   7.075   6.938  -2.595
   50   HG22  THR   6          1HG2      THR   6   5.880   6.276  -1.477
   51   HG23  THR   6          2HG2      THR   6   5.848   7.992  -1.889
   52    H    LEU   7           H        LEU   7   1.916   8.314  -4.101
   53    HA   LEU   7           HA       LEU   7   0.810   6.233  -5.915
   54    HB2  LEU   7           1HB      LEU   7  -0.317   8.967  -5.194
   55    HB3  LEU   7           2HB      LEU   7  -1.144   7.679  -6.070
   56    HG   LEU   7           HG       LEU   7  -0.230   7.570  -3.157
   57   HD11  LEU   7          1HD1      LEU   7  -2.198   9.016  -3.554
   58   HD12  LEU   7          2HD1      LEU   7  -2.637   7.584  -2.632
   59   HD13  LEU   7          3HD1      LEU   7  -3.023   7.680  -4.347
   60   HD21  LEU   7          3HD2      LEU   7  -0.097   5.305  -3.891
   61   HD22  LEU   7          1HD2      LEU   7  -1.518   5.446  -4.928
   62   HD23  LEU   7          2HD2      LEU   7  -1.694   5.403  -3.171
   63    H    SER   8           H        SER   8   0.685   6.549  -8.109
   64    HA   SER   8           HA       SER   8   2.682   8.312  -9.304
   65    HB2  SER   8           1HB      SER   8   2.358   6.082 -10.249
   66    HB3  SER   8           2HB      SER   8   0.653   6.416 -10.539
   67    HG   SER   8           HG       SER   8   1.271   7.253 -12.354
   68    H    LYS   9           H        LYS   9   0.419   9.585  -7.920
   69    HA   LYS   9           HA       LYS   9  -1.372  10.667  -9.901
   70    HB2  LYS   9           1HB      LYS   9  -1.800  10.419  -7.380
   71    HB3  LYS   9           2HB      LYS   9  -0.790  11.840  -7.145
   72    HG2  LYS   9           1HG      LYS   9  -2.318  13.162  -8.607
   73    HG3  LYS   9           2HG      LYS   9  -3.309  11.728  -8.862
   74    HD2  LYS   9           1HD      LYS   9  -3.790  11.634  -6.420
   75    HD3  LYS   9           2HD      LYS   9  -2.825  13.092  -6.183
   76    HE2  LYS   9           1HE      LYS   9  -4.354  14.359  -7.664
   77    HE3  LYS   9           2HE      LYS   9  -5.304  12.899  -7.935
   78    HZ1  LYS   9           3HZ      LYS   9  -5.985  14.603  -6.118
   79    HZ2  LYS   9           1HZ      LYS   9  -4.828  13.795  -5.181
   80    HZ3  LYS   9           2HZ      LYS   9  -6.147  12.940  -5.827
   81    H    GLU  10           H        GLU  10   1.065  10.951 -10.981
   82    HA   GLU  10           HA       GLU  10   2.476  13.352 -10.505
   83    HB2  GLU  10           1HB      GLU  10   2.119  11.818 -13.112
   84    HB3  GLU  10           2HB      GLU  10   3.371  13.024 -12.799
   85    HG2  GLU  10           1HG      GLU  10   4.255  11.620 -10.949
   86    HG3  GLU  10           2HG      GLU  10   3.009  10.416 -11.271
   87    H    THR  11           H        THR  11  -0.292  12.622 -12.576
   88    HA   THR  11           HA       THR  11  -0.690  15.537 -13.161
   89    HB   THR  11           HB       THR  11  -1.731  14.837 -15.237
   90    HG1  THR  11           HG1      THR  11  -2.084  12.738 -15.698
   91   HG21  THR  11          3HG2      THR  11   0.849  13.266 -14.841
   92   HG22  THR  11          1HG2      THR  11   0.776  14.997 -15.187
   93   HG23  THR  11          2HG2      THR  11   0.193  13.832 -16.376
   94    HA   PRO  12           HA       PRO  12  -4.166  14.323 -10.228
   95    HB2  PRO  12           1HB      PRO  12  -4.408  17.340 -10.616
   96    HB3  PRO  12           2HB      PRO  12  -4.730  16.384  -9.144
   97    HG2  PRO  12           1HG      PRO  12  -2.433  17.638  -9.302
   98    HG3  PRO  12           2HG      PRO  12  -2.410  15.922  -8.821
   99    HD2  PRO  12           1HD      PRO  12  -1.748  17.111 -11.547
  100    HD3  PRO  12           2HD      PRO  12  -0.899  15.819 -10.664
  101    H    PHE  13           H        PHE  13  -5.750  13.291 -11.394
  102    HA   PHE  13           HA       PHE  13  -7.757  14.812 -12.818
  103    HB2  PHE  13           1HB      PHE  13  -5.769  13.086 -14.340
  104    HB3  PHE  13           2HB      PHE  13  -7.411  13.249 -14.949
  105    HD1  PHE  13           HD1      PHE  13  -8.373  15.693 -15.123
  106    HD2  PHE  13           HD2      PHE  13  -4.161  14.809 -14.983
  107    HE1  PHE  13           HE1      PHE  13  -7.867  17.906 -16.116
  108    HE2  PHE  13           HE2      PHE  13  -3.664  17.024 -15.976
  109    HZ   PHE  13           HZ       PHE  13  -5.515  18.571 -16.541
  110    H    GLU  14           H        GLU  14  -9.460  13.966 -11.835
  111    HA   GLU  14           HA       GLU  14  -9.694  11.414 -10.701
  112    HB2  GLU  14           1HB      GLU  14 -11.224  13.318 -10.207
  113    HB3  GLU  14           2HB      GLU  14 -11.930  13.156 -11.809
  114    HG2  GLU  14           1HG      GLU  14 -13.381  12.062 -10.154
  115    HG3  GLU  14           2HG      GLU  14 -12.697  10.838 -11.209
  116    H    GLY  15           H        GLY  15 -10.479   9.449 -11.423
  117    HA2  GLY  15           1HA      GLY  15 -11.291   7.847 -12.924
  118    HA3  GLY  15           2HA      GLY  15 -11.478   9.070 -14.154
  119    H    GLU  16           H        GLU  16  -8.451   8.982 -12.527
  120    HA   GLU  16           HA       GLU  16  -7.125   7.747 -14.901
  121    HB2  GLU  16           1HB      GLU  16  -6.536  10.128 -14.355
  122    HB3  GLU  16           2HB      GLU  16  -5.899   9.592 -12.803
  123    HG2  GLU  16           1HG      GLU  16  -4.243   8.149 -13.968
  124    HG3  GLU  16           2HG      GLU  16  -4.908   8.627 -15.527
  125    H    GLU  17           H        GLU  17  -5.676   6.087 -14.647
  126    HA   GLU  17           HA       GLU  17  -5.958   4.481 -12.269
  127    HB2  GLU  17           1HB      GLU  17  -5.700   3.526 -14.572
  128    HB3  GLU  17           2HB      GLU  17  -4.037   4.107 -14.604
  129    HG2  GLU  17           1HG      GLU  17  -3.520   2.710 -12.603
  130    HG3  GLU  17           2HG      GLU  17  -5.187   2.142 -12.575
  131    H    ILE  18           H        ILE  18  -4.681   4.449 -10.522
  132    HA   ILE  18           HA       ILE  18  -2.084   5.951 -10.542
  133    HB   ILE  18           HB       ILE  18  -2.517   6.377  -8.113
  134   HG12  ILE  18          1HG1      ILE  18  -5.360   5.388  -8.690
  135   HG13  ILE  18          2HG1      ILE  18  -4.171   4.457  -7.789
  136   HG21  ILE  18          1HG2      ILE  18  -4.671   7.428  -9.998
  137   HG22  ILE  18          2HG2      ILE  18  -3.052   8.102  -9.819
  138   HG23  ILE  18          3HG2      ILE  18  -4.189   8.182  -8.479
  139   HD11  ILE  18          3HD1      ILE  18  -5.240   7.185  -6.992
  140   HD12  ILE  18          1HD1      ILE  18  -4.007   6.274  -6.122
  141   HD13  ILE  18          2HD1      ILE  18  -5.643   5.644  -6.243
  142    H    THR  19           H        THR  19  -0.345   5.045  -9.569
  143    HA   THR  19           HA       THR  19  -0.442   2.125  -9.208
  144    HB   THR  19           HB       THR  19   1.973   3.987  -9.071
  145    HG1  THR  19           HG1      THR  19   2.105   3.806 -11.187
  146   HG21  THR  19          3HG2      THR  19   1.734   0.998  -9.595
  147   HG22  THR  19          1HG2      THR  19   2.337   1.723  -8.104
  148   HG23  THR  19          2HG2      THR  19   3.231   1.925  -9.606
  149    H    VAL  20           H        VAL  20  -1.003   1.417  -7.244
  150    HA   VAL  20           HA       VAL  20  -0.361   3.019  -4.833
  151    HB   VAL  20           HB       VAL  20  -2.023   0.464  -5.042
  152   HG11  VAL  20          1HG1      VAL  20  -1.778   2.617  -2.876
  153   HG12  VAL  20          2HG1      VAL  20  -1.226   0.947  -2.747
  154   HG13  VAL  20          3HG1      VAL  20  -2.943   1.303  -2.852
  155   HG21  VAL  20          3HG2      VAL  20  -2.921   3.383  -5.067
  156   HG22  VAL  20          1HG2      VAL  20  -3.995   1.985  -4.992
  157   HG23  VAL  20          2HG2      VAL  20  -3.021   2.269  -6.430
  158    H    SER  21           H        SER  21   1.547   2.608  -3.894
  159    HA   SER  21           HA       SER  21   2.547  -0.207  -3.731
  160    HB2  SER  21           1HB      SER  21   4.788   0.589  -4.071
  161    HB3  SER  21           2HB      SER  21   3.822   1.212  -5.398
  162    HG   SER  21           HG       SER  21   5.139   2.523  -3.397
  163    H    ALA  22           H        ALA  22   3.131  -0.840  -1.767
  164    HA   ALA  22           HA       ALA  22   3.272   1.150   0.467
  165    HB1  ALA  22           3HB      ALA  22   1.291  -0.330   0.577
  166    HB2  ALA  22           1HB      ALA  22   2.413  -0.669   1.896
  167    HB3  ALA  22           2HB      ALA  22   2.334  -1.748   0.500
  168    H    ARG  23           H        ARG  23   5.181   1.263   1.449
  169    HA   ARG  23           HA       ARG  23   7.329  -0.614   0.774
  170    HB2  ARG  23           1HB      ARG  23   7.294   1.816   2.615
  171    HB3  ARG  23           2HB      ARG  23   8.733   0.904   2.152
  172    HG2  ARG  23           1HG      ARG  23   8.308   1.453  -0.236
  173    HG3  ARG  23           2HG      ARG  23   6.883   2.380   0.230
  174    HD2  ARG  23           1HD      ARG  23   8.796   3.891  -0.108
  175    HD3  ARG  23           2HD      ARG  23   8.342   3.879   1.596
  176    HE   ARG  23           HE       ARG  23  10.319   1.894   1.101
  177   HH11  ARG  23          1HH2      ARG  23   9.920   5.343   1.357
  178   HH12  ARG  23          2HH2      ARG  23  11.561   5.623   1.834
  179   HH21  ARG  23          1HH1      ARG  23  12.449   2.276   1.724
  180   HH22  ARG  23          2HH1      ARG  23  12.988   3.891   2.040
  181    H    VAL  24           H        VAL  24   7.525  -2.470   1.854
  182    HA   VAL  24           HA       VAL  24   6.467  -2.741   4.622
  183    HB   VAL  24           HB       VAL  24   7.464  -4.917   2.723
  184   HG11  VAL  24          1HG1      VAL  24   6.132  -6.401   4.277
  185   HG12  VAL  24          2HG1      VAL  24   5.867  -5.012   5.324
  186   HG13  VAL  24          3HG1      VAL  24   7.497  -5.632   5.085
  187   HG21  VAL  24          3HG2      VAL  24   4.627  -3.947   3.297
  188   HG22  VAL  24          1HG2      VAL  24   5.042  -5.357   2.320
  189   HG23  VAL  24          2HG2      VAL  24   5.493  -3.744   1.773
  190    H    THR  25           H        THR  25   7.810  -2.742   6.322
  191    HA   THR  25           HA       THR  25  10.743  -2.807   5.902
  192    HB   THR  25           HB       THR  25   9.096  -2.055   8.346
  193    HG1  THR  25           HG1      THR  25   8.831  -0.564   6.739
  194   HG21  THR  25          3HG2      THR  25  11.336  -2.752   9.061
  195   HG22  THR  25          1HG2      THR  25  11.270  -0.990   9.080
  196   HG23  THR  25          2HG2      THR  25  12.082  -1.823   7.757
  197    H    ASN  26           H        ASN  26  11.905  -4.564   6.371
  198    HA   ASN  26           HA       ASN  26  10.643  -6.921   7.553
  199    HB2  ASN  26           1HB      ASN  26  12.196  -7.111   5.622
  200    HB3  ASN  26           2HB      ASN  26  13.516  -6.499   6.611
  201   HD21  ASN  26          2HD2      ASN  26  14.756  -8.491   6.621
  202   HD22  ASN  26          1HD2      ASN  26  14.190  -9.908   7.364
  203    H    ARG  27           H        ARG  27  10.401  -6.886   9.705
  204    HA   ARG  27           HA       ARG  27  12.478  -5.725  11.484
  205    HB2  ARG  27           1HB      ARG  27   9.636  -6.684  12.019
  206    HB3  ARG  27           2HB      ARG  27  10.702  -5.939  13.214
  207    HG2  ARG  27           1HG      ARG  27  10.814  -3.876  11.826
  208    HG3  ARG  27           2HG      ARG  27   9.741  -4.619  10.637
  209    HD2  ARG  27           1HD      ARG  27   8.459  -3.137  12.131
  210    HD3  ARG  27           2HD      ARG  27   7.971  -4.815  12.385
  211    HE   ARG  27           HE       ARG  27  10.075  -4.157  14.174
  212   HH11  ARG  27          1HH2      ARG  27   6.709  -3.454  13.605
  213   HH12  ARG  27          2HH2      ARG  27   6.363  -3.162  15.276
  214   HH21  ARG  27          1HH1      ARG  27   9.602  -3.775  16.339
  215   HH22  ARG  27          2HH1      ARG  27   7.995  -3.343  16.819
  216    H    GLY  28           H        GLY  28  12.098  -7.165  13.746
  217    HA2  GLY  28           1HA      GLY  28  12.327  -9.245  14.777
  218    HA3  GLY  28           2HA      GLY  28  12.473 -10.036  13.210
  219    H    ALA  29           H        ALA  29  14.465 -10.847  12.883
  220    HA   ALA  29           HA       ALA  29  16.871  -9.302  13.207
  221    HB1  ALA  29           3HB      ALA  29  17.917 -10.689  14.968
  222    HB2  ALA  29           1HB      ALA  29  16.412 -11.593  15.155
  223    HB3  ALA  29           2HB      ALA  29  16.473  -9.885  15.582
  224    H    ALA  30           H        ALA  30  15.182 -11.408  11.558
  225    HA   ALA  30           HA       ALA  30  17.553 -12.743  10.382
  226    HB1  ALA  30           3HB      ALA  30  16.602 -14.357  12.006
  227    HB2  ALA  30           1HB      ALA  30  16.385 -14.919  10.348
  228    HB3  ALA  30           2HB      ALA  30  15.027 -14.217  11.230
  229    H    GLU  31           H        GLU  31  17.213 -13.488   8.247
  230    HA   GLU  31           HA       GLU  31  15.767 -11.739   6.589
  231    HB2  GLU  31           1HB      GLU  31  16.275 -13.462   4.779
  232    HB3  GLU  31           2HB      GLU  31  17.679 -12.914   5.693
  233    HG2  GLU  31           1HG      GLU  31  17.564 -14.958   7.103
  234    HG3  GLU  31           2HG      GLU  31  16.174 -15.513   6.193
  235    H    ALA  32           H        ALA  32  13.625 -11.596   6.270
  236    HA   ALA  32           HA       ALA  32  11.810 -13.800   6.997
  237    HB1  ALA  32           3HB      ALA  32  11.236 -10.943   6.101
  238    HB2  ALA  32           1HB      ALA  32  11.316 -11.500   7.773
  239    HB3  ALA  32           2HB      ALA  32  10.045 -12.098   6.709
  240    H    HIS  33           H        HIS  33  10.317 -14.687   5.557
  241    HA   HIS  33           HA       HIS  33  10.576 -14.080   2.657
  242    HB2  HIS  33           1HB      HIS  33  10.851 -16.811   3.990
  243    HB3  HIS  33           2HB      HIS  33  10.515 -16.613   2.270
  244    HD1  HIS  33           HD1      HIS  33  13.227 -15.956   4.839
  245    HD2  HIS  33           HD2      HIS  33  12.709 -15.861   0.704
  246    HE1  HIS  33           HE1      HIS  33  15.530 -15.642   3.826
  247    HE2  HIS  33           HE2      HIS  33  15.229 -15.576   1.312
  248    H    ASN  34           H        ASN  34   8.850 -14.990   1.411
  249    HA   ASN  34           HA       ASN  34   6.605 -15.038   0.937
  250    HB2  ASN  34           1HB      ASN  34   6.436 -16.570   3.561
  251    HB3  ASN  34           2HB      ASN  34   5.261 -16.612   2.246
  252   HD21  ASN  34          2HD2      ASN  34   7.131 -18.765   3.434
  253   HD22  ASN  34          1HD2      ASN  34   7.923 -19.405   2.076
  254    H    VAL  35           H        VAL  35   6.864 -12.651   1.461
  255    HA   VAL  35           HA       VAL  35   5.040 -11.823   3.691
  256    HB   VAL  35           HB       VAL  35   7.298 -10.197   2.439
  257   HG11  VAL  35          1HG1      VAL  35   6.928  -8.729   4.426
  258   HG12  VAL  35          2HG1      VAL  35   5.574  -9.742   4.919
  259   HG13  VAL  35          3HG1      VAL  35   5.483  -8.819   3.420
  260   HG21  VAL  35          3HG2      VAL  35   8.237 -12.115   3.679
  261   HG22  VAL  35          1HG2      VAL  35   7.216 -11.745   5.070
  262   HG23  VAL  35          2HG2      VAL  35   8.499 -10.632   4.591
  263    HA   PRO  36           HA       PRO  36   3.170 -10.455  -0.332
  264    HB2  PRO  36           1HB      PRO  36   0.657 -11.425  -0.089
  265    HB3  PRO  36           2HB      PRO  36   2.010 -12.517  -0.479
  266    HG2  PRO  36           1HG      PRO  36   0.716 -12.022   2.203
  267    HG3  PRO  36           2HG      PRO  36   1.129 -13.572   1.437
  268    HD2  PRO  36           1HD      PRO  36   2.765 -12.343   3.312
  269    HD3  PRO  36           2HD      PRO  36   3.409 -13.415   2.048
  270    H    VAL  37           H        VAL  37   1.128  -9.086  -0.643
  271    HA   VAL  37           HA       VAL  37   0.518  -7.405   1.752
  272    HB   VAL  37           HB       VAL  37   1.247  -6.295  -1.000
  273   HG11  VAL  37          1HG1      VAL  37   1.213  -4.091   0.211
  274   HG12  VAL  37          2HG1      VAL  37   0.631  -4.918   1.656
  275   HG13  VAL  37          3HG1      VAL  37  -0.371  -4.861   0.211
  276   HG21  VAL  37          3HG2      VAL  37   3.290  -5.438   0.137
  277   HG22  VAL  37          1HG2      VAL  37   3.242  -7.199   0.150
  278   HG23  VAL  37          2HG2      VAL  37   2.825  -6.295   1.606
  279    H    ALA  38           H        ALA  38  -1.531  -6.741   1.893
  280    HA   ALA  38           HA       ALA  38  -3.410  -7.266  -0.381
  281    HB1  ALA  38           3HB      ALA  38  -3.892  -7.694   2.602
  282    HB2  ALA  38           1HB      ALA  38  -3.618  -8.974   1.418
  283    HB3  ALA  38           2HB      ALA  38  -5.060  -7.965   1.302
  284    H    VAL  39           H        VAL  39  -4.060  -5.317  -1.063
  285    HA   VAL  39           HA       VAL  39  -4.507  -3.114   0.887
  286    HB   VAL  39           HB       VAL  39  -4.226  -2.975  -2.153
  287   HG11  VAL  39          1HG1      VAL  39  -4.151  -0.810  -0.005
  288   HG12  VAL  39          2HG1      VAL  39  -5.491  -1.081  -1.114
  289   HG13  VAL  39          3HG1      VAL  39  -3.938  -0.556  -1.728
  290   HG21  VAL  39          3HG2      VAL  39  -1.943  -2.081  -1.676
  291   HG22  VAL  39          1HG2      VAL  39  -2.113  -3.747  -1.128
  292   HG23  VAL  39          2HG2      VAL  39  -2.175  -2.425   0.038
  293    H    TYR  40           H        TYR  40  -6.476  -2.197   1.054
  294    HA   TYR  40           HA       TYR  40  -8.664  -2.956  -0.784
  295    HB2  TYR  40           1HB      TYR  40 -10.126  -3.554   1.179
  296    HB3  TYR  40           2HB      TYR  40  -8.802  -4.690   0.920
  297    HD1  TYR  40           HD1      TYR  40 -10.071  -1.973   3.117
  298    HD2  TYR  40           HD2      TYR  40  -6.857  -4.779   2.465
  299    HE1  TYR  40           HE1      TYR  40  -9.202  -1.524   5.393
  300    HE2  TYR  40           HE2      TYR  40  -6.008  -4.323   4.747
  301    HH   TYR  40           HH       TYR  40  -6.840  -1.699   6.518
  302    H    LEU  41           H        LEU  41  -9.917  -1.280  -1.216
  303    HA   LEU  41           HA       LEU  41  -9.438   1.279   0.126
  304    HB2  LEU  41           1HB      LEU  41  -9.736   0.966  -2.404
  305    HB3  LEU  41           2HB      LEU  41 -11.444   0.696  -2.101
  306    HG   LEU  41           HG       LEU  41 -11.130   3.065  -0.704
  307   HD11  LEU  41          1HD1      LEU  41  -8.688   3.174  -1.278
  308   HD12  LEU  41          2HD1      LEU  41  -9.594   4.573  -1.835
  309   HD13  LEU  41          3HD1      LEU  41  -9.121   3.321  -2.982
  310   HD21  LEU  41          3HD2      LEU  41 -11.557   2.843  -3.703
  311   HD22  LEU  41          1HD2      LEU  41 -11.945   4.268  -2.747
  312   HD23  LEU  41          2HD2      LEU  41 -12.796   2.755  -2.466
  313    H    GLY  42           H        GLY  42 -10.646   2.043   1.755
  314    HA2  GLY  42           1HA      GLY  42 -12.926   2.629   2.488
  315    HA3  GLY  42           2HA      GLY  42 -13.381   0.942   2.281
  316    H    ASN  43           H        ASN  43 -14.018   0.958   4.487
  317    HA   ASN  43           HA       ASN  43 -11.820   1.023   6.492
  318    HB2  ASN  43           1HB      ASN  43 -14.822   1.285   6.806
  319    HB3  ASN  43           2HB      ASN  43 -13.663   1.324   8.133
  320   HD21  ASN  43          2HD2      ASN  43 -14.633   3.094   5.153
  321   HD22  ASN  43          1HD2      ASN  43 -13.954   4.574   5.634
  322    HA   PRO  44           HA       PRO  44 -12.368  -3.433   6.836
  323    HB2  PRO  44           1HB      PRO  44 -11.151  -3.977   9.228
  324    HB3  PRO  44           2HB      PRO  44 -10.215  -3.404   7.824
  325    HG2  PRO  44           1HG      PRO  44 -11.320  -1.770  10.114
  326    HG3  PRO  44           2HG      PRO  44  -9.654  -1.807   9.488
  327    HD2  PRO  44           1HD      PRO  44 -11.376   0.139   8.695
  328    HD3  PRO  44           2HD      PRO  44 -10.227  -0.568   7.531
  329    H    ALA  45           H        ALA  45 -13.678  -1.210   9.167
  330    HA   ALA  45           HA       ALA  45 -15.138  -2.997  10.825
  331    HB1  ALA  45           3HB      ALA  45 -16.452  -0.997  11.442
  332    HB2  ALA  45           1HB      ALA  45 -15.775  -0.121  10.065
  333    HB3  ALA  45           2HB      ALA  45 -14.729  -0.621  11.391
  334    H    GLN  46           H        GLN  46 -16.060  -1.242   7.859
  335    HA   GLN  46           HA       GLN  46 -18.747  -2.307   7.777
  336    HB2  GLN  46           1HB      GLN  46 -18.084  -0.153   6.702
  337    HB3  GLN  46           2HB      GLN  46 -17.117  -1.045   5.531
  338    HG2  GLN  46           1HG      GLN  46 -19.156  -2.208   4.713
  339    HG3  GLN  46           2HG      GLN  46 -20.126  -1.366   5.920
  340   HE21  GLN  46          2HE2      GLN  46 -21.213   0.404   5.021
  341   HE22  GLN  46          1HE2      GLN  46 -20.629   1.358   3.744
  342    H    GLY  47           H        GLY  47 -16.114  -2.775   5.410
  343    HA2  GLY  47           1HA      GLY  47 -15.810  -5.505   5.460
  344    HA3  GLY  47           2HA      GLY  47 -17.232  -5.269   4.446
  345    H    GLY  48           H        GLY  48 -13.826  -4.348   4.812
  346    HA2  GLY  48           1HA      GLY  48 -13.480  -3.084   2.304
  347    HA3  GLY  48           2HA      GLY  48 -12.205  -3.820   3.269
  348    H    VAL  49           H        VAL  49 -12.116  -3.969   0.510
  349    HA   VAL  49           HA       VAL  49 -12.452  -6.891   0.017
  350    HB   VAL  49           HB       VAL  49 -14.325  -5.678  -1.061
  351   HG11  VAL  49          1HG1      VAL  49 -12.192  -4.209  -2.674
  352   HG12  VAL  49          2HG1      VAL  49 -13.176  -3.488  -1.401
  353   HG13  VAL  49          3HG1      VAL  49 -13.938  -4.073  -2.879
  354   HG21  VAL  49          3HG2      VAL  49 -12.305  -6.686  -3.121
  355   HG22  VAL  49          1HG2      VAL  49 -14.055  -6.606  -3.323
  356   HG23  VAL  49          2HG2      VAL  49 -13.353  -7.721  -2.151
  357    H    GLU  50           H        GLU  50 -10.828  -7.842  -1.096
  358    HA   GLU  50           HA       GLU  50  -8.297  -6.455  -1.234
  359    HB2  GLU  50           1HB      GLU  50  -8.517  -8.870  -0.646
  360    HB3  GLU  50           2HB      GLU  50  -9.041  -9.217  -2.292
  361    HG2  GLU  50           1HG      GLU  50  -6.864  -8.361  -3.157
  362    HG3  GLU  50           2HG      GLU  50  -6.355  -8.004  -1.510
  363    H    ILE  51           H        ILE  51  -7.342  -5.520  -2.966
  364    HA   ILE  51           HA       ILE  51  -8.832  -5.376  -5.546
  365    HB   ILE  51           HB       ILE  51  -6.490  -3.683  -4.554
  366   HG12  ILE  51          1HG1      ILE  51  -9.467  -2.981  -4.660
  367   HG13  ILE  51          2HG1      ILE  51  -8.633  -3.456  -3.190
  368   HG21  ILE  51          1HG2      ILE  51  -8.408  -3.328  -6.910
  369   HG22  ILE  51          2HG2      ILE  51  -6.695  -3.723  -7.039
  370   HG23  ILE  51          3HG2      ILE  51  -7.187  -2.154  -6.426
  371   HD11  ILE  51          3HD1      ILE  51  -8.764  -1.042  -3.303
  372   HD12  ILE  51          1HD1      ILE  51  -7.985  -1.022  -4.879
  373   HD13  ILE  51          2HD1      ILE  51  -7.085  -1.533  -3.448
  374    H    GLY  52           H        GLY  52  -5.642  -6.108  -4.187
  375    HA2  GLY  52           1HA      GLY  52  -5.039  -8.141  -6.040
  376    HA3  GLY  52           2HA      GLY  52  -4.288  -6.646  -6.600
  377    H    ARG  53           H        ARG  53  -2.677  -8.722  -5.978
  378    HA   ARG  53           HA       ARG  53  -1.109  -7.652  -3.751
  379    HB2  ARG  53           1HB      ARG  53  -0.940  -9.856  -2.606
  380    HB3  ARG  53           2HB      ARG  53  -2.583  -9.218  -2.563
  381    HG2  ARG  53           1HG      ARG  53  -3.236 -10.676  -4.443
  382    HG3  ARG  53           2HG      ARG  53  -1.596 -11.305  -4.560
  383    HD2  ARG  53           1HD      ARG  53  -1.765 -12.235  -2.284
  384    HD3  ARG  53           2HD      ARG  53  -3.396 -11.591  -2.127
  385    HE   ARG  53           HE       ARG  53  -3.315 -13.167  -4.454
  386   HH11  ARG  53          1HH2      ARG  53  -3.050 -13.537  -1.000
  387   HH12  ARG  53          2HH2      ARG  53  -3.665 -15.156  -1.001
  388   HH21  ARG  53          1HH1      ARG  53  -4.117 -15.277  -4.434
  389   HH22  ARG  53          2HH1      ARG  53  -4.267 -16.137  -2.938
  390    H    ASP  54           H        ASP  54   0.991  -8.779  -3.574
  391    HA   ASP  54           HA       ASP  54   1.907 -10.330  -5.894
  392    HB2  ASP  54           1HB      ASP  54   2.964  -7.530  -5.318
  393    HB3  ASP  54           2HB      ASP  54   3.687  -8.665  -6.456
  394    H    THR  55           H        THR  55   3.014 -11.902  -4.915
  395    HA   THR  55           HA       THR  55   4.244 -11.587  -2.314
  396    HB   THR  55           HB       THR  55   4.556 -13.906  -4.280
  397    HG1  THR  55           HG1      THR  55   2.399 -13.579  -3.903
  398   HG21  THR  55          3HG2      THR  55   4.769 -13.768  -1.243
  399   HG22  THR  55          1HG2      THR  55   6.137 -13.926  -2.346
  400   HG23  THR  55          2HG2      THR  55   4.949 -15.223  -2.219
  401    H    ILE  56           H        ILE  56   6.316 -11.097  -1.862
  402    HA   ILE  56           HA       ILE  56   8.126 -10.307  -4.033
  403    HB   ILE  56           HB       ILE  56   8.393 -10.110  -1.001
  404   HG12  ILE  56          1HG1      ILE  56   7.769  -7.887  -3.021
  405   HG13  ILE  56          2HG1      ILE  56   6.512  -8.735  -2.134
  406   HG21  ILE  56          1HG2      ILE  56  10.221  -8.428  -1.589
  407   HG22  ILE  56          2HG2      ILE  56  10.096  -8.950  -3.263
  408   HG23  ILE  56          3HG2      ILE  56  10.633 -10.083  -2.024
  409   HD11  ILE  56          3HD1      ILE  56   7.225  -7.873  -0.050
  410   HD12  ILE  56          1HD1      ILE  56   7.292  -6.506  -1.155
  411   HD13  ILE  56          2HD1      ILE  56   8.779  -7.327  -0.684
  412    H    SER  57           H        SER  57  10.166 -11.185  -4.367
  413    HA   SER  57           HA       SER  57  10.433 -13.995  -4.086
  414    HB2  SER  57           1HB      SER  57  11.600 -12.738  -5.851
  415    HB3  SER  57           2HB      SER  57  12.559 -11.891  -4.640
  416    HG   SER  57           HG       SER  57  13.845 -13.540  -4.677
  417    H    ARG  58           H        ARG  58  12.072 -11.326  -2.392
  418    HA   ARG  58           HA       ARG  58  12.085 -12.585   0.135
  419    HB2  ARG  58           1HB      ARG  58  14.550 -13.089   0.320
  420    HB3  ARG  58           2HB      ARG  58  13.721 -14.156  -0.799
  421    HG2  ARG  58           1HG      ARG  58  14.479 -12.736  -2.709
  422    HG3  ARG  58           2HG      ARG  58  15.353 -11.706  -1.577
  423    HD2  ARG  58           1HD      ARG  58  16.735 -13.642  -0.881
  424    HD3  ARG  58           2HD      ARG  58  15.857 -14.673  -2.015
  425    HE   ARG  58           HE       ARG  58  16.900 -12.430  -3.401
  426   HH11  ARG  58          1HH2      ARG  58  17.926 -15.360  -1.833
  427   HH12  ARG  58          2HH2      ARG  58  19.345 -15.538  -2.811
  428   HH21  ARG  58          1HH1      ARG  58  18.755 -12.675  -4.672
  429   HH22  ARG  58          2HH1      ARG  58  19.812 -14.022  -4.412
  430    H    ILE  59           H        ILE  59  12.847 -11.221   1.743
  431    HA   ILE  59           HA       ILE  59  13.772  -8.530   0.845
  432    HB   ILE  59           HB       ILE  59  12.145  -9.079   3.363
  433   HG12  ILE  59          1HG1      ILE  59  11.163  -8.064   0.656
  434   HG13  ILE  59          2HG1      ILE  59  10.831  -9.666   1.300
  435   HG21  ILE  59          1HG2      ILE  59  12.811  -6.509   1.842
  436   HG22  ILE  59          2HG2      ILE  59  13.493  -6.986   3.394
  437   HG23  ILE  59          3HG2      ILE  59  11.787  -6.596   3.268
  438   HD11  ILE  59          3HD1      ILE  59   9.696  -8.582   3.270
  439   HD12  ILE  59          1HD1      ILE  59   8.903  -8.271   1.727
  440   HD13  ILE  59          2HD1      ILE  59   9.897  -7.023   2.469
  441    HA   PRO  60           HA       PRO  60  17.260  -9.736   3.519
  442    HB2  PRO  60           1HB      PRO  60  18.930  -7.615   3.175
  443    HB3  PRO  60           2HB      PRO  60  18.612  -8.758   1.846
  444    HG2  PRO  60           1HG      PRO  60  17.295  -6.091   2.362
  445    HG3  PRO  60           2HG      PRO  60  18.036  -6.681   0.857
  446    HD2  PRO  60           1HD      PRO  60  15.341  -6.839   1.259
  447    HD3  PRO  60           2HD      PRO  60  16.201  -8.118   0.367
  448    H    VAL  61           H        VAL  61  18.312  -8.977   5.507
  449    HA   VAL  61           HA       VAL  61  16.425  -7.827   7.350
  450    HB   VAL  61           HB       VAL  61  19.366  -8.496   7.794
  451   HG11  VAL  61          1HG1      VAL  61  18.660  -8.707  10.191
  452   HG12  VAL  61          2HG1      VAL  61  17.048  -8.146   9.748
  453   HG13  VAL  61          3HG1      VAL  61  18.431  -7.064   9.595
  454   HG21  VAL  61          3HG2      VAL  61  18.491 -10.664   8.661
  455   HG22  VAL  61          1HG2      VAL  61  18.092 -10.453   6.956
  456   HG23  VAL  61          2HG2      VAL  61  16.862 -10.184   8.190
  457    H    GLY  62           H        GLY  62  16.457  -5.840   8.375
  458    HA2  GLY  62           1HA      GLY  62  16.942  -3.627   8.760
  459    HA3  GLY  62           2HA      GLY  62  18.568  -3.918   8.147
  460    H    GLY  63           H        GLY  63  16.312  -4.998   5.932
  461    HA2  GLY  63           1HA      GLY  63  16.561  -2.562   4.233
  462    HA3  GLY  63           2HA      GLY  63  16.363  -4.216   3.674
  463    H    THR  64           H        THR  64  14.630  -3.082   2.423
  464    HA   THR  64           HA       THR  64  12.047  -3.455   3.811
  465    HB   THR  64           HB       THR  64  11.144  -1.332   3.029
  466    HG1  THR  64           HG1      THR  64  13.178   0.012   2.179
  467   HG21  THR  64          3HG2      THR  64  12.375   0.247   4.393
  468   HG22  THR  64          1HG2      THR  64  13.861  -0.681   4.227
  469   HG23  THR  64          2HG2      THR  64  12.531  -1.316   5.191
  470    H    GLY  65           H        GLY  65  10.335  -3.893   2.407
  471    HA2  GLY  65           1HA      GLY  65  11.093  -4.893  -0.278
  472    HA3  GLY  65           2HA      GLY  65   9.670  -5.329   0.666
  473    H    LEU  66           H        LEU  66   9.690  -4.465  -2.055
  474    HA   LEU  66           HA       LEU  66   7.831  -2.183  -1.783
  475    HB2  LEU  66           1HB      LEU  66  10.378  -1.587  -2.523
  476    HB3  LEU  66           2HB      LEU  66   9.774  -2.041  -4.112
  477    HG   LEU  66           HG       LEU  66   8.611   0.106  -2.278
  478   HD11  LEU  66          1HD1      LEU  66  10.020   0.335  -4.949
  479   HD12  LEU  66          2HD1      LEU  66  10.706   0.764  -3.379
  480   HD13  LEU  66          3HD1      LEU  66   9.336   1.673  -4.023
  481   HD21  LEU  66          3HD2      LEU  66   6.741  -0.830  -3.445
  482   HD22  LEU  66          1HD2      LEU  66   7.639  -0.954  -4.961
  483   HD23  LEU  66          2HD2      LEU  66   7.169   0.626  -4.336
  484    H    ALA  67           H        ALA  67   5.994  -2.890  -2.550
  485    HA   ALA  67           HA       ALA  67   5.868  -4.855  -4.771
  486    HB1  ALA  67           3HB      ALA  67   3.757  -3.925  -2.781
  487    HB2  ALA  67           1HB      ALA  67   4.682  -5.422  -2.673
  488    HB3  ALA  67           2HB      ALA  67   3.544  -5.186  -3.999
  489    H    ARG  68           H        ARG  68   4.266  -4.520  -6.418
  490    HA   ARG  68           HA       ARG  68   3.591  -1.644  -6.957
  491    HB2  ARG  68           1HB      ARG  68   5.516  -2.453  -8.358
  492    HB3  ARG  68           2HB      ARG  68   4.471  -3.699  -9.033
  493    HG2  ARG  68           1HG      ARG  68   2.932  -1.930  -9.907
  494    HG3  ARG  68           2HG      ARG  68   3.977  -0.694  -9.217
  495    HD2  ARG  68           1HD      ARG  68   5.853  -1.517 -10.669
  496    HD3  ARG  68           2HD      ARG  68   4.731  -2.662 -11.403
  497    HE   ARG  68           HE       ARG  68   3.789  -0.917 -12.618
  498   HH11  ARG  68          1HH2      ARG  68   5.738   0.374 -10.041
  499   HH12  ARG  68          2HH2      ARG  68   5.561   2.019 -10.556
  500   HH21  ARG  68          1HH1      ARG  68   3.564   1.240 -13.279
  501   HH22  ARG  68          2HH1      ARG  68   4.334   2.506 -12.383
  502    H    VAL  69           H        VAL  69   1.496  -1.341  -7.096
  503    HA   VAL  69           HA       VAL  69  -0.264  -3.393  -8.324
  504    HB   VAL  69           HB       VAL  69  -0.960  -1.962  -5.711
  505   HG11  VAL  69          1HG1      VAL  69  -2.842  -3.592  -5.662
  506   HG12  VAL  69          2HG1      VAL  69  -2.320  -4.236  -7.219
  507   HG13  VAL  69          3HG1      VAL  69  -2.917  -2.582  -7.106
  508   HG21  VAL  69          3HG2      VAL  69   0.846  -3.571  -5.266
  509   HG22  VAL  69          1HG2      VAL  69  -0.002  -4.822  -6.179
  510   HG23  VAL  69          2HG2      VAL  69  -0.668  -4.228  -4.658
  511    H    GLN  70           H        GLN  70  -2.013  -2.584  -9.382
  512    HA   GLN  70           HA       GLN  70  -2.181   0.391  -9.712
  513    HB2  GLN  70           1HB      GLN  70  -2.860  -0.081 -12.056
  514    HB3  GLN  70           2HB      GLN  70  -1.229  -0.653 -11.709
  515    HG2  GLN  70           1HG      GLN  70  -2.117  -2.958 -11.377
  516    HG3  GLN  70           2HG      GLN  70  -3.737  -2.389 -11.769
  517   HE21  GLN  70          2HE2      GLN  70  -0.485  -2.910 -13.157
  518   HE22  GLN  70          1HE2      GLN  70  -1.004  -2.899 -14.773
  519    H    TRP  71           H        TRP  71  -4.151   1.311  -9.713
  520    HA   TRP  71           HA       TRP  71  -6.592  -0.339  -9.577
  521    HB2  TRP  71           1HB      TRP  71  -5.932  -0.102  -7.210
  522    HB3  TRP  71           2HB      TRP  71  -5.752   1.637  -7.410
  523    HD1  TRP  71           HD1      TRP  71  -8.580  -0.914  -8.185
  524    HE1  TRP  71           HE1      TRP  71 -10.822   0.147  -7.484
  525    HE3  TRP  71           HE3      TRP  71  -6.916   3.543  -6.340
  526    HZ2  TRP  71           HZ2      TRP  71 -11.782   2.561  -6.302
  527    HZ3  TRP  71           HZ3      TRP  71  -8.510   5.210  -5.430
  528    HH2  TRP  71           HH2      TRP  71 -10.942   4.723  -5.404
  529    H    LYS  72           H        LYS  72  -8.395   0.696 -10.259
  530    HA   LYS  72           HA       LYS  72  -7.980   3.191 -11.777
  531    HB2  LYS  72           1HB      LYS  72  -9.092   1.225 -12.835
  532    HB3  LYS  72           2HB      LYS  72 -10.416   1.366 -11.681
  533    HG2  LYS  72           1HG      LYS  72 -10.919   3.652 -12.516
  534    HG3  LYS  72           2HG      LYS  72  -9.558   3.553 -13.634
  535    HD2  LYS  72           1HD      LYS  72 -10.641   1.623 -14.772
  536    HD3  LYS  72           2HD      LYS  72 -12.012   1.752 -13.668
  537    HE2  LYS  72           1HE      LYS  72 -11.090   3.903 -15.618
  538    HE3  LYS  72           2HE      LYS  72 -12.527   2.894 -15.797
  539    HZ1  LYS  72           3HZ      LYS  72 -13.411   4.745 -14.823
  540    HZ2  LYS  72           1HZ      LYS  72 -12.015   5.093 -13.924
  541    HZ3  LYS  72           2HZ      LYS  72 -13.048   3.836 -13.434
  542    H    ALA  73           H        ALA  73  -8.467   5.096 -10.894
  543    HA   ALA  73           HA       ALA  73  -9.878   5.328  -8.383
  544    HB1  ALA  73           3HB      ALA  73  -9.547   7.760  -8.711
  545    HB2  ALA  73           1HB      ALA  73  -8.997   7.468 -10.365
  546    HB3  ALA  73           2HB      ALA  73  -8.051   6.873  -9.002
  547    H    THR  74           H        THR  74 -12.020   5.706  -8.070
  548    HA   THR  74           HA       THR  74 -13.693   7.099  -9.918
  549    HB   THR  74           HB       THR  74 -13.700   5.137 -11.302
  550    HG1  THR  74           HG1      THR  74 -15.771   5.144 -11.369
  551   HG21  THR  74          3HG2      THR  74 -14.258   3.447  -8.828
  552   HG22  THR  74          1HG2      THR  74 -12.710   3.535  -9.656
  553   HG23  THR  74          2HG2      THR  74 -14.110   2.860 -10.476
  554    H    ARG  75           H        ARG  75 -15.040   8.123  -8.612
  555    HA   ARG  75           HA       ARG  75 -16.732   6.793  -6.726
  556    HB2  ARG  75           1HB      ARG  75 -14.367   7.014  -5.531
  557    HB3  ARG  75           2HB      ARG  75 -14.770   8.715  -5.374
  558    HG2  ARG  75           1HG      ARG  75 -16.865   8.080  -4.152
  559    HG3  ARG  75           2HG      ARG  75 -16.430   6.387  -4.311
  560    HD2  ARG  75           1HD      ARG  75 -14.354   6.808  -3.007
  561    HD3  ARG  75           2HD      ARG  75 -14.828   8.498  -2.837
  562    HE   ARG  75           HE       ARG  75 -16.345   7.872  -1.199
  563   HH11  ARG  75          1HH2      ARG  75 -15.413   5.083  -3.059
  564   HH12  ARG  75          2HH2      ARG  75 -16.277   3.963  -2.059
  565   HH21  ARG  75          1HH1      ARG  75 -17.484   6.392   0.095
  566   HH22  ARG  75          2HH1      ARG  75 -17.445   4.703  -0.281
  567    H    LYS  76           H        LYS  76 -16.362   9.016  -8.938
  568    HA   LYS  76           HA       LYS  76 -17.286  11.463  -7.850
  569    HB2  LYS  76           1HB      LYS  76 -17.890  11.998 -10.222
  570    HB3  LYS  76           2HB      LYS  76 -16.254  11.361 -10.068
  571    HG2  LYS  76           1HG      LYS  76 -17.065   9.106 -10.735
  572    HG3  LYS  76           2HG      LYS  76 -18.698   9.746 -10.915
  573    HD2  LYS  76           1HD      LYS  76 -17.910  11.297 -12.681
  574    HD3  LYS  76           2HD      LYS  76 -16.266  10.682 -12.498
  575    HE2  LYS  76           1HE      LYS  76 -17.424   9.611 -14.424
  576    HE3  LYS  76           2HE      LYS  76 -17.019   8.425 -13.180
  577    HZ1  LYS  76           3HZ      LYS  76 -19.179   8.171 -12.582
  578    HZ2  LYS  76           1HZ      LYS  76 -19.416   8.573 -14.212
  579    HZ3  LYS  76           2HZ      LYS  76 -19.619   9.755 -13.009
  580    H    LEU  77           H        LEU  77 -19.382  12.406  -7.994
  581    HA   LEU  77           HA       LEU  77 -21.718  10.628  -8.384
  582    HB2  LEU  77           1HB      LEU  77 -22.675  11.361  -6.173
  583    HB3  LEU  77           2HB      LEU  77 -21.293  10.288  -6.017
  584    HG   LEU  77           HG       LEU  77 -20.599  13.245  -6.032
  585   HD11  LEU  77          1HD1      LEU  77 -21.195  13.575  -3.656
  586   HD12  LEU  77          2HD1      LEU  77 -22.006  12.007  -3.641
  587   HD13  LEU  77          3HD1      LEU  77 -22.629  13.311  -4.647
  588   HD21  LEU  77          3HD2      LEU  77 -18.899  11.444  -5.668
  589   HD22  LEU  77          1HD2      LEU  77 -19.743  10.961  -4.196
  590   HD23  LEU  77          2HD2      LEU  77 -18.996  12.556  -4.304
  591    H    ALA  78           H        ALA  78 -20.307  13.278  -9.346
  592    HA   ALA  78           HA       ALA  78 -20.955  15.324 -10.159
  593    HB1  ALA  78           3HB      ALA  78 -22.403  13.844 -11.527
  594    HB2  ALA  78           1HB      ALA  78 -23.190  15.389 -11.202
  595    HB3  ALA  78           2HB      ALA  78 -23.664  13.948 -10.300
  596    H    GLY  79           H        GLY  79 -20.724  15.357  -7.457
  597    HA2  GLY  79           1HA      GLY  79 -22.182  17.628  -6.668
  598    HA3  GLY  79           2HA      GLY  79 -22.967  16.214  -5.967
  599    H    ARG  80           H        ARG  80 -21.407  18.468  -4.743
  600    HA   ARG  80           HA       ARG  80 -19.883  18.817  -3.067
  601    HB2  ARG  80           1HB      ARG  80 -21.373  17.016  -2.043
  602    HB3  ARG  80           2HB      ARG  80 -20.162  15.828  -2.520
  603    HG2  ARG  80           1HG      ARG  80 -18.456  17.080  -1.163
  604    HG3  ARG  80           2HG      ARG  80 -19.712  18.198  -0.647
  605    HD2  ARG  80           1HD      ARG  80 -19.709  15.198  -0.128
  606    HD3  ARG  80           2HD      ARG  80 -19.308  16.438   1.060
  607    HE   ARG  80           HE       ARG  80 -21.859  17.013  -0.003
  608   HH11  ARG  80          1HH2      ARG  80 -20.265  14.662   2.025
  609   HH12  ARG  80          2HH2      ARG  80 -21.710  14.248   2.887
  610   HH21  ARG  80          1HH1      ARG  80 -23.725  16.447   1.128
  611   HH22  ARG  80          2HH1      ARG  80 -23.657  15.252   2.380
  612    H    ALA  81           H        ALA  81 -18.391  19.072  -5.034
  613    HA   ALA  81           HA       ALA  81 -16.353  16.974  -5.374
  614    HB1  ALA  81           3HB      ALA  81 -15.441  18.493  -7.092
  615    HB2  ALA  81           1HB      ALA  81 -16.605  19.738  -6.624
  616    HB3  ALA  81           2HB      ALA  81 -17.168  18.230  -7.342
  617    H    ALA  82           H        ALA  82 -16.884  19.772  -3.448
  618    HA   ALA  82           HA       ALA  82 -14.105  20.477  -3.003
  619    HB1  ALA  82           3HB      ALA  82 -15.929  22.139  -2.839
  620    HB2  ALA  82           1HB      ALA  82 -15.059  22.002  -1.309
  621    HB3  ALA  82           2HB      ALA  82 -16.637  21.236  -1.503
  622    H    ASN  83           H        ASN  83 -14.666  17.689  -2.570
  623    HA   ASN  83           HA       ASN  83 -13.433  17.392   0.010
  624    HB2  ASN  83           1HB      ASN  83 -15.769  17.706   0.750
  625    HB3  ASN  83           2HB      ASN  83 -16.273  16.355  -0.261
  626   HD21  ASN  83          2HD2      ASN  83 -15.545  14.167   0.387
  627   HD22  ASN  83          1HD2      ASN  83 -15.031  13.868   1.976
  628    HA   PRO  84           HA       PRO  84 -12.306  13.766  -2.482
  629    HB2  PRO  84           1HB      PRO  84 -10.551  12.493  -0.782
  630    HB3  PRO  84           2HB      PRO  84 -10.137  13.999  -1.620
  631    HG2  PRO  84           1HG      PRO  84 -11.074  13.653   1.224
  632    HG3  PRO  84           2HG      PRO  84  -9.749  14.651   0.604
  633    HD2  PRO  84           1HD      PRO  84 -12.226  15.702   1.176
  634    HD3  PRO  84           2HD      PRO  84 -11.201  16.370  -0.113
  635    H    GLY  85           H        GLY  85 -12.143  12.373   0.759
  636    HA2  GLY  85           1HA      GLY  85 -13.548  10.892   1.880
  637    HA3  GLY  85           2HA      GLY  85 -14.732  11.017   0.580
  638    H    VAL  86           H        VAL  86 -11.573  10.459  -0.533
  639    HA   VAL  86           HA       VAL  86 -12.039   7.519  -0.840
  640    HB   VAL  86           HB       VAL  86 -12.358   8.652  -2.959
  641   HG11  VAL  86          1HG1      VAL  86 -11.131  10.751  -2.493
  642   HG12  VAL  86          2HG1      VAL  86 -10.660  10.046  -4.039
  643   HG13  VAL  86          3HG1      VAL  86  -9.599   9.895  -2.650
  644   HG21  VAL  86          3HG2      VAL  86  -9.547   7.513  -3.295
  645   HG22  VAL  86          1HG2      VAL  86 -10.969   7.287  -4.307
  646   HG23  VAL  86          2HG2      VAL  86 -10.851   6.463  -2.762
  647    HA   PRO  87           HA       PRO  87  -7.993   8.390   1.427
  648    HB2  PRO  87           1HB      PRO  87  -8.435   6.849   3.663
  649    HB3  PRO  87           2HB      PRO  87  -9.078   8.508   3.541
  650    HG2  PRO  87           1HG      PRO  87 -10.492   5.914   2.857
  651    HG3  PRO  87           2HG      PRO  87 -11.028   7.199   3.970
  652    HD2  PRO  87           1HD      PRO  87 -11.966   7.201   1.473
  653    HD3  PRO  87           2HD      PRO  87 -11.433   8.742   2.183
  654    H    VAL  88           H        VAL  88  -6.448   6.627   2.230
  655    HA   VAL  88           HA       VAL  88  -6.788   4.061   0.724
  656    HB   VAL  88           HB       VAL  88  -4.242   5.741   0.806
  657   HG11  VAL  88          1HG1      VAL  88  -3.443   4.090  -0.898
  658   HG12  VAL  88          2HG1      VAL  88  -4.936   3.176  -0.692
  659   HG13  VAL  88          3HG1      VAL  88  -3.791   3.306   0.640
  660   HG21  VAL  88          3HG2      VAL  88  -5.976   6.800  -0.618
  661   HG22  VAL  88          1HG2      VAL  88  -6.226   5.270  -1.463
  662   HG23  VAL  88          2HG2      VAL  88  -4.691   6.126  -1.615
  663    H    TYR  89           H        TYR  89  -6.213   2.295   1.800
  664    HA   TYR  89           HA       TYR  89  -4.607   2.491   4.302
  665    HB2  TYR  89           1HB      TYR  89  -7.287   1.069   3.971
  666    HB3  TYR  89           2HB      TYR  89  -6.212   0.843   5.351
  667    HD1  TYR  89           HD2      TYR  89  -5.551   2.880   6.767
  668    HD2  TYR  89           HD1      TYR  89  -8.792   3.017   3.921
  669    HE1  TYR  89           HE2      TYR  89  -6.436   4.924   7.856
  670    HE2  TYR  89           HE1      TYR  89  -9.660   5.059   5.031
  671    HH   TYR  89           HH       TYR  89  -8.392   7.006   6.540
  672    H    ALA  90           H        ALA  90  -3.385   0.739   4.764
  673    HA   ALA  90           HA       ALA  90  -3.429  -1.630   2.989
  674    HB1  ALA  90           3HB      ALA  90  -1.018  -1.386   2.506
  675    HB2  ALA  90           1HB      ALA  90  -0.988   0.151   3.376
  676    HB3  ALA  90           2HB      ALA  90  -1.920  -0.002   1.889
  677    H    VAL  91           H        VAL  91  -2.665  -3.446   3.952
  678    HA   VAL  91           HA       VAL  91  -1.479  -3.265   6.678
  679    HB   VAL  91           HB       VAL  91  -3.772  -5.124   5.883
  680   HG11  VAL  91          1HG1      VAL  91  -2.377  -4.633   8.557
  681   HG12  VAL  91          2HG1      VAL  91  -2.269  -6.110   7.597
  682   HG13  VAL  91          3HG1      VAL  91  -3.800  -5.651   8.335
  683   HG21  VAL  91          3HG2      VAL  91  -3.751  -2.629   7.646
  684   HG22  VAL  91          1HG2      VAL  91  -5.113  -3.739   7.485
  685   HG23  VAL  91          2HG2      VAL  91  -4.577  -2.801   6.096
  686    H    VAL  92           H        VAL  92   0.037  -4.744   7.100
  687    HA   VAL  92           HA       VAL  92   0.967  -6.460   4.884
  688    HB   VAL  92           HB       VAL  92   2.320  -5.845   7.554
  689   HG11  VAL  92          1HG1      VAL  92   3.434  -6.906   4.913
  690   HG12  VAL  92          2HG1      VAL  92   3.152  -7.886   6.349
  691   HG13  VAL  92          3HG1      VAL  92   4.358  -6.613   6.386
  692   HG21  VAL  92          3HG2      VAL  92   2.634  -4.491   4.837
  693   HG22  VAL  92          1HG2      VAL  92   3.658  -4.189   6.242
  694   HG23  VAL  92          2HG2      VAL  92   1.952  -3.750   6.285
  695    H    ASP  93           H        ASP  93   1.035  -8.655   5.016
  696    HA   ASP  93           HA       ASP  93  -0.775 -10.176   6.298
  697    HB2  ASP  93           1HB      ASP  93   0.836 -12.106   5.985
  698    HB3  ASP  93           2HB      ASP  93   0.681 -11.073   4.563
  699    HA   PRO  94           HA       PRO  94   0.340 -10.127  10.638
  700    HB2  PRO  94           1HB      PRO  94  -0.845 -12.385  11.614
  701    HB3  PRO  94           2HB      PRO  94  -1.815 -11.031  10.991
  702    HG2  PRO  94           1HG      PRO  94  -0.969 -13.535   9.527
  703    HG3  PRO  94           2HG      PRO  94  -2.608 -12.856   9.697
  704    HD2  PRO  94           1HD      PRO  94  -1.152 -12.335   7.464
  705    HD3  PRO  94           2HD      PRO  94  -2.150 -11.054   8.194
  706    H    ASP  95           H        ASP  95   2.499 -10.344  11.016
  707    HA   ASP  95           HA       ASP  95   3.970 -12.810  10.449
  708    HB2  ASP  95           1HB      ASP  95   5.918 -11.475  11.251
  709    HB3  ASP  95           2HB      ASP  95   5.024 -10.640   9.983
  710    H    ASN  96           H        ASN  96   1.852 -12.134  12.767
  711    HA   ASN  96           HA       ASN  96   3.161 -13.867  14.760
  712    HB2  ASN  96           1HB      ASN  96   2.086 -11.101  15.454
  713    HB3  ASN  96           2HB      ASN  96   2.709 -12.287  16.600
  714   HD21  ASN  96          2HD2      ASN  96   3.610  -9.660  14.576
  715   HD22  ASN  96          1HD2      ASN  96   5.292  -9.859  14.688
  716    H    ARG  97           H        ARG  97   1.141 -14.636  13.120
  717    HA   ARG  97           HA       ARG  97  -0.989 -15.511  13.052
  718    HB2  ARG  97           1HB      ARG  97  -0.598 -15.486  16.065
  719    HB3  ARG  97           2HB      ARG  97  -1.849 -16.396  15.220
  720    HG2  ARG  97           1HG      ARG  97  -0.117 -17.694  14.023
  721    HG3  ARG  97           2HG      ARG  97   1.150 -16.764  14.824
  722    HD2  ARG  97           1HD      ARG  97   0.359 -17.577  17.032
  723    HD3  ARG  97           2HD      ARG  97  -0.903 -18.517  16.232
  724    HE   ARG  97           HE       ARG  97   1.583 -19.261  15.130
  725   HH11  ARG  97          1HH2      ARG  97  -0.155 -19.427  18.143
  726   HH12  ARG  97          2HH2      ARG  97   0.613 -20.892  18.655
  727   HH21  ARG  97          1HH1      ARG  97   2.580 -21.176  15.817
  728   HH22  ARG  97          2HH1      ARG  97   2.155 -21.878  17.342
  729    H    VAL  98           H        VAL  98  -1.633 -13.953  16.150
  730    HA   VAL  98           HA       VAL  98  -3.382 -11.923  14.829
  731    HB   VAL  98           HB       VAL  98  -4.153 -13.568  17.277
  732   HG11  VAL  98          1HG1      VAL  98  -6.388 -12.518  16.920
  733   HG12  VAL  98          2HG1      VAL  98  -5.725 -11.577  15.584
  734   HG13  VAL  98          3HG1      VAL  98  -5.158 -11.293  17.228
  735   HG21  VAL  98          3HG2      VAL  98  -5.809 -14.647  15.750
  736   HG22  VAL  98          1HG2      VAL  98  -4.155 -14.980  15.241
  737   HG23  VAL  98          2HG2      VAL  98  -5.113 -13.769  14.388
  738    H    ALA  99           H        ALA  99  -2.926  -9.962  15.467
  739    HA   ALA  99           HA       ALA  99  -2.411  -9.201  18.185
  740    HB1  ALA  99           3HB      ALA  99  -0.039  -9.152  16.278
  741    HB2  ALA  99           1HB      ALA  99  -0.200 -10.209  17.675
  742    HB3  ALA  99           2HB      ALA  99  -0.068  -8.473  17.910
  743    H    GLU 100           H        GLU 100  -3.874  -7.571  17.919
  744    HA   GLU 100           HA       GLU 100  -3.955  -5.855  15.614
  745    HB2  GLU 100           1HB      GLU 100  -5.912  -6.316  17.137
  746    HB3  GLU 100           2HB      GLU 100  -5.130  -5.347  18.380
  747    HG2  GLU 100           1HG      GLU 100  -6.761  -3.939  17.221
  748    HG3  GLU 100           2HG      GLU 100  -5.156  -3.377  16.775
  749    H    SER 101           H        SER 101  -3.058  -5.139  19.001
  750    HA   SER 101           HA       SER 101  -2.045  -2.591  18.738
  751    HB2  SER 101           1HB      SER 101  -2.166  -3.777  20.893
  752    HB3  SER 101           2HB      SER 101  -0.852  -4.838  20.395
  753    HG   SER 101           HG       SER 101  -0.286  -2.175  20.101
  754    H    ASP 102           H        ASP 102  -0.177  -5.599  18.153
  755    HA   ASP 102           HA       ASP 102   2.254  -4.342  17.395
  756    HB2  ASP 102           1HB      ASP 102   2.011  -6.776  17.941
  757    HB3  ASP 102           2HB      ASP 102   1.175  -7.012  16.410
  758    H    LYS 103           H        LYS 103   0.101  -6.055  15.098
  759    HA   LYS 103           HA       LYS 103   1.009  -5.025  12.707
  760    HB2  LYS 103           1HB      LYS 103  -1.892  -5.515  13.485
  761    HB3  LYS 103           2HB      LYS 103  -1.335  -5.305  11.824
  762    HG2  LYS 103           1HG      LYS 103   0.068  -7.311  11.984
  763    HG3  LYS 103           2HG      LYS 103  -0.295  -7.476  13.693
  764    HD2  LYS 103           1HD      LYS 103  -1.667  -9.073  12.476
  765    HD3  LYS 103           2HD      LYS 103  -2.723  -7.822  13.119
  766    HE2  LYS 103           1HE      LYS 103  -3.167  -8.534  10.674
  767    HE3  LYS 103           2HE      LYS 103  -3.002  -6.804  10.935
  768    HZ1  LYS 103           3HZ      LYS 103  -0.576  -8.317  10.322
  769    HZ2  LYS 103           1HZ      LYS 103  -1.016  -6.742   9.872
  770    HZ3  LYS 103           2HZ      LYS 103  -1.689  -8.073   9.061
  771    H    ALA 104           H        ALA 104  -1.402  -3.456  14.821
  772    HA   ALA 104           HA       ALA 104  -2.014  -1.189  13.311
  773    HB1  ALA 104           3HB      ALA 104  -1.686  -1.346  16.329
  774    HB2  ALA 104           1HB      ALA 104  -3.142  -1.781  15.435
  775    HB3  ALA 104           2HB      ALA 104  -2.590  -0.105  15.456
  776    H    ASN 105           H        ASN 105   1.024  -2.072  14.384
  777    HA   ASN 105           HA       ASN 105   2.119   0.631  14.766
  778    HB2  ASN 105           1HB      ASN 105   3.624  -2.008  14.548
  779    HB3  ASN 105           2HB      ASN 105   4.285  -0.460  15.061
  780   HD21  ASN 105          2HD2      ASN 105   1.440  -0.097  16.482
  781   HD22  ASN 105          1HD2      ASN 105   1.677  -0.936  17.939
  782    H    ASN 106           H        ASN 106   2.082  -1.886  12.261
  783    HA   ASN 106           HA       ASN 106   3.681  -0.239  10.406
  784    HB2  ASN 106           1HB      ASN 106   2.567  -3.063  10.181
  785    HB3  ASN 106           2HB      ASN 106   3.630  -2.286   9.009
  786   HD21  ASN 106          2HD2      ASN 106   5.453  -1.013  10.833
  787   HD22  ASN 106          1HD2      ASN 106   6.308  -2.229  11.654
  788    H    VAL 107           H        VAL 107   1.266   0.937  11.038
  789    HA   VAL 107           HA       VAL 107  -0.537   0.405   8.718
  790    HB   VAL 107           HB       VAL 107  -1.554   0.340  10.984
  791   HG11  VAL 107          1HG1      VAL 107  -0.016   2.057  12.036
  792   HG12  VAL 107          2HG1      VAL 107  -1.723   2.331  12.382
  793   HG13  VAL 107          3HG1      VAL 107  -0.900   3.317  11.178
  794   HG21  VAL 107          3HG2      VAL 107  -2.491   2.742   9.342
  795   HG22  VAL 107          1HG2      VAL 107  -3.462   1.827  10.495
  796   HG23  VAL 107          2HG2      VAL 107  -2.910   1.063   9.005
  797    H    PHE 108           H        PHE 108  -0.878   1.935   7.205
  798    HA   PHE 108           HA       PHE 108   0.191   4.670   7.558
  799    HB2  PHE 108           1HB      PHE 108   0.950   2.887   5.201
  800    HB3  PHE 108           2HB      PHE 108   1.480   4.544   5.491
  801    HD1  PHE 108           HD1      PHE 108   2.598   4.972   7.895
  802    HD2  PHE 108           HD2      PHE 108   2.442   1.120   5.948
  803    HE1  PHE 108           HE1      PHE 108   4.490   4.181   9.282
  804    HE2  PHE 108           HE2      PHE 108   4.339   0.351   7.343
  805    HZ   PHE 108           HZ       PHE 108   5.363   1.878   9.007
  806    H    SER 109           H        SER 109  -0.880   6.187   6.399
  807    HA   SER 109           HA       SER 109  -2.612   5.640   4.177
  808    HB2  SER 109           1HB      SER 109  -4.759   6.182   5.389
  809    HB3  SER 109           2HB      SER 109  -4.051   4.654   5.900
  810    HG   SER 109           HG       SER 109  -3.220   5.681   7.707
  811    H    ARG 110           H        ARG 110  -3.219   7.513   3.178
  812    HA   ARG 110           HA       ARG 110  -2.865  10.115   4.552
  813    HB2  ARG 110           1HB      ARG 110  -1.398  10.966   2.801
  814    HB3  ARG 110           2HB      ARG 110  -0.683   9.501   3.475
  815    HG2  ARG 110           1HG      ARG 110  -1.657   8.194   1.551
  816    HG3  ARG 110           2HG      ARG 110  -2.237   9.713   0.857
  817    HD2  ARG 110           1HD      ARG 110   0.672   9.053   1.428
  818    HD3  ARG 110           2HD      ARG 110  -0.095   9.026  -0.161
  819    HE   ARG 110           HE       ARG 110  -0.555  11.554   0.968
  820   HH11  ARG 110          1HH2      ARG 110   2.110   9.628  -0.192
  821   HH12  ARG 110          2HH2      ARG 110   3.058  11.002  -0.655
  822   HH21  ARG 110          1HH1      ARG 110   0.695  13.322   0.363
  823   HH22  ARG 110          2HH1      ARG 110   2.260  13.086  -0.342
  824    H    ILE 111           H        ILE 111  -4.065  11.757   3.693
  825    HA   ILE 111           HA       ILE 111  -6.271  10.952   1.900
  826    HB   ILE 111           HB       ILE 111  -5.799  13.375   3.691
  827   HG12  ILE 111          1HG1      ILE 111  -7.821  12.505   4.900
  828   HG13  ILE 111          2HG1      ILE 111  -7.880  11.145   3.787
  829   HG21  ILE 111          1HG2      ILE 111  -8.082  12.852   1.724
  830   HG22  ILE 111          2HG2      ILE 111  -7.051  14.281   1.798
  831   HG23  ILE 111          3HG2      ILE 111  -8.241  13.991   3.063
  832   HD11  ILE 111          3HD1      ILE 111  -5.987  10.134   4.725
  833   HD12  ILE 111          1HD1      ILE 111  -6.763  10.851   6.131
  834   HD13  ILE 111          2HD1      ILE 111  -5.369  11.646   5.404
  835    H    VAL 112           H        VAL 112  -6.670  11.923  -0.037
  836    HA   VAL 112           HA       VAL 112  -4.760  13.962  -1.081
  837    HB   VAL 112           HB       VAL 112  -4.645  12.659  -3.248
  838   HG11  VAL 112          1HG1      VAL 112  -2.957  11.040  -2.452
  839   HG12  VAL 112          2HG1      VAL 112  -3.560  11.189  -0.806
  840   HG13  VAL 112          3HG1      VAL 112  -2.790  12.565  -1.592
  841   HG21  VAL 112          3HG2      VAL 112  -5.236  10.245  -3.204
  842   HG22  VAL 112          1HG2      VAL 112  -6.662  11.238  -2.902
  843   HG23  VAL 112          2HG2      VAL 112  -5.859  10.420  -1.563
  844    H    LYS 113           H        LYS 113  -5.623  15.431  -2.410
  845    HA   LYS 113           HA       LYS 113  -8.566  15.332  -2.898
  846    HB2  LYS 113           1HB      LYS 113  -6.686  17.715  -2.657
  847    HB3  LYS 113           2HB      LYS 113  -8.422  17.802  -2.968
  848    HG2  LYS 113           1HG      LYS 113  -8.844  16.622  -0.794
  849    HG3  LYS 113           2HG      LYS 113  -7.110  16.636  -0.475
  850    HD2  LYS 113           1HD      LYS 113  -7.122  19.122  -0.533
  851    HD3  LYS 113           2HD      LYS 113  -8.856  19.104  -0.853
  852    HE2  LYS 113           1HE      LYS 113  -9.241  17.952   1.319
  853    HE3  LYS 113           2HE      LYS 113  -7.508  18.001   1.644
  854    HZ1  LYS 113           3HZ      LYS 113  -7.541  20.235   1.996
  855    HZ2  LYS 113           1HZ      LYS 113  -9.110  19.859   2.520
  856    HZ3  LYS 113           2HZ      LYS 113  -8.867  20.507   0.969
  857    H    VAL 114           H        VAL 114  -9.360  15.739  -4.898
  858    HA   VAL 114           HA       VAL 114  -7.430  15.748  -7.173
  859    HB   VAL 114           HB       VAL 114  -9.288  14.710  -8.460
  860   HG11  VAL 114          1HG1      VAL 114  -9.204  12.491  -7.332
  861   HG12  VAL 114          2HG1      VAL 114  -8.604  13.263  -5.864
  862   HG13  VAL 114          3HG1      VAL 114  -7.627  13.273  -7.330
  863   HG21  VAL 114          3HG2      VAL 114 -11.244  15.588  -7.225
  864   HG22  VAL 114          1HG2      VAL 114 -10.747  14.720  -5.773
  865   HG23  VAL 114          2HG2      VAL 114 -11.286  13.830  -7.197
  866    H    LEU 115           H        LEU 115  -7.500  17.334  -8.622
  867    HA   LEU 115           HA       LEU 115  -9.144  19.682  -8.051
  868    HB2  LEU 115           1HB      LEU 115  -6.878  19.065  -9.972
  869    HB3  LEU 115           2HB      LEU 115  -7.814  20.542 -10.172
  870    HG   LEU 115           HG       LEU 115  -5.718  20.897  -8.844
  871   HD11  LEU 115          1HD1      LEU 115  -6.603  22.444  -7.382
  872   HD12  LEU 115          2HD1      LEU 115  -7.892  21.392  -6.806
  873   HD13  LEU 115          3HD1      LEU 115  -8.030  22.181  -8.378
  874   HD21  LEU 115          3HD2      LEU 115  -5.391  19.935  -6.661
  875   HD22  LEU 115          1HD2      LEU 115  -5.734  18.599  -7.759
  876   HD23  LEU 115          2HD2      LEU 115  -6.988  19.193  -6.668
  877    H    GLU 116           H        GLU 116 -10.916  20.284  -9.090
  878    HA   GLU 116           HA       GLU 116 -11.776  18.860 -11.578
  879    HB2  GLU 116           1HB      GLU 116 -13.493  19.561  -9.164
  880    HB3  GLU 116           2HB      GLU 116 -14.073  18.831 -10.661
  881    HG2  GLU 116           1HG      GLU 116 -12.034  17.571  -8.778
  882    HG3  GLU 116           2HG      GLU 116 -13.737  17.135  -8.856
  883    H    HIS 117           H        HIS 117 -11.408  20.457 -12.997
  884    HA   HIS 117           HA       HIS 117 -13.219  22.696 -13.055
  885    HB2  HIS 117           1HB      HIS 117 -11.479  24.462 -13.009
  886    HB3  HIS 117           2HB      HIS 117 -11.538  23.590 -11.479
  887    HD1  HIS 117           HD1      HIS 117  -9.890  21.091 -12.203
  888    HD2  HIS 117           HD2      HIS 117  -8.747  24.966 -13.235
  889    HE1  HIS 117           HE1      HIS 117  -7.387  21.023 -12.587
  890    HE2  HIS 117           HE2      HIS 117  -6.676  23.378 -13.217
  891    H    HIS 118           H        HIS 118 -12.663  24.134 -14.964
  892    HA   HIS 118           HA       HIS 118 -11.144  22.813 -17.122
  893    HB2  HIS 118           1HB      HIS 118 -14.134  23.378 -17.338
  894    HB3  HIS 118           2HB      HIS 118 -13.096  22.806 -18.646
  895    HD1  HIS 118           HD1      HIS 118 -14.642  21.704 -15.388
  896    HD2  HIS 118           HD2      HIS 118 -12.418  20.053 -18.505
  897    HE1  HIS 118           HE1      HIS 118 -14.663  19.197 -15.033
  898    HE2  HIS 118           HE2      HIS 118 -13.312  18.176 -16.925
  899    H    HIS 119           H        HIS 119 -10.690  24.177 -18.860
  900    HA   HIS 119           HA       HIS 119 -10.364  26.939 -18.176
  901    HB2  HIS 119           1HB      HIS 119 -10.033  25.516 -20.852
  902    HB3  HIS 119           2HB      HIS 119  -9.451  27.139 -20.478
  903    HD1  HIS 119           HD1      HIS 119  -7.913  27.088 -18.075
  904    HD2  HIS 119           HD2      HIS 119  -8.025  23.665 -20.455
  905    HE1  HIS 119           HE1      HIS 119  -5.900  25.696 -17.424
  906    HE2  HIS 119           HE2      HIS 119  -5.953  23.608 -18.866
  907    H    HIS 120           H        HIS 120 -11.827  28.511 -18.353
  908    HA   HIS 120           HA       HIS 120 -14.391  28.098 -19.652
  909    HB2  HIS 120           1HB      HIS 120 -13.219  30.575 -18.314
  910    HB3  HIS 120           2HB      HIS 120 -14.914  30.316 -18.722
  911    HD1  HIS 120           HD1      HIS 120 -12.253  29.272 -16.294
  912    HD2  HIS 120           HD2      HIS 120 -16.292  28.506 -16.988
  913    HE1  HIS 120           HE1      HIS 120 -13.112  28.050 -14.249
  914    HE2  HIS 120           HE2      HIS 120 -15.573  27.576 -14.655
  915    H    HIS 121           H        HIS 121 -14.805  30.780 -20.528
  916    HA   HIS 121           HA       HIS 121 -14.741  31.986 -22.481
  917    HB2  HIS 121           1HB      HIS 121 -11.760  31.378 -22.346
  918    HB3  HIS 121           2HB      HIS 121 -12.509  32.666 -23.280
  919    HD1  HIS 121           HD1      HIS 121 -13.903  34.470 -21.755
  920    HD2  HIS 121           HD2      HIS 121 -11.114  32.096 -19.762
  921    HE1  HIS 121           HE1      HIS 121 -13.419  35.625 -19.552
  922    HE2  HIS 121           HE2      HIS 121 -11.721  34.189 -18.326
  923    H    HIS 122           H        HIS 122 -12.045  29.870 -23.404
  924    HA   HIS 122           HA       HIS 122 -13.603  28.091 -25.045
  925    HB2  HIS 122           1HB      HIS 122 -12.755  28.897 -27.240
  926    HB3  HIS 122           2HB      HIS 122 -13.775  30.106 -26.457
  927    HD1  HIS 122           HD1      HIS 122 -11.703  31.264 -24.457
  928    HD2  HIS 122           HD2      HIS 122 -10.908  30.581 -28.491
  929    HE1  HIS 122           HE1      HIS 122  -9.757  32.763 -25.065
  930    HE2  HIS 122           HE2      HIS 122  -9.259  32.360 -27.522
  Start of MODEL    2
    1    H1   MET   1           1H       MET   1  10.821  14.671   3.483
    2    H2   MET   1           2H       MET   1  11.105  12.999   3.573
    3    H3   MET   1           3H       MET   1   9.680  13.656   4.225
    4    HA   MET   1           HA       MET   1   8.709  13.996   2.195
    5    HB2  MET   1           1HB      MET   1  10.070  14.015   0.066
    6    HB3  MET   1           2HB      MET   1  10.519  15.297   1.188
    7    HG2  MET   1           1HG      MET   1  12.434  13.946   1.984
    8    HG3  MET   1           2HG      MET   1  11.987  12.647   0.879
    9    HE1  MET   1           3HE      MET   1  14.288  12.588  -0.068
   10    HE2  MET   1           1HE      MET   1  14.867  13.929   0.929
   11    HE3  MET   1           2HE      MET   1  15.160  13.927  -0.808
   12    H    ASP   2           H        ASP   2  10.730  11.600   3.413
   13    HA   ASP   2           HA       ASP   2  10.128   9.492   1.487
   14    HB2  ASP   2           1HB      ASP   2  11.372   9.410   4.265
   15    HB3  ASP   2           2HB      ASP   2  11.342   8.075   3.116
   16    H    LEU   3           H        LEU   3   7.766   9.886   1.634
   17    HA   LEU   3           HA       LEU   3   6.381   9.183   4.070
   18    HB2  LEU   3           1HB      LEU   3   5.567   9.933   1.258
   19    HB3  LEU   3           2HB      LEU   3   4.360   9.137   2.260
   20    HG   LEU   3           HG       LEU   3   4.655  10.913   3.999
   21   HD11  LEU   3          1HD1      LEU   3   6.539  12.153   1.954
   22   HD12  LEU   3          2HD1      LEU   3   6.971  11.583   3.567
   23   HD13  LEU   3          3HD1      LEU   3   5.929  12.986   3.385
   24   HD21  LEU   3          3HD2      LEU   3   3.550  12.735   2.731
   25   HD22  LEU   3          1HD2      LEU   3   2.906  11.161   2.267
   26   HD23  LEU   3          2HD2      LEU   3   4.052  11.987   1.213
   27    HA   PRO   4           HA       PRO   4   6.256   4.767   3.503
   28    HB2  PRO   4           1HB      PRO   4   3.869   4.054   4.690
   29    HB3  PRO   4           2HB      PRO   4   5.241   4.688   5.636
   30    HG2  PRO   4           1HG      PRO   4   2.866   6.210   4.545
   31    HG3  PRO   4           2HG      PRO   4   3.496   6.188   6.211
   32    HD2  PRO   4           1HD      PRO   4   4.185   8.197   4.537
   33    HD3  PRO   4           2HD      PRO   4   5.404   7.507   5.633
   34    H    ILE   5           H        ILE   5   3.694   6.743   2.209
   35    HA   ILE   5           HA       ILE   5   3.069   4.670   0.131
   36    HB   ILE   5           HB       ILE   5   1.126   6.672   1.372
   37   HG12  ILE   5          1HG1      ILE   5   1.219   3.622   1.638
   38   HG13  ILE   5          2HG1      ILE   5   1.785   4.724   2.883
   39   HG21  ILE   5          1HG2      ILE   5   0.726   4.457  -0.699
   40   HG22  ILE   5          2HG2      ILE   5   0.597   6.187  -1.008
   41   HG23  ILE   5          3HG2      ILE   5  -0.577   5.396   0.019
   42   HD11  ILE   5          3HD1      ILE   5  -1.052   4.561   1.831
   43   HD12  ILE   5          1HD1      ILE   5  -0.480   5.718   3.034
   44   HD13  ILE   5          2HD1      ILE   5  -0.484   3.993   3.392
   45    H    THR   6           H        THR   6   3.332   5.307  -1.897
   46    HA   THR   6           HA       THR   6   3.388   8.224  -2.581
   47    HB   THR   6           HB       THR   6   5.363   6.157  -3.646
   48    HG1  THR   6           HG1      THR   6   5.762   8.266  -1.796
   49   HG21  THR   6          3HG2      THR   6   4.926   8.041  -5.202
   50   HG22  THR   6          1HG2      THR   6   6.540   8.171  -4.505
   51   HG23  THR   6          2HG2      THR   6   5.237   9.190  -3.901
   52    H    LEU   7           H        LEU   7   1.946   8.643  -4.082
   53    HA   LEU   7           HA       LEU   7   0.925   6.484  -5.862
   54    HB2  LEU   7           1HB      LEU   7  -0.229   9.258  -5.371
   55    HB3  LEU   7           2HB      LEU   7  -0.996   7.907  -6.196
   56    HG   LEU   7           HG       LEU   7  -0.399   6.712  -3.731
   57   HD11  LEU   7          1HD1      LEU   7   0.435   8.845  -2.788
   58   HD12  LEU   7          2HD1      LEU   7  -0.999   8.282  -1.933
   59   HD13  LEU   7          3HD1      LEU   7  -1.127   9.601  -3.100
   60   HD21  LEU   7          3HD2      LEU   7  -2.799   7.069  -3.133
   61   HD22  LEU   7          1HD2      LEU   7  -2.583   6.579  -4.811
   62   HD23  LEU   7          2HD2      LEU   7  -2.921   8.266  -4.427
   63    H    SER   8           H        SER   8   0.851   6.748  -8.088
   64    HA   SER   8           HA       SER   8   2.904   8.512  -9.238
   65    HB2  SER   8           1HB      SER   8   2.437   7.253 -11.325
   66    HB3  SER   8           2HB      SER   8   2.779   6.174  -9.978
   67    HG   SER   8           HG       SER   8   0.412   6.639 -11.359
   68    H    LYS   9           H        LYS   9   0.548   9.782  -8.119
   69    HA   LYS   9           HA       LYS   9  -1.220  10.578 -10.233
   70    HB2  LYS   9           1HB      LYS   9  -1.768  10.603  -7.740
   71    HB3  LYS   9           2HB      LYS   9  -0.762  12.037  -7.591
   72    HG2  LYS   9           1HG      LYS   9  -2.212  13.259  -9.175
   73    HG3  LYS   9           2HG      LYS   9  -3.163  11.818  -9.477
   74    HD2  LYS   9           1HD      LYS   9  -2.982  12.673  -6.576
   75    HD3  LYS   9           2HD      LYS   9  -3.896  13.744  -7.630
   76    HE2  LYS   9           1HE      LYS   9  -5.352  12.020  -6.571
   77    HE3  LYS   9           2HE      LYS   9  -5.354  11.885  -8.326
   78    HZ1  LYS   9           3HZ      LYS   9  -3.621  10.170  -8.109
   79    HZ2  LYS   9           1HZ      LYS   9  -5.090   9.726  -7.387
   80    HZ3  LYS   9           2HZ      LYS   9  -3.789  10.237  -6.419
   81    H    GLU  10           H        GLU  10   1.074  10.887 -11.437
   82    HA   GLU  10           HA       GLU  10   2.595  13.198 -11.176
   83    HB2  GLU  10           1HB      GLU  10   1.711  11.813 -13.739
   84    HB3  GLU  10           2HB      GLU  10   3.054  12.955 -13.622
   85    HG2  GLU  10           1HG      GLU  10   4.202  11.446 -12.026
   86    HG3  GLU  10           2HG      GLU  10   2.862  10.307 -12.132
   87    H    THR  11           H        THR  11  -0.609  12.782 -12.544
   88    HA   THR  11           HA       THR  11  -0.882  15.730 -12.796
   89    HB   THR  11           HB       THR  11  -2.097  15.472 -14.890
   90    HG1  THR  11           HG1      THR  11  -2.993  13.611 -15.156
   91   HG21  THR  11          3HG2      THR  11   0.485  13.854 -14.988
   92   HG22  THR  11          1HG2      THR  11   0.421  15.620 -14.961
   93   HG23  THR  11          2HG2      THR  11  -0.254  14.729 -16.325
   94    HA   PRO  12           HA       PRO  12  -4.649  14.686 -10.510
   95    HB2  PRO  12           1HB      PRO  12  -5.829  17.107 -10.287
   96    HB3  PRO  12           2HB      PRO  12  -4.247  16.810  -9.524
   97    HG2  PRO  12           1HG      PRO  12  -4.803  18.119 -12.196
   98    HG3  PRO  12           2HG      PRO  12  -3.810  18.728 -10.854
   99    HD2  PRO  12           1HD      PRO  12  -2.675  17.388 -12.973
  100    HD3  PRO  12           2HD      PRO  12  -2.025  17.243 -11.318
  101    H    PHE  13           H        PHE  13  -6.166  13.475 -11.546
  102    HA   PHE  13           HA       PHE  13  -8.225  14.701 -13.142
  103    HB2  PHE  13           1HB      PHE  13  -6.306  14.440 -14.812
  104    HB3  PHE  13           2HB      PHE  13  -6.445  12.698 -14.619
  105    HD1  PHE  13           HD1      PHE  13  -8.592  11.515 -15.294
  106    HD2  PHE  13           HD2      PHE  13  -7.991  15.708 -16.093
  107    HE1  PHE  13           HE1      PHE  13 -10.475  11.484 -16.903
  108    HE2  PHE  13           HE2      PHE  13  -9.875  15.663 -17.700
  109    HZ   PHE  13           HZ       PHE  13 -11.117  13.556 -18.105
  110    H    GLU  14           H        GLU  14  -9.799  13.740 -11.960
  111    HA   GLU  14           HA       GLU  14  -9.796  11.204 -10.804
  112    HB2  GLU  14           1HB      GLU  14 -11.469  13.018 -10.352
  113    HB3  GLU  14           2HB      GLU  14 -12.241  12.662 -11.893
  114    HG2  GLU  14           1HG      GLU  14 -12.712  10.345 -11.127
  115    HG3  GLU  14           2HG      GLU  14 -11.906  10.681  -9.599
  116    H    GLY  15           H        GLY  15 -10.562   9.177 -11.424
  117    HA2  GLY  15           1HA      GLY  15 -11.417   7.540 -12.881
  118    HA3  GLY  15           2HA      GLY  15 -11.431   8.688 -14.203
  119    H    GLU  16           H        GLU  16  -8.593   9.471 -13.378
  120    HA   GLU  16           HA       GLU  16  -7.211   7.777 -15.224
  121    HB2  GLU  16           1HB      GLU  16  -6.609  10.164 -14.765
  122    HB3  GLU  16           2HB      GLU  16  -6.030   9.701 -13.169
  123    HG2  GLU  16           1HG      GLU  16  -4.343   8.202 -14.217
  124    HG3  GLU  16           2HG      GLU  16  -4.944   8.634 -15.814
  125    H    GLU  17           H        GLU  17  -5.823   6.092 -14.877
  126    HA   GLU  17           HA       GLU  17  -6.155   4.544 -12.496
  127    HB2  GLU  17           1HB      GLU  17  -5.739   3.580 -14.775
  128    HB3  GLU  17           2HB      GLU  17  -4.086   4.188 -14.712
  129    HG2  GLU  17           1HG      GLU  17  -3.661   2.813 -12.682
  130    HG3  GLU  17           2HG      GLU  17  -5.320   2.224 -12.732
  131    H    ILE  18           H        ILE  18  -4.919   4.456 -10.707
  132    HA   ILE  18           HA       ILE  18  -2.374   6.045 -10.588
  133    HB   ILE  18           HB       ILE  18  -2.935   6.401  -8.158
  134   HG12  ILE  18          1HG1      ILE  18  -5.727   5.405  -8.949
  135   HG13  ILE  18          2HG1      ILE  18  -4.590   4.448  -8.010
  136   HG21  ILE  18          1HG2      ILE  18  -4.976   7.465 -10.161
  137   HG22  ILE  18          2HG2      ILE  18  -3.385   8.160  -9.850
  138   HG23  ILE  18          3HG2      ILE  18  -4.615   8.187  -8.595
  139   HD11  ILE  18          3HD1      ILE  18  -4.531   6.218  -6.275
  140   HD12  ILE  18          1HD1      ILE  18  -6.153   5.576  -6.510
  141   HD13  ILE  18          2HD1      ILE  18  -5.721   7.139  -7.190
  142    H    THR  19           H        THR  19  -0.658   5.180  -9.550
  143    HA   THR  19           HA       THR  19  -0.724   2.247  -9.119
  144    HB   THR  19           HB       THR  19   1.671   4.128  -9.231
  145    HG1  THR  19           HG1      THR  19   0.243   2.714 -11.203
  146   HG21  THR  19          3HG2      THR  19   1.426   1.110  -9.550
  147   HG22  THR  19          1HG2      THR  19   2.127   1.936  -8.157
  148   HG23  THR  19          2HG2      THR  19   2.910   2.042  -9.730
  149    H    VAL  20           H        VAL  20  -1.261   1.703  -7.098
  150    HA   VAL  20           HA       VAL  20  -0.470   3.385  -4.794
  151    HB   VAL  20           HB       VAL  20  -2.172   0.845  -4.848
  152   HG11  VAL  20          1HG1      VAL  20  -1.242   1.399  -2.609
  153   HG12  VAL  20          2HG1      VAL  20  -2.973   1.702  -2.644
  154   HG13  VAL  20          3HG1      VAL  20  -1.844   3.051  -2.758
  155   HG21  VAL  20          3HG2      VAL  20  -4.108   2.414  -4.745
  156   HG22  VAL  20          1HG2      VAL  20  -3.201   2.620  -6.240
  157   HG23  VAL  20          2HG2      VAL  20  -3.008   3.780  -4.928
  158    H    SER  21           H        SER  21   1.444   2.982  -3.867
  159    HA   SER  21           HA       SER  21   2.482   0.179  -3.692
  160    HB2  SER  21           1HB      SER  21   3.780   1.409  -5.368
  161    HB3  SER  21           2HB      SER  21   4.022   2.740  -4.240
  162    HG   SER  21           HG       SER  21   4.712   0.418  -3.084
  163    H    ALA  22           H        ALA  22   3.197  -0.435  -1.754
  164    HA   ALA  22           HA       ALA  22   3.331   1.558   0.482
  165    HB1  ALA  22           3HB      ALA  22   2.438  -0.237   1.922
  166    HB2  ALA  22           1HB      ALA  22   2.332  -1.316   0.525
  167    HB3  ALA  22           2HB      ALA  22   1.319   0.124   0.607
  168    H    ARG  23           H        ARG  23   5.301   1.675   1.347
  169    HA   ARG  23           HA       ARG  23   7.375  -0.255   0.688
  170    HB2  ARG  23           1HB      ARG  23   7.420   2.109   2.607
  171    HB3  ARG  23           2HB      ARG  23   8.831   1.172   2.101
  172    HG2  ARG  23           1HG      ARG  23   8.362   1.803  -0.281
  173    HG3  ARG  23           2HG      ARG  23   7.012   2.801   0.272
  174    HD2  ARG  23           1HD      ARG  23   9.930   3.163   1.058
  175    HD3  ARG  23           2HD      ARG  23   9.040   4.176  -0.081
  176    HE   ARG  23           HE       ARG  23   7.587   4.183   2.304
  177   HH11  ARG  23          1HH2      ARG  23  10.710   5.171   1.148
  178   HH12  ARG  23          2HH2      ARG  23  10.882   6.444   2.307
  179   HH21  ARG  23          1HH1      ARG  23   7.823   5.848   3.824
  180   HH22  ARG  23          2HH1      ARG  23   9.250   6.830   3.818
  181    H    VAL  24           H        VAL  24   7.537  -2.138   1.675
  182    HA   VAL  24           HA       VAL  24   6.450  -2.554   4.398
  183    HB   VAL  24           HB       VAL  24   7.550  -4.531   2.351
  184   HG11  VAL  24          1HG1      VAL  24   6.275  -6.194   3.805
  185   HG12  VAL  24          2HG1      VAL  24   6.079  -4.922   5.000
  186   HG13  VAL  24          3HG1      VAL  24   7.690  -5.501   4.591
  187   HG21  VAL  24          3HG2      VAL  24   4.682  -3.767   3.053
  188   HG22  VAL  24          1HG2      VAL  24   5.153  -5.067   1.960
  189   HG23  VAL  24          2HG2      VAL  24   5.508  -3.396   1.537
  190    H    THR  25           H        THR  25   7.786  -2.419   6.089
  191    HA   THR  25           HA       THR  25  10.733  -2.766   5.710
  192    HB   THR  25           HB       THR  25   9.217  -1.333   7.930
  193    HG1  THR  25           HG1      THR  25  10.025   0.512   6.850
  194   HG21  THR  25          3HG2      THR  25  11.422  -2.128   8.701
  195   HG22  THR  25          1HG2      THR  25  11.486  -0.388   8.434
  196   HG23  THR  25          2HG2      THR  25  12.187  -1.485   7.247
  197    H    ASN  26           H        ASN  26  11.575  -4.585   6.463
  198    HA   ASN  26           HA       ASN  26  10.056  -6.343   8.276
  199    HB2  ASN  26           1HB      ASN  26  12.690  -6.710   6.805
  200    HB3  ASN  26           2HB      ASN  26  11.895  -7.953   7.772
  201   HD21  ASN  26          2HD2      ASN  26  11.815  -9.183   5.650
  202   HD22  ASN  26          1HD2      ASN  26  10.549  -8.850   4.573
  203    H    ARG  27           H        ARG  27  10.414  -6.437  10.390
  204    HA   ARG  27           HA       ARG  27  12.985  -5.425  11.549
  205    HB2  ARG  27           1HB      ARG  27  10.164  -4.958  12.594
  206    HB3  ARG  27           2HB      ARG  27  11.655  -4.455  13.396
  207    HG2  ARG  27           1HG      ARG  27  12.223  -3.034  11.427
  208    HG3  ARG  27           2HG      ARG  27  10.719  -3.526  10.644
  209    HD2  ARG  27           1HD      ARG  27  10.406  -1.338  11.706
  210    HD3  ARG  27           2HD      ARG  27   9.444  -2.543  12.559
  211    HE   ARG  27           HE       ARG  27  10.773  -2.215  14.434
  212   HH11  ARG  27          1HH2      ARG  27  12.395  -0.959  11.622
  213   HH12  ARG  27          2HH2      ARG  27  13.705  -0.274  12.523
  214   HH21  ARG  27          1HH1      ARG  27  12.498  -1.322  15.598
  215   HH22  ARG  27          2HH1      ARG  27  13.763  -0.480  14.766
  216    H    GLY  28           H        GLY  28  13.934  -6.790  12.895
  217    HA2  GLY  28           1HA      GLY  28  12.774  -8.414  14.821
  218    HA3  GLY  28           2HA      GLY  28  12.918  -9.420  13.379
  219    H    ALA  29           H        ALA  29  14.826 -10.408  13.028
  220    HA   ALA  29           HA       ALA  29  17.387  -9.306  13.738
  221    HB1  ALA  29           3HB      ALA  29  16.351 -11.620  15.420
  222    HB2  ALA  29           1HB      ALA  29  16.626  -9.979  15.998
  223    HB3  ALA  29           2HB      ALA  29  17.989 -10.964  15.472
  224    H    ALA  30           H        ALA  30  15.480 -11.204  11.907
  225    HA   ALA  30           HA       ALA  30  17.770 -12.635  10.694
  226    HB1  ALA  30           3HB      ALA  30  16.516 -14.762  10.638
  227    HB2  ALA  30           1HB      ALA  30  15.196 -14.021  11.548
  228    HB3  ALA  30           2HB      ALA  30  16.773 -14.239  12.302
  229    H    GLU  31           H        GLU  31  17.229 -13.523   8.587
  230    HA   GLU  31           HA       GLU  31  15.860 -11.616   6.960
  231    HB2  GLU  31           1HB      GLU  31  16.845 -14.423   6.317
  232    HB3  GLU  31           2HB      GLU  31  16.302 -13.250   5.116
  233    HG2  GLU  31           1HG      GLU  31  18.088 -11.684   5.831
  234    HG3  GLU  31           2HG      GLU  31  18.635 -12.850   7.032
  235    H    ALA  32           H        ALA  32  13.730 -11.443   6.658
  236    HA   ALA  32           HA       ALA  32  11.896 -13.646   7.380
  237    HB1  ALA  32           3HB      ALA  32  11.354 -10.765   6.587
  238    HB2  ALA  32           1HB      ALA  32  11.454 -11.367   8.238
  239    HB3  ALA  32           2HB      ALA  32  10.154 -11.914   7.178
  240    H    HIS  33           H        HIS  33  10.270 -14.364   5.943
  241    HA   HIS  33           HA       HIS  33  10.532 -13.715   3.056
  242    HB2  HIS  33           1HB      HIS  33  10.627 -16.546   4.181
  243    HB3  HIS  33           2HB      HIS  33  10.634 -16.102   2.473
  244    HD1  HIS  33           HD1      HIS  33  12.812 -16.358   5.474
  245    HD2  HIS  33           HD2      HIS  33  13.096 -14.824   1.608
  246    HE1  HIS  33           HE1      HIS  33  15.270 -15.914   5.059
  247    HE2  HIS  33           HE2      HIS  33  15.460 -14.978   2.707
  248    H    ASN  34           H        ASN  34   8.788 -14.865   1.819
  249    HA   ASN  34           HA       ASN  34   6.529 -14.933   1.386
  250    HB2  ASN  34           1HB      ASN  34   6.849 -17.101   2.535
  251    HB3  ASN  34           2HB      ASN  34   6.500 -16.332   4.081
  252   HD21  ASN  34          2HD2      ASN  34   5.040 -17.221   0.941
  253   HD22  ASN  34          1HD2      ASN  34   3.434 -17.145   1.485
  254    H    VAL  35           H        VAL  35   6.859 -12.501   1.850
  255    HA   VAL  35           HA       VAL  35   5.083 -11.583   4.073
  256    HB   VAL  35           HB       VAL  35   7.226 -10.022   2.576
  257   HG11  VAL  35          1HG1      VAL  35   5.458  -8.562   3.504
  258   HG12  VAL  35          2HG1      VAL  35   6.906  -8.422   4.497
  259   HG13  VAL  35          3HG1      VAL  35   5.549  -9.388   5.063
  260   HG21  VAL  35          3HG2      VAL  35   8.458 -10.266   4.806
  261   HG22  VAL  35          1HG2      VAL  35   8.277 -11.784   3.929
  262   HG23  VAL  35          2HG2      VAL  35   7.236 -11.424   5.307
  263    HA   PRO  36           HA       PRO  36   2.839 -10.572   0.133
  264    HB2  PRO  36           1HB      PRO  36   0.376 -11.507   0.713
  265    HB3  PRO  36           2HB      PRO  36   1.694 -12.645   0.338
  266    HG2  PRO  36           1HG      PRO  36   0.709 -11.770   3.053
  267    HG3  PRO  36           2HG      PRO  36   0.949 -13.426   2.452
  268    HD2  PRO  36           1HD      PRO  36   2.859 -12.149   3.951
  269    HD3  PRO  36           2HD      PRO  36   3.314 -13.298   2.673
  270    H    VAL  37           H        VAL  37   1.248  -8.971  -0.286
  271    HA   VAL  37           HA       VAL  37   0.586  -7.175   2.020
  272    HB   VAL  37           HB       VAL  37   1.353  -6.319  -0.806
  273   HG11  VAL  37          1HG1      VAL  37  -0.181  -4.730   0.322
  274   HG12  VAL  37          2HG1      VAL  37   1.432  -4.040   0.224
  275   HG13  VAL  37          3HG1      VAL  37   0.854  -4.719   1.747
  276   HG21  VAL  37          3HG2      VAL  37   3.444  -5.498   0.244
  277   HG22  VAL  37          1HG2      VAL  37   3.303  -7.247   0.409
  278   HG23  VAL  37          2HG2      VAL  37   2.947  -6.202   1.787
  279    H    ALA  38           H        ALA  38  -1.456  -6.510   2.140
  280    HA   ALA  38           HA       ALA  38  -3.331  -7.005  -0.142
  281    HB1  ALA  38           3HB      ALA  38  -3.608  -8.706   1.651
  282    HB2  ALA  38           1HB      ALA  38  -5.019  -7.652   1.530
  283    HB3  ALA  38           2HB      ALA  38  -3.850  -7.421   2.836
  284    H    VAL  39           H        VAL  39  -3.956  -5.062  -0.838
  285    HA   VAL  39           HA       VAL  39  -4.360  -2.818   1.067
  286    HB   VAL  39           HB       VAL  39  -4.309  -1.466  -1.113
  287   HG11  VAL  39          1HG1      VAL  39  -2.347  -1.583   0.413
  288   HG12  VAL  39          2HG1      VAL  39  -1.838  -1.486  -1.268
  289   HG13  VAL  39          3HG1      VAL  39  -1.795  -3.030  -0.420
  290   HG21  VAL  39          3HG2      VAL  39  -4.761  -3.363  -2.651
  291   HG22  VAL  39          1HG2      VAL  39  -3.181  -4.035  -2.255
  292   HG23  VAL  39          2HG2      VAL  39  -3.298  -2.483  -3.071
  293    H    TYR  40           H        TYR  40  -6.286  -1.857   1.221
  294    HA   TYR  40           HA       TYR  40  -8.510  -2.584  -0.590
  295    HB2  TYR  40           1HB      TYR  40  -9.960  -3.104   1.410
  296    HB3  TYR  40           2HB      TYR  40  -8.677  -4.283   1.143
  297    HD1  TYR  40           HD1      TYR  40  -6.687  -4.392   2.638
  298    HD2  TYR  40           HD2      TYR  40  -9.842  -1.532   3.342
  299    HE1  TYR  40           HE1      TYR  40  -5.795  -3.953   4.907
  300    HE2  TYR  40           HE2      TYR  40  -8.933  -1.104   5.608
  301    HH   TYR  40           HH       TYR  40  -6.328  -1.424   6.634
  302    H    LEU  41           H        LEU  41  -9.719  -0.888  -1.036
  303    HA   LEU  41           HA       LEU  41  -9.173   1.681   0.269
  304    HB2  LEU  41           1HB      LEU  41  -9.482   1.363  -2.244
  305    HB3  LEU  41           2HB      LEU  41 -11.190   1.097  -1.941
  306    HG   LEU  41           HG       LEU  41 -10.875   3.481  -0.560
  307   HD11  LEU  41          1HD1      LEU  41  -9.361   4.983  -1.734
  308   HD12  LEU  41          2HD1      LEU  41  -8.873   3.699  -2.842
  309   HD13  LEU  41          3HD1      LEU  41  -8.450   3.600  -1.136
  310   HD21  LEU  41          3HD2      LEU  41 -11.299   3.250  -3.556
  311   HD22  LEU  41          1HD2      LEU  41 -11.705   4.669  -2.592
  312   HD23  LEU  41          2HD2      LEU  41 -12.546   3.143  -2.323
  313    H    GLY  42           H        GLY  42 -10.359   2.493   1.894
  314    HA2  GLY  42           1HA      GLY  42 -12.654   3.133   2.605
  315    HA3  GLY  42           2HA      GLY  42 -13.109   1.441   2.460
  316    H    ASN  43           H        ASN  43 -13.756   1.630   4.681
  317    HA   ASN  43           HA       ASN  43 -11.628   1.913   6.689
  318    HB2  ASN  43           1HB      ASN  43 -13.583   1.762   8.300
  319    HB3  ASN  43           2HB      ASN  43 -13.654   3.115   7.174
  320   HD21  ASN  43          2HD2      ASN  43 -15.853   3.368   6.708
  321   HD22  ASN  43          1HD2      ASN  43 -16.881   2.111   6.213
  322    HA   PRO  44           HA       PRO  44 -11.278  -2.543   7.087
  323    HB2  PRO  44           1HB      PRO  44 -10.199  -2.837   9.572
  324    HB3  PRO  44           2HB      PRO  44  -9.288  -2.067   8.253
  325    HG2  PRO  44           1HG      PRO  44 -10.908  -0.718  10.422
  326    HG3  PRO  44           2HG      PRO  44  -9.222  -0.397   9.946
  327    HD2  PRO  44           1HD      PRO  44 -11.244   1.149   8.972
  328    HD3  PRO  44           2HD      PRO  44  -9.869   0.705   7.926
  329    H    ALA  45           H        ALA  45 -13.386  -0.659   9.007
  330    HA   ALA  45           HA       ALA  45 -14.501  -2.533  10.777
  331    HB1  ALA  45           3HB      ALA  45 -16.485  -1.055  10.783
  332    HB2  ALA  45           1HB      ALA  45 -15.888  -0.244   9.331
  333    HB3  ALA  45           2HB      ALA  45 -14.997  -0.108  10.847
  334    H    GLN  46           H        GLN  46 -15.342  -1.782   7.406
  335    HA   GLN  46           HA       GLN  46 -17.425  -3.830   7.280
  336    HB2  GLN  46           1HB      GLN  46 -16.143  -2.090   5.137
  337    HB3  GLN  46           2HB      GLN  46 -17.531  -3.152   4.875
  338    HG2  GLN  46           1HG      GLN  46 -18.822  -1.883   6.580
  339    HG3  GLN  46           2HG      GLN  46 -17.442  -0.816   6.829
  340   HE21  GLN  46          2HE2      GLN  46 -20.343  -1.022   5.157
  341   HE22  GLN  46          1HE2      GLN  46 -19.998   0.060   3.895
  342    H    GLY  47           H        GLY  47 -14.225  -4.146   7.555
  343    HA2  GLY  47           1HA      GLY  47 -12.877  -5.998   7.233
  344    HA3  GLY  47           2HA      GLY  47 -14.139  -6.751   6.263
  345    H    GLY  48           H        GLY  48 -14.006  -3.855   4.918
  346    HA2  GLY  48           1HA      GLY  48 -13.148  -3.027   2.943
  347    HA3  GLY  48           2HA      GLY  48 -11.591  -3.599   3.529
  348    H    VAL  49           H        VAL  49 -11.750  -3.732   0.921
  349    HA   VAL  49           HA       VAL  49 -12.185  -6.621   0.279
  350    HB   VAL  49           HB       VAL  49 -14.060  -5.279  -0.630
  351   HG11  VAL  49          1HG1      VAL  49 -13.714  -3.576  -2.349
  352   HG12  VAL  49          2HG1      VAL  49 -11.972  -3.809  -2.301
  353   HG13  VAL  49          3HG1      VAL  49 -12.806  -3.118  -0.908
  354   HG21  VAL  49          3HG2      VAL  49 -13.232  -7.289  -1.871
  355   HG22  VAL  49          1HG2      VAL  49 -12.171  -6.250  -2.825
  356   HG23  VAL  49          2HG2      VAL  49 -13.919  -6.081  -2.955
  357    H    GLU  50           H        GLU  50 -10.560  -7.572  -0.781
  358    HA   GLU  50           HA       GLU  50  -8.045  -6.211  -1.042
  359    HB2  GLU  50           1HB      GLU  50  -8.303  -8.643  -0.482
  360    HB3  GLU  50           2HB      GLU  50  -8.850  -8.949  -2.129
  361    HG2  GLU  50           1HG      GLU  50  -6.677  -8.112  -3.007
  362    HG3  GLU  50           2HG      GLU  50  -6.137  -7.778  -1.364
  363    H    ILE  51           H        ILE  51  -7.175  -5.235  -2.774
  364    HA   ILE  51           HA       ILE  51  -8.704  -5.170  -5.340
  365    HB   ILE  51           HB       ILE  51  -6.591  -3.237  -4.299
  366   HG12  ILE  51          1HG1      ILE  51  -9.627  -2.902  -4.429
  367   HG13  ILE  51          2HG1      ILE  51  -8.753  -3.281  -2.953
  368   HG21  ILE  51          1HG2      ILE  51  -7.449  -1.783  -6.153
  369   HG22  ILE  51          2HG2      ILE  51  -8.498  -3.089  -6.676
  370   HG23  ILE  51          3HG2      ILE  51  -6.748  -3.265  -6.778
  371   HD11  ILE  51          3HD1      ILE  51  -8.406  -0.774  -4.619
  372   HD12  ILE  51          1HD1      ILE  51  -7.455  -1.177  -3.186
  373   HD13  ILE  51          2HD1      ILE  51  -9.189  -0.902  -3.049
  374    H    GLY  52           H        GLY  52  -5.449  -5.541  -3.973
  375    HA2  GLY  52           1HA      GLY  52  -4.673  -7.414  -6.008
  376    HA3  GLY  52           2HA      GLY  52  -3.952  -5.831  -6.284
  377    H    ARG  53           H        ARG  53  -2.563  -8.260  -5.668
  378    HA   ARG  53           HA       ARG  53  -1.035  -7.345  -3.316
  379    HB2  ARG  53           1HB      ARG  53  -1.074  -9.647  -2.322
  380    HB3  ARG  53           2HB      ARG  53  -2.662  -8.879  -2.313
  381    HG2  ARG  53           1HG      ARG  53  -3.297 -10.139  -4.356
  382    HG3  ARG  53           2HG      ARG  53  -1.714 -10.912  -4.377
  383    HD2  ARG  53           1HD      ARG  53  -3.730 -11.147  -2.116
  384    HD3  ARG  53           2HD      ARG  53  -3.443 -12.378  -3.344
  385    HE   ARG  53           HE       ARG  53  -1.819 -11.850  -1.027
  386   HH11  ARG  53          1HH2      ARG  53  -1.723 -12.944  -4.329
  387   HH12  ARG  53          2HH2      ARG  53  -0.263 -13.853  -4.117
  388   HH21  ARG  53          1HH1      ARG  53   0.085 -13.040  -0.769
  389   HH22  ARG  53          2HH1      ARG  53   0.756 -13.906  -2.110
  390    H    ASP  54           H        ASP  54   1.004  -8.447  -3.106
  391    HA   ASP  54           HA       ASP  54   1.996 -10.093  -5.288
  392    HB2  ASP  54           1HB      ASP  54   2.014  -7.809  -6.294
  393    HB3  ASP  54           2HB      ASP  54   3.045  -7.245  -4.984
  394    H    THR  55           H        THR  55   3.143 -11.522  -4.143
  395    HA   THR  55           HA       THR  55   4.456 -10.804  -1.638
  396    HB   THR  55           HB       THR  55   4.522 -13.464  -3.132
  397    HG1  THR  55           HG1      THR  55   2.476 -13.364  -2.657
  398   HG21  THR  55          3HG2      THR  55   5.005 -12.753  -0.207
  399   HG22  THR  55          1HG2      THR  55   6.248 -13.248  -1.357
  400   HG23  THR  55          2HG2      THR  55   4.994 -14.387  -0.870
  401    H    ILE  56           H        ILE  56   6.612 -10.603  -1.292
  402    HA   ILE  56           HA       ILE  56   8.266 -10.035  -3.613
  403    HB   ILE  56           HB       ILE  56   9.124 -10.061  -0.680
  404   HG12  ILE  56          1HG1      ILE  56   7.122  -8.637  -0.854
  405   HG13  ILE  56          2HG1      ILE  56   8.548  -7.635  -0.647
  406   HG21  ILE  56          1HG2      ILE  56  10.759  -8.346  -1.521
  407   HG22  ILE  56          2HG2      ILE  56  10.188  -8.618  -3.151
  408   HG23  ILE  56          3HG2      ILE  56  10.986  -9.919  -2.268
  409   HD11  ILE  56          3HD1      ILE  56   8.516  -7.394  -3.246
  410   HD12  ILE  56          1HD1      ILE  56   7.307  -6.529  -2.302
  411   HD13  ILE  56          2HD1      ILE  56   6.879  -8.030  -3.124
  412    H    SER  57           H        SER  57  10.168 -11.141  -4.194
  413    HA   SER  57           HA       SER  57  10.131 -13.979  -3.934
  414    HB2  SER  57           1HB      SER  57  11.141 -12.837  -5.868
  415    HB3  SER  57           2HB      SER  57  12.379 -12.143  -4.826
  416    HG   SER  57           HG       SER  57  12.362 -14.511  -6.005
  417    H    ARG  58           H        ARG  58  12.181 -11.474  -2.466
  418    HA   ARG  58           HA       ARG  58  12.548 -12.980  -0.044
  419    HB2  ARG  58           1HB      ARG  58  15.014 -13.309  -0.280
  420    HB3  ARG  58           2HB      ARG  58  14.092 -14.265  -1.439
  421    HG2  ARG  58           1HG      ARG  58  14.502 -12.529  -3.184
  422    HG3  ARG  58           2HG      ARG  58  15.469 -11.614  -2.032
  423    HD2  ARG  58           1HD      ARG  58  17.044 -13.506  -1.832
  424    HD3  ARG  58           2HD      ARG  58  16.075 -14.433  -2.982
  425    HE   ARG  58           HE       ARG  58  16.744 -11.952  -4.157
  426   HH11  ARG  58          1HH2      ARG  58  18.245 -14.923  -3.136
  427   HH12  ARG  58          2HH2      ARG  58  19.518 -14.827  -4.306
  428   HH21  ARG  58          1HH1      ARG  58  18.405 -11.845  -5.675
  429   HH22  ARG  58          2HH1      ARG  58  19.608 -13.089  -5.740
  430    H    ILE  59           H        ILE  59  13.102 -11.653   1.594
  431    HA   ILE  59           HA       ILE  59  13.927  -8.871   0.933
  432    HB   ILE  59           HB       ILE  59  12.199  -9.728   3.279
  433   HG12  ILE  59          1HG1      ILE  59  11.407  -8.221   0.742
  434   HG13  ILE  59          2HG1      ILE  59  11.098  -9.937   0.964
  435   HG21  ILE  59          1HG2      ILE  59  11.833  -7.172   3.409
  436   HG22  ILE  59          2HG2      ILE  59  13.128  -6.987   2.249
  437   HG23  ILE  59          3HG2      ILE  59  13.458  -7.693   3.828
  438   HD11  ILE  59          3HD1      ILE  59   9.746  -9.404   2.966
  439   HD12  ILE  59          1HD1      ILE  59   9.098  -8.662   1.516
  440   HD13  ILE  59          2HD1      ILE  59   9.999  -7.688   2.673
  441    HA   PRO  60           HA       PRO  60  17.365 -10.218   3.618
  442    HB2  PRO  60           1HB      PRO  60  19.100  -8.158   3.258
  443    HB3  PRO  60           2HB      PRO  60  18.757  -9.302   1.937
  444    HG2  PRO  60           1HG      PRO  60  17.540  -6.581   2.414
  445    HG3  PRO  60           2HG      PRO  60  18.250  -7.228   0.916
  446    HD2  PRO  60           1HD      PRO  60  15.543  -7.265   1.360
  447    HD3  PRO  60           2HD      PRO  60  16.341  -8.565   0.435
  448    H    VAL  61           H        VAL  61  18.393  -9.464   5.614
  449    HA   VAL  61           HA       VAL  61  16.522  -8.249   7.402
  450    HB   VAL  61           HB       VAL  61  18.129 -10.000   8.081
  451   HG11  VAL  61          1HG1      VAL  61  20.508  -9.523   8.386
  452   HG12  VAL  61          2HG1      VAL  61  20.296  -7.866   7.833
  453   HG13  VAL  61          3HG1      VAL  61  20.074  -9.207   6.707
  454   HG21  VAL  61          3HG2      VAL  61  17.177  -8.456   9.797
  455   HG22  VAL  61          1HG2      VAL  61  18.572  -7.390   9.604
  456   HG23  VAL  61          2HG2      VAL  61  18.786  -9.016  10.244
  457    H    GLY  62           H        GLY  62  16.410  -6.194   8.203
  458    HA2  GLY  62           1HA      GLY  62  16.842  -3.962   8.510
  459    HA3  GLY  62           2HA      GLY  62  18.502  -4.240   7.988
  460    H    GLY  63           H        GLY  63  16.074  -5.394   5.877
  461    HA2  GLY  63           1HA      GLY  63  16.488  -3.131   3.971
  462    HA3  GLY  63           2HA      GLY  63  16.212  -4.813   3.538
  463    H    THR  64           H        THR  64  14.546  -3.631   2.220
  464    HA   THR  64           HA       THR  64  11.945  -3.697   3.636
  465    HB   THR  64           HB       THR  64  11.210  -1.625   2.605
  466    HG1  THR  64           HG1      THR  64  13.771  -1.648   1.380
  467   HG21  THR  64          3HG2      THR  64  12.595  -1.438   4.726
  468   HG22  THR  64          1HG2      THR  64  12.659  -0.001   3.707
  469   HG23  THR  64          2HG2      THR  64  14.004  -1.134   3.707
  470    H    GLY  65           H        GLY  65  10.283  -3.086   1.658
  471    HA2  GLY  65           1HA      GLY  65  10.910  -4.798  -0.689
  472    HA3  GLY  65           2HA      GLY  65   9.495  -5.147   0.306
  473    H    LEU  66           H        LEU  66   9.783  -4.271  -2.516
  474    HA   LEU  66           HA       LEU  66   8.007  -1.877  -2.381
  475    HB2  LEU  66           1HB      LEU  66  10.520  -1.733  -3.402
  476    HB3  LEU  66           2HB      LEU  66   9.711  -2.317  -4.842
  477    HG   LEU  66           HG       LEU  66   9.770   0.118  -4.916
  478   HD11  LEU  66          1HD1      LEU  66   7.437   0.650  -5.227
  479   HD12  LEU  66          2HD1      LEU  66   6.926  -0.656  -4.165
  480   HD13  LEU  66          3HD1      LEU  66   7.675  -1.025  -5.719
  481   HD21  LEU  66          3HD2      LEU  66   8.076   0.542  -2.438
  482   HD22  LEU  66          1HD2      LEU  66   9.263   1.594  -3.200
  483   HD23  LEU  66          2HD2      LEU  66   9.797   0.251  -2.205
  484    H    ALA  67           H        ALA  67   6.035  -2.425  -2.884
  485    HA   ALA  67           HA       ALA  67   5.512  -4.586  -4.879
  486    HB1  ALA  67           3HB      ALA  67   3.291  -4.723  -3.802
  487    HB2  ALA  67           1HB      ALA  67   3.735  -3.413  -2.703
  488    HB3  ALA  67           2HB      ALA  67   4.578  -4.957  -2.616
  489    H    ARG  68           H        ARG  68   3.914  -4.236  -6.441
  490    HA   ARG  68           HA       ARG  68   3.205  -1.366  -6.991
  491    HB2  ARG  68           1HB      ARG  68   5.032  -2.221  -8.489
  492    HB3  ARG  68           2HB      ARG  68   3.936  -3.470  -9.074
  493    HG2  ARG  68           1HG      ARG  68   2.359  -1.696  -9.865
  494    HG3  ARG  68           2HG      ARG  68   3.477  -0.462  -9.290
  495    HD2  ARG  68           1HD      ARG  68   4.105  -2.541 -11.419
  496    HD3  ARG  68           2HD      ARG  68   3.709  -0.855 -11.737
  497    HE   ARG  68           HE       ARG  68   6.249  -1.888 -10.866
  498   HH11  ARG  68          1HH2      ARG  68   4.143   0.878 -10.699
  499   HH12  ARG  68          2HH2      ARG  68   5.429   1.993 -10.377
  500   HH21  ARG  68          1HH1      ARG  68   7.909  -0.419 -10.448
  501   HH22  ARG  68          2HH1      ARG  68   7.551   1.262 -10.235
  502    H    VAL  69           H        VAL  69   1.108  -1.068  -6.978
  503    HA   VAL  69           HA       VAL  69  -0.711  -3.174  -8.030
  504    HB   VAL  69           HB       VAL  69  -1.208  -1.609  -5.454
  505   HG11  VAL  69          1HG1      VAL  69  -3.315  -2.106  -6.598
  506   HG12  VAL  69          2HG1      VAL  69  -3.157  -3.256  -5.282
  507   HG13  VAL  69          3HG1      VAL  69  -2.808  -3.760  -6.924
  508   HG21  VAL  69          3HG2      VAL  69  -0.486  -4.542  -5.871
  509   HG22  VAL  69          1HG2      VAL  69  -0.964  -3.821  -4.333
  510   HG23  VAL  69          2HG2      VAL  69   0.535  -3.321  -5.109
  511    H    GLN  70           H        GLN  70  -2.141  -2.410  -9.408
  512    HA   GLN  70           HA       GLN  70  -2.493   0.552  -9.702
  513    HB2  GLN  70           1HB      GLN  70  -2.788  -1.701 -11.728
  514    HB3  GLN  70           2HB      GLN  70  -3.098   0.007 -12.053
  515    HG2  GLN  70           1HG      GLN  70  -0.735   0.539 -11.467
  516    HG3  GLN  70           2HG      GLN  70  -0.427  -1.172 -11.175
  517   HE21  GLN  70          2HE2      GLN  70   0.673   0.756 -13.291
  518   HE22  GLN  70          1HE2      GLN  70   0.390  -0.037 -14.765
  519    H    TRP  71           H        TRP  71  -4.486   1.404  -9.644
  520    HA   TRP  71           HA       TRP  71  -6.872  -0.365  -9.594
  521    HB2  TRP  71           1HB      TRP  71  -6.247   0.050  -7.230
  522    HB3  TRP  71           2HB      TRP  71  -6.255   1.782  -7.520
  523    HD1  TRP  71           HD1      TRP  71  -8.761  -1.122  -8.164
  524    HE1  TRP  71           HE1      TRP  71 -11.126  -0.286  -7.566
  525    HE3  TRP  71           HE3      TRP  71  -7.667   3.637  -6.687
  526    HZ2  TRP  71           HZ2      TRP  71 -12.384   2.084  -6.590
  527    HZ3  TRP  71           HZ3      TRP  71  -9.464   5.168  -5.932
  528    HH2  TRP  71           HH2      TRP  71 -11.822   4.397  -5.879
  529    H    LYS  72           H        LYS  72  -8.508   0.416 -10.707
  530    HA   LYS  72           HA       LYS  72  -8.227   2.999 -12.088
  531    HB2  LYS  72           1HB      LYS  72  -8.899   0.901 -13.265
  532    HB3  LYS  72           2HB      LYS  72 -10.396   0.868 -12.346
  533    HG2  LYS  72           1HG      LYS  72 -10.995   3.108 -13.268
  534    HG3  LYS  72           2HG      LYS  72  -9.511   3.115 -14.210
  535    HD2  LYS  72           1HD      LYS  72 -11.735   1.041 -14.482
  536    HD3  LYS  72           2HD      LYS  72 -11.527   2.429 -15.542
  537    HE2  LYS  72           1HE      LYS  72  -9.149   1.509 -16.041
  538    HE3  LYS  72           2HE      LYS  72  -9.707   0.005 -15.301
  539    HZ1  LYS  72           3HZ      LYS  72 -11.503  -0.093 -16.859
  540    HZ2  LYS  72           1HZ      LYS  72 -10.036   0.056 -17.698
  541    HZ3  LYS  72           2HZ      LYS  72 -11.061   1.401 -17.535
  542    H    ALA  73           H        ALA  73  -9.088   4.798 -11.245
  543    HA   ALA  73           HA       ALA  73 -10.821   4.784  -8.948
  544    HB1  ALA  73           3HB      ALA  73  -9.252   6.631  -9.373
  545    HB2  ALA  73           1HB      ALA  73 -10.906   7.245  -9.309
  546    HB3  ALA  73           2HB      ALA  73 -10.097   7.033 -10.862
  547    H    THR  74           H        THR  74 -12.967   4.455  -8.946
  548    HA   THR  74           HA       THR  74 -14.765   5.622 -10.858
  549    HB   THR  74           HB       THR  74 -13.920   3.770 -12.260
  550    HG1  THR  74           HG1      THR  74 -15.906   3.850 -12.868
  551   HG21  THR  74          3HG2      THR  74 -14.215   1.431 -11.631
  552   HG22  THR  74          1HG2      THR  74 -15.000   1.889 -10.123
  553   HG23  THR  74          2HG2      THR  74 -13.287   2.226 -10.360
  554    H    ARG  75           H        ARG  75 -16.948   4.013 -10.580
  555    HA   ARG  75           HA       ARG  75 -18.709   3.625  -9.197
  556    HB2  ARG  75           1HB      ARG  75 -17.053   1.785  -8.490
  557    HB3  ARG  75           2HB      ARG  75 -16.654   2.790  -7.101
  558    HG2  ARG  75           1HG      ARG  75 -19.108   2.760  -6.456
  559    HG3  ARG  75           2HG      ARG  75 -19.407   1.659  -7.795
  560    HD2  ARG  75           1HD      ARG  75 -17.525   1.123  -5.463
  561    HD3  ARG  75           2HD      ARG  75 -19.136   0.430  -5.655
  562    HE   ARG  75           HE       ARG  75 -17.676  -0.161  -7.979
  563   HH11  ARG  75          1HH2      ARG  75 -17.647  -0.892  -4.578
  564   HH12  ARG  75          2HH2      ARG  75 -16.907  -2.445  -4.786
  565   HH21  ARG  75          1HH1      ARG  75 -16.705  -2.188  -8.236
  566   HH22  ARG  75          2HH1      ARG  75 -16.375  -3.174  -6.851
  567    H    LYS  76           H        LYS  76 -18.140   6.231  -9.331
  568    HA   LYS  76           HA       LYS  76 -19.158   7.273  -6.864
  569    HB2  LYS  76           1HB      LYS  76 -16.700   6.977  -6.297
  570    HB3  LYS  76           2HB      LYS  76 -16.306   8.116  -7.576
  571    HG2  LYS  76           1HG      LYS  76 -17.648   9.860  -6.436
  572    HG3  LYS  76           2HG      LYS  76 -18.087   8.717  -5.174
  573    HD2  LYS  76           1HD      LYS  76 -15.689   8.485  -4.556
  574    HD3  LYS  76           2HD      LYS  76 -15.257   9.648  -5.809
  575    HE2  LYS  76           1HE      LYS  76 -16.622  11.381  -4.678
  576    HE3  LYS  76           2HE      LYS  76 -17.066  10.216  -3.428
  577    HZ1  LYS  76           3HZ      LYS  76 -15.172  10.592  -2.378
  578    HZ2  LYS  76           1HZ      LYS  76 -14.839  11.842  -3.474
  579    HZ3  LYS  76           2HZ      LYS  76 -14.258  10.275  -3.774
  580    H    LEU  77           H        LEU  77 -20.729   8.047  -8.299
  581    HA   LEU  77           HA       LEU  77 -20.170   9.684 -10.572
  582    HB2  LEU  77           1HB      LEU  77 -22.707   9.542  -8.891
  583    HB3  LEU  77           2HB      LEU  77 -22.571  10.242 -10.498
  584    HG   LEU  77           HG       LEU  77 -21.516   7.631 -10.897
  585   HD11  LEU  77          1HD1      LEU  77 -23.083   6.053  -9.883
  586   HD12  LEU  77          2HD1      LEU  77 -23.928   7.369  -9.062
  587   HD13  LEU  77          3HD1      LEU  77 -22.271   6.974  -8.617
  588   HD21  LEU  77          3HD2      LEU  77 -23.640   7.138 -12.078
  589   HD22  LEU  77          1HD2      LEU  77 -23.086   8.776 -12.427
  590   HD23  LEU  77          2HD2      LEU  77 -24.404   8.519 -11.285
  591    H    ALA  78           H        ALA  78 -20.612  10.314  -7.160
  592    HA   ALA  78           HA       ALA  78 -20.460  12.214  -5.883
  593    HB1  ALA  78           3HB      ALA  78 -18.145  12.212  -6.771
  594    HB2  ALA  78           1HB      ALA  78 -18.732  13.855  -6.548
  595    HB3  ALA  78           2HB      ALA  78 -18.670  13.148  -8.161
  596    H    GLY  79           H        GLY  79 -22.789  12.511  -6.441
  597    HA2  GLY  79           1HA      GLY  79 -23.692  14.260  -8.474
  598    HA3  GLY  79           2HA      GLY  79 -24.571  13.836  -7.009
  599    H    ARG  80           H        ARG  80 -22.206  16.041  -8.386
  600    HA   ARG  80           HA       ARG  80 -21.467  18.127  -7.752
  601    HB2  ARG  80           1HB      ARG  80 -24.273  18.246  -6.589
  602    HB3  ARG  80           2HB      ARG  80 -23.240  19.644  -6.900
  603    HG2  ARG  80           1HG      ARG  80 -23.205  19.103  -9.316
  604    HG3  ARG  80           2HG      ARG  80 -24.205  17.677  -9.023
  605    HD2  ARG  80           1HD      ARG  80 -25.603  19.546  -9.810
  606    HD3  ARG  80           2HD      ARG  80 -26.017  19.139  -8.142
  607    HE   ARG  80           HE       ARG  80 -24.006  21.153  -8.189
  608   HH11  ARG  80          1HH2      ARG  80 -27.390  20.659  -8.815
  609   HH12  ARG  80          2HH2      ARG  80 -27.823  22.300  -8.467
  610   HH21  ARG  80          1HH1      ARG  80 -24.583  23.285  -7.734
  611   HH22  ARG  80          2HH1      ARG  80 -26.237  23.784  -7.857
  612    H    ALA  81           H        ALA  81 -19.854  17.438  -6.301
  613    HA   ALA  81           HA       ALA  81 -20.155  18.362  -3.591
  614    HB1  ALA  81           3HB      ALA  81 -21.274  16.161  -3.376
  615    HB2  ALA  81           1HB      ALA  81 -19.756  16.186  -2.476
  616    HB3  ALA  81           2HB      ALA  81 -19.848  15.363  -4.036
  617    H    ALA  82           H        ALA  82 -18.298  19.534  -3.789
  618    HA   ALA  82           HA       ALA  82 -15.929  18.689  -5.098
  619    HB1  ALA  82           3HB      ALA  82 -16.450  21.063  -4.629
  620    HB2  ALA  82           1HB      ALA  82 -14.882  20.617  -3.956
  621    HB3  ALA  82           2HB      ALA  82 -16.290  20.765  -2.900
  622    H    ASN  83           H        ASN  83 -13.849  19.051  -3.410
  623    HA   ASN  83           HA       ASN  83 -12.444  17.646  -2.181
  624    HB2  ASN  83           1HB      ASN  83 -13.107  17.589   0.233
  625    HB3  ASN  83           2HB      ASN  83 -13.259  19.193  -0.478
  626   HD21  ASN  83          2HD2      ASN  83 -15.061  16.532   0.948
  627   HD22  ASN  83          1HD2      ASN  83 -16.574  17.302   0.914
  628    HA   PRO  84           HA       PRO  84 -15.024  13.810  -3.228
  629    HB2  PRO  84           1HB      PRO  84 -12.166  13.065  -3.981
  630    HB3  PRO  84           2HB      PRO  84 -13.683  12.602  -4.799
  631    HG2  PRO  84           1HG      PRO  84 -12.250  14.532  -5.855
  632    HG3  PRO  84           2HG      PRO  84 -14.000  14.804  -5.650
  633    HD2  PRO  84           1HD      PRO  84 -11.737  15.835  -3.891
  634    HD3  PRO  84           2HD      PRO  84 -13.164  16.714  -4.498
  635    H    GLY  85           H        GLY  85 -11.807  13.945  -1.727
  636    HA2  GLY  85           1HA      GLY  85 -10.968  12.972   0.195
  637    HA3  GLY  85           2HA      GLY  85 -12.634  12.776   0.733
  638    H    VAL  86           H        VAL  86 -10.079  11.366  -1.238
  639    HA   VAL  86           HA       VAL  86 -11.343   8.661  -1.022
  640    HB   VAL  86           HB       VAL  86  -9.436   9.678  -3.158
  641   HG11  VAL  86          1HG1      VAL  86 -10.083   7.546  -4.311
  642   HG12  VAL  86          2HG1      VAL  86 -11.012   7.075  -2.889
  643   HG13  VAL  86          3HG1      VAL  86  -9.261   7.231  -2.787
  644   HG21  VAL  86          3HG2      VAL  86 -12.447   9.175  -3.245
  645   HG22  VAL  86          1HG2      VAL  86 -11.445   9.600  -4.633
  646   HG23  VAL  86          2HG2      VAL  86 -11.665  10.753  -3.322
  647    HA   PRO  87           HA       PRO  87  -7.292   8.569   1.294
  648    HB2  PRO  87           1HB      PRO  87  -8.103   7.321   3.576
  649    HB3  PRO  87           2HB      PRO  87  -8.438   9.050   3.309
  650    HG2  PRO  87           1HG      PRO  87 -10.272   6.698   2.858
  651    HG3  PRO  87           2HG      PRO  87 -10.610   8.217   3.717
  652    HD2  PRO  87           1HD      PRO  87 -11.355   7.808   1.107
  653    HD3  PRO  87           2HD      PRO  87 -10.913   9.424   1.701
  654    H    VAL  88           H        VAL  88  -5.952   6.743   1.824
  655    HA   VAL  88           HA       VAL  88  -6.826   4.129   0.657
  656    HB   VAL  88           HB       VAL  88  -4.476   3.874  -0.135
  657   HG11  VAL  88          1HG1      VAL  88  -5.857   6.401  -1.140
  658   HG12  VAL  88          2HG1      VAL  88  -6.211   4.758  -1.673
  659   HG13  VAL  88          3HG1      VAL  88  -4.641   5.475  -2.022
  660   HG21  VAL  88          3HG2      VAL  88  -2.998   5.881  -0.174
  661   HG22  VAL  88          1HG2      VAL  88  -3.362   5.402   1.479
  662   HG23  VAL  88          2HG2      VAL  88  -4.190   6.781   0.760
  663    H    TYR  89           H        TYR  89  -5.756   2.284   1.485
  664    HA   TYR  89           HA       TYR  89  -4.385   2.541   4.094
  665    HB2  TYR  89           1HB      TYR  89  -6.965   0.978   3.648
  666    HB3  TYR  89           2HB      TYR  89  -5.944   0.820   5.079
  667    HD1  TYR  89           HD1      TYR  89  -5.698   2.709   6.695
  668    HD2  TYR  89           HD2      TYR  89  -8.340   3.025   3.301
  669    HE1  TYR  89           HE1      TYR  89  -6.770   4.699   7.707
  670    HE2  TYR  89           HE2      TYR  89  -9.404   5.006   4.339
  671    HH   TYR  89           HH       TYR  89  -9.193   5.818   7.450
  672    H    ALA  90           H        ALA  90  -3.160   0.792   4.644
  673    HA   ALA  90           HA       ALA  90  -3.022  -1.546   2.849
  674    HB1  ALA  90           3HB      ALA  90  -0.645  -1.213   2.389
  675    HB2  ALA  90           1HB      ALA  90  -0.616   0.257   3.369
  676    HB3  ALA  90           2HB      ALA  90  -1.529   0.222   1.866
  677    H    VAL  91           H        VAL  91  -2.452  -3.341   3.932
  678    HA   VAL  91           HA       VAL  91  -1.146  -3.138   6.595
  679    HB   VAL  91           HB       VAL  91  -3.634  -4.824   6.038
  680   HG11  VAL  91          1HG1      VAL  91  -3.565  -5.201   8.512
  681   HG12  VAL  91          2HG1      VAL  91  -2.055  -4.297   8.597
  682   HG13  VAL  91          3HG1      VAL  91  -2.118  -5.829   7.727
  683   HG21  VAL  91          3HG2      VAL  91  -4.251  -2.443   6.145
  684   HG22  VAL  91          1HG2      VAL  91  -3.302  -2.232   7.619
  685   HG23  VAL  91          2HG2      VAL  91  -4.753  -3.236   7.635
  686    H    VAL  92           H        VAL  92   0.143  -4.817   7.112
  687    HA   VAL  92           HA       VAL  92   0.896  -6.654   4.921
  688    HB   VAL  92           HB       VAL  92   2.924  -7.028   6.309
  689   HG11  VAL  92          1HG1      VAL  92   2.230  -4.091   5.855
  690   HG12  VAL  92          2HG1      VAL  92   2.902  -5.192   4.651
  691   HG13  VAL  92          3HG1      VAL  92   3.861  -4.733   6.055
  692   HG21  VAL  92          3HG2      VAL  92   1.967  -6.692   8.570
  693   HG22  VAL  92          1HG2      VAL  92   1.639  -5.003   8.197
  694   HG23  VAL  92          2HG2      VAL  92   3.298  -5.578   8.319
  695    H    ASP  93           H        ASP  93   0.731  -8.824   5.074
  696    HA   ASP  93           HA       ASP  93  -0.556 -10.009   7.512
  697    HB2  ASP  93           1HB      ASP  93  -2.047  -9.874   5.529
  698    HB3  ASP  93           2HB      ASP  93  -0.905 -10.851   4.624
  699    HA   PRO  94           HA       PRO  94   3.442 -12.251   6.696
  700    HB2  PRO  94           1HB      PRO  94   4.607 -12.091   9.133
  701    HB3  PRO  94           2HB      PRO  94   4.572 -10.673   8.058
  702    HG2  PRO  94           1HG      PRO  94   2.755 -11.312  10.381
  703    HG3  PRO  94           2HG      PRO  94   3.569  -9.779   9.996
  704    HD2  PRO  94           1HD      PRO  94   0.925 -10.298   9.314
  705    HD3  PRO  94           2HD      PRO  94   1.946  -9.178   8.381
  706    H    ASP  95           H        ASP  95   4.179 -14.325   7.523
  707    HA   ASP  95           HA       ASP  95   1.966 -16.047   8.281
  708    HB2  ASP  95           1HB      ASP  95   3.698 -16.665   6.582
  709    HB3  ASP  95           2HB      ASP  95   4.904 -16.733   7.862
  710    H    ASN  96           H        ASN  96   3.205 -14.003  10.184
  711    HA   ASN  96           HA       ASN  96   3.334 -15.789  12.537
  712    HB2  ASN  96           1HB      ASN  96   5.693 -15.363  11.754
  713    HB3  ASN  96           2HB      ASN  96   5.428 -13.640  11.993
  714   HD21  ASN  96          2HD2      ASN  96   5.460 -16.769  13.751
  715   HD22  ASN  96          1HD2      ASN  96   5.829 -16.092  15.263
  716    H    ARG  97           H        ARG  97   1.224 -14.183  11.650
  717    HA   ARG  97           HA       ARG  97   1.062 -11.627  12.766
  718    HB2  ARG  97           1HB      ARG  97  -1.479 -12.195  12.892
  719    HB3  ARG  97           2HB      ARG  97  -0.711 -12.246  11.309
  720    HG2  ARG  97           1HG      ARG  97  -0.518 -14.689  11.404
  721    HG3  ARG  97           2HG      ARG  97  -1.144 -14.716  13.045
  722    HD2  ARG  97           1HD      ARG  97  -2.675 -13.694  10.636
  723    HD3  ARG  97           2HD      ARG  97  -2.884 -15.290  11.359
  724    HE   ARG  97           HE       ARG  97  -3.189 -13.353  13.384
  725   HH11  ARG  97          1HH2      ARG  97  -4.786 -14.490  10.509
  726   HH12  ARG  97          2HH2      ARG  97  -6.366 -14.033  11.053
  727   HH21  ARG  97          1HH1      ARG  97  -5.255 -12.764  14.081
  728   HH22  ARG  97          2HH1      ARG  97  -6.631 -13.059  13.070
  729    H    VAL  98           H        VAL  98   1.943 -11.408  14.809
  730    HA   VAL  98           HA       VAL  98   1.595 -13.182  16.987
  731    HB   VAL  98           HB       VAL  98   2.147 -10.185  17.031
  732   HG11  VAL  98          1HG1      VAL  98   3.250 -10.696  19.235
  733   HG12  VAL  98          2HG1      VAL  98   2.633 -12.344  19.130
  734   HG13  VAL  98          3HG1      VAL  98   1.513 -10.988  19.275
  735   HG21  VAL  98          3HG2      VAL  98   4.056 -12.561  16.962
  736   HG22  VAL  98          1HG2      VAL  98   4.537 -10.871  17.122
  737   HG23  VAL  98          2HG2      VAL  98   3.774 -11.430  15.636
  738    H    ALA  99           H        ALA  99  -0.029 -10.051  16.344
  739    HA   ALA  99           HA       ALA  99  -2.605 -10.986  17.186
  740    HB1  ALA  99           3HB      ALA  99  -1.112  -9.157  19.108
  741    HB2  ALA  99           1HB      ALA  99  -1.550 -10.833  19.423
  742    HB3  ALA  99           2HB      ALA  99  -2.812  -9.618  19.243
  743    H    GLU 100           H        GLU 100  -3.964  -8.848  17.759
  744    HA   GLU 100           HA       GLU 100  -4.020  -7.325  15.333
  745    HB2  GLU 100           1HB      GLU 100  -5.435  -6.864  17.988
  746    HB3  GLU 100           2HB      GLU 100  -5.823  -6.035  16.480
  747    HG2  GLU 100           1HG      GLU 100  -6.368  -8.211  15.420
  748    HG3  GLU 100           2HG      GLU 100  -5.981  -9.044  16.922
  749    H    SER 101           H        SER 101  -3.576  -6.179  18.691
  750    HA   SER 101           HA       SER 101  -2.732  -3.600  18.182
  751    HB2  SER 101           1HB      SER 101  -3.137  -4.462  20.454
  752    HB3  SER 101           2HB      SER 101  -1.690  -5.459  20.346
  753    HG   SER 101           HG       SER 101  -1.715  -3.135  21.302
  754    H    ASP 102           H        ASP 102  -0.683  -6.516  18.288
  755    HA   ASP 102           HA       ASP 102   1.804  -5.251  17.802
  756    HB2  ASP 102           1HB      ASP 102   0.885  -8.050  17.044
  757    HB3  ASP 102           2HB      ASP 102   2.565  -7.511  17.126
  758    H    LYS 103           H        LYS 103   0.032  -7.268  15.441
  759    HA   LYS 103           HA       LYS 103   1.326  -6.515  13.127
  760    HB2  LYS 103           1HB      LYS 103  -0.452  -8.261  13.275
  761    HB3  LYS 103           2HB      LYS 103  -1.667  -6.991  13.370
  762    HG2  LYS 103           1HG      LYS 103  -1.040  -6.185  11.115
  763    HG3  LYS 103           2HG      LYS 103   0.266  -7.363  11.043
  764    HD2  LYS 103           1HD      LYS 103  -1.635  -8.198   9.753
  765    HD3  LYS 103           2HD      LYS 103  -1.420  -9.212  11.172
  766    HE2  LYS 103           1HE      LYS 103  -3.368  -8.282  12.242
  767    HE3  LYS 103           2HE      LYS 103  -3.394  -6.882  11.165
  768    HZ1  LYS 103           3HZ      LYS 103  -4.303  -8.074   9.483
  769    HZ2  LYS 103           1HZ      LYS 103  -4.966  -8.921  10.795
  770    HZ3  LYS 103           2HZ      LYS 103  -3.615  -9.546   9.976
  771    H    ALA 104           H        ALA 104  -1.317  -4.771  14.725
  772    HA   ALA 104           HA       ALA 104  -1.768  -2.743  12.812
  773    HB1  ALA 104           3HB      ALA 104  -1.963  -2.523  15.836
  774    HB2  ALA 104           1HB      ALA 104  -3.228  -3.140  14.777
  775    HB3  ALA 104           2HB      ALA 104  -2.735  -1.448  14.670
  776    H    ASN 105           H        ASN 105   1.133  -3.418  14.136
  777    HA   ASN 105           HA       ASN 105   2.094  -0.625  14.492
  778    HB2  ASN 105           1HB      ASN 105   3.588  -3.256  14.848
  779    HB3  ASN 105           2HB      ASN 105   4.203  -1.655  15.228
  780   HD21  ASN 105          2HD2      ASN 105   3.992  -3.666  17.242
  781   HD22  ASN 105          1HD2      ASN 105   2.806  -3.184  18.356
  782    H    ASN 106           H        ASN 106   1.192  -1.605  11.880
  783    HA   ASN 106           HA       ASN 106   3.472  -0.745  10.285
  784    HB2  ASN 106           1HB      ASN 106   2.402  -3.587  10.058
  785    HB3  ASN 106           2HB      ASN 106   3.442  -2.834   8.851
  786   HD21  ASN 106          2HD2      ASN 106   3.503  -4.768  11.641
  787   HD22  ASN 106          1HD2      ASN 106   5.139  -4.554  12.041
  788    H    VAL 107           H        VAL 107   0.925   0.364  10.725
  789    HA   VAL 107           HA       VAL 107  -0.498  -0.071   8.123
  790    HB   VAL 107           HB       VAL 107  -1.871  -0.541  10.119
  791   HG11  VAL 107          1HG1      VAL 107  -0.718   0.982  11.717
  792   HG12  VAL 107          2HG1      VAL 107  -2.464   1.229  11.717
  793   HG13  VAL 107          3HG1      VAL 107  -1.415   2.374  10.886
  794   HG21  VAL 107          3HG2      VAL 107  -2.733   2.062   8.765
  795   HG22  VAL 107          1HG2      VAL 107  -3.789   0.886   9.545
  796   HG23  VAL 107          2HG2      VAL 107  -2.929   0.456   8.068
  797    H    PHE 108           H        PHE 108  -0.991   1.674   6.861
  798    HA   PHE 108           HA       PHE 108  -0.134   4.384   7.656
  799    HB2  PHE 108           1HB      PHE 108   0.933   2.991   5.159
  800    HB3  PHE 108           2HB      PHE 108   1.268   4.650   5.655
  801    HD1  PHE 108           HD2      PHE 108   2.223   4.960   8.118
  802    HD2  PHE 108           HD1      PHE 108   2.504   1.280   5.870
  803    HE1  PHE 108           HE2      PHE 108   4.090   4.205   9.562
  804    HE2  PHE 108           HE1      PHE 108   4.366   0.545   7.329
  805    HZ   PHE 108           HZ       PHE 108   5.161   2.003   9.171
  806    H    SER 109           H        SER 109  -0.990   6.017   6.345
  807    HA   SER 109           HA       SER 109  -2.784   5.405   4.133
  808    HB2  SER 109           1HB      SER 109  -4.266   4.850   6.004
  809    HB3  SER 109           2HB      SER 109  -3.879   6.372   6.800
  810    HG   SER 109           HG       SER 109  -4.849   7.465   5.088
  811    H    ARG 110           H        ARG 110  -3.284   7.212   2.939
  812    HA   ARG 110           HA       ARG 110  -2.322   9.868   3.902
  813    HB2  ARG 110           1HB      ARG 110  -0.561   8.775   2.496
  814    HB3  ARG 110           2HB      ARG 110  -1.710   8.677   1.162
  815    HG2  ARG 110           1HG      ARG 110  -1.931  11.170   1.186
  816    HG3  ARG 110           2HG      ARG 110  -0.783  11.250   2.516
  817    HD2  ARG 110           1HD      ARG 110   0.948  10.220   1.066
  818    HD3  ARG 110           2HD      ARG 110  -0.211  10.169  -0.263
  819    HE   ARG 110           HE       ARG 110  -0.081  12.815   0.709
  820   HH11  ARG 110          1HH2      ARG 110   1.895  10.490  -0.965
  821   HH12  ARG 110          2HH2      ARG 110   2.812  11.691  -1.810
  822   HH21  ARG 110          1HH1      ARG 110   1.124  14.368  -0.395
  823   HH22  ARG 110          2HH1      ARG 110   2.377  13.882  -1.489
  824    H    ILE 111           H        ILE 111  -3.723  11.434   3.539
  825    HA   ILE 111           HA       ILE 111  -6.225  10.891   2.149
  826    HB   ILE 111           HB       ILE 111  -5.156  13.319   3.660
  827   HG12  ILE 111          1HG1      ILE 111  -6.951  12.722   5.292
  828   HG13  ILE 111          2HG1      ILE 111  -7.407  11.354   4.289
  829   HG21  ILE 111          1HG2      ILE 111  -6.655  14.259   1.972
  830   HG22  ILE 111          2HG2      ILE 111  -7.571  14.194   3.471
  831   HG23  ILE 111          3HG2      ILE 111  -7.834  12.971   2.227
  832   HD11  ILE 111          3HD1      ILE 111  -5.853  10.982   6.356
  833   HD12  ILE 111          1HD1      ILE 111  -4.564  11.568   5.306
  834   HD13  ILE 111          2HD1      ILE 111  -5.501  10.136   4.856
  835    H    VAL 112           H        VAL 112  -6.643  11.374   0.102
  836    HA   VAL 112           HA       VAL 112  -4.976  13.376  -1.364
  837    HB   VAL 112           HB       VAL 112  -5.864  10.672  -2.472
  838   HG11  VAL 112          1HG1      VAL 112  -4.026  12.831  -3.601
  839   HG12  VAL 112          2HG1      VAL 112  -5.650  12.470  -4.181
  840   HG13  VAL 112          3HG1      VAL 112  -4.369  11.278  -4.366
  841   HG21  VAL 112          3HG2      VAL 112  -3.453  10.072  -2.368
  842   HG22  VAL 112          1HG2      VAL 112  -4.095  10.381  -0.758
  843   HG23  VAL 112          2HG2      VAL 112  -3.107  11.602  -1.559
  844    H    LYS 113           H        LYS 113  -6.065  14.688  -2.690
  845    HA   LYS 113           HA       LYS 113  -8.986  14.225  -3.180
  846    HB2  LYS 113           1HB      LYS 113  -7.628  16.819  -2.340
  847    HB3  LYS 113           2HB      LYS 113  -9.326  16.655  -2.801
  848    HG2  LYS 113           1HG      LYS 113  -9.674  15.046  -0.930
  849    HG3  LYS 113           2HG      LYS 113  -7.983  15.242  -0.457
  850    HD2  LYS 113           1HD      LYS 113  -8.380  17.663  -0.048
  851    HD3  LYS 113           2HD      LYS 113 -10.068  17.463  -0.519
  852    HE2  LYS 113           1HE      LYS 113 -10.403  15.864   1.352
  853    HE3  LYS 113           2HE      LYS 113  -8.716  16.077   1.830
  854    HZ1  LYS 113           3HZ      LYS 113 -10.912  18.054   1.904
  855    HZ2  LYS 113           1HZ      LYS 113  -9.286  18.536   1.940
  856    HZ3  LYS 113           2HZ      LYS 113  -9.902  17.540   3.171
  857    H    VAL 114           H        VAL 114  -9.098  13.875  -5.292
  858    HA   VAL 114           HA       VAL 114  -7.316  15.246  -7.187
  859    HB   VAL 114           HB       VAL 114  -7.760  12.818  -7.407
  860   HG11  VAL 114          1HG1      VAL 114 -10.120  12.821  -6.568
  861   HG12  VAL 114          2HG1      VAL 114  -9.947  11.963  -8.098
  862   HG13  VAL 114          3HG1      VAL 114 -10.638  13.582  -8.073
  863   HG21  VAL 114          3HG2      VAL 114  -7.216  14.195  -9.427
  864   HG22  VAL 114          1HG2      VAL 114  -8.941  14.419  -9.725
  865   HG23  VAL 114          2HG2      VAL 114  -8.226  12.813  -9.822
  866    H    LEU 115           H        LEU 115  -7.943  16.836  -8.546
  867    HA   LEU 115           HA       LEU 115 -10.482  18.185  -8.006
  868    HB2  LEU 115           1HB      LEU 115  -8.019  18.831  -9.652
  869    HB3  LEU 115           2HB      LEU 115  -9.474  19.803  -9.835
  870    HG   LEU 115           HG       LEU 115  -7.849  20.801  -8.215
  871   HD11  LEU 115          1HD1      LEU 115  -9.427  21.595  -6.716
  872   HD12  LEU 115          2HD1      LEU 115 -10.201  20.036  -6.468
  873   HD13  LEU 115          3HD1      LEU 115 -10.505  20.950  -7.946
  874   HD21  LEU 115          3HD2      LEU 115  -7.314  19.763  -6.110
  875   HD22  LEU 115          1HD2      LEU 115  -6.973  18.566  -7.358
  876   HD23  LEU 115          2HD2      LEU 115  -8.442  18.443  -6.384
  877    H    GLU 116           H        GLU 116 -12.245  18.163  -9.239
  878    HA   GLU 116           HA       GLU 116 -12.620  16.168 -11.234
  879    HB2  GLU 116           1HB      GLU 116 -14.307  18.601 -10.535
  880    HB3  GLU 116           2HB      GLU 116 -14.845  17.252 -11.542
  881    HG2  GLU 116           1HG      GLU 116 -14.502  15.690  -9.643
  882    HG3  GLU 116           2HG      GLU 116 -13.955  17.028  -8.634
  883    H    HIS 117           H        HIS 117 -11.903  19.620 -11.358
  884    HA   HIS 117           HA       HIS 117 -11.103  19.382 -14.183
  885    HB2  HIS 117           1HB      HIS 117 -13.213  21.382 -13.261
  886    HB3  HIS 117           2HB      HIS 117 -12.506  21.297 -14.876
  887    HD1  HIS 117           HD1      HIS 117 -14.999  19.651 -12.641
  888    HD2  HIS 117           HD2      HIS 117 -13.339  18.991 -16.408
  889    HE1  HIS 117           HE1      HIS 117 -16.420  17.872 -13.747
  890    HE2  HIS 117           HE2      HIS 117 -15.422  17.458 -16.045
  891    H    HIS 118           H        HIS 118  -9.824  21.139 -14.900
  892    HA   HIS 118           HA       HIS 118  -9.089  23.340 -13.200
  893    HB2  HIS 118           1HB      HIS 118  -7.920  21.478 -12.004
  894    HB3  HIS 118           2HB      HIS 118  -7.037  21.098 -13.478
  895    HD1  HIS 118           HD1      HIS 118  -5.255  22.859 -14.286
  896    HD2  HIS 118           HD2      HIS 118  -6.991  23.763 -10.605
  897    HE1  HIS 118           HE1      HIS 118  -3.851  24.703 -13.265
  898    HE2  HIS 118           HE2      HIS 118  -4.895  25.264 -11.020
  899    H    HIS 119           H        HIS 119  -8.997  21.560 -16.088
  900    HA   HIS 119           HA       HIS 119  -6.960  23.143 -17.452
  901    HB2  HIS 119           1HB      HIS 119  -9.043  21.195 -18.525
  902    HB3  HIS 119           2HB      HIS 119  -7.681  21.851 -19.436
  903    HD1  HIS 119           HD1      HIS 119  -8.538  19.390 -16.736
  904    HD2  HIS 119           HD2      HIS 119  -5.131  20.772 -18.704
  905    HE1  HIS 119           HE1      HIS 119  -6.658  17.815 -16.108
  906    HE2  HIS 119           HE2      HIS 119  -4.573  18.643 -17.298
  907    H    HIS 120           H        HIS 120  -9.380  24.442 -16.184
  908    HA   HIS 120           HA       HIS 120 -11.167  25.354 -18.182
  909    HB2  HIS 120           1HB      HIS 120 -11.577  25.576 -15.734
  910    HB3  HIS 120           2HB      HIS 120 -10.296  26.781 -15.633
  911    HD1  HIS 120           HD1      HIS 120 -10.745  29.103 -16.794
  912    HD2  HIS 120           HD2      HIS 120 -14.016  26.518 -16.827
  913    HE1  HIS 120           HE1      HIS 120 -12.749  30.490 -17.484
  914    HE2  HIS 120           HE2      HIS 120 -14.750  28.928 -17.509
  915    H    HIS 121           H        HIS 121  -8.156  26.796 -16.902
  916    HA   HIS 121           HA       HIS 121  -8.201  29.052 -18.709
  917    HB2  HIS 121           1HB      HIS 121  -5.945  27.913 -17.004
  918    HB3  HIS 121           2HB      HIS 121  -5.959  29.503 -17.772
  919    HD1  HIS 121           HD1      HIS 121  -8.255  30.966 -17.025
  920    HD2  HIS 121           HD2      HIS 121  -6.856  28.033 -14.413
  921    HE1  HIS 121           HE1      HIS 121  -9.241  31.499 -14.755
  922    HE2  HIS 121           HE2      HIS 121  -8.399  29.721 -13.150
  923    H    HIS 122           H        HIS 122  -8.572  27.571 -20.617
  924    HA   HIS 122           HA       HIS 122  -6.515  25.879 -21.616
  925    HB2  HIS 122           1HB      HIS 122  -8.875  25.817 -22.412
  926    HB3  HIS 122           2HB      HIS 122  -8.658  27.391 -23.170
  927    HD1  HIS 122           HD1      HIS 122  -7.115  23.901 -23.301
  928    HD2  HIS 122           HD2      HIS 122  -7.657  27.224 -25.760
  929    HE1  HIS 122           HE1      HIS 122  -6.219  23.258 -25.582
  930    HE2  HIS 122           HE2      HIS 122  -6.543  25.274 -27.092
  Start of MODEL    3
    1    H1   MET   1           1H       MET   1  11.946  12.484   4.130
    2    H2   MET   1           2H       MET   1  10.632  11.516   4.604
    3    H3   MET   1           3H       MET   1  10.924  12.999   5.381
    4    HA   MET   1           HA       MET   1   9.416  13.853   3.993
    5    HB2  MET   1           1HB      MET   1  11.706  13.324   2.056
    6    HB3  MET   1           2HB      MET   1  10.383  14.448   1.750
    7    HG2  MET   1           1HG      MET   1  11.036  15.753   3.772
    8    HG3  MET   1           2HG      MET   1  12.375  14.638   4.045
    9    HE1  MET   1           3HE      MET   1  11.966  17.826   0.760
   10    HE2  MET   1           1HE      MET   1  11.491  18.028   2.449
   11    HE3  MET   1           2HE      MET   1  10.644  16.875   1.426
   12    H    ASP   2           H        ASP   2  10.927  11.033   2.421
   13    HA   ASP   2           HA       ASP   2   8.745  10.431   0.675
   14    HB2  ASP   2           1HB      ASP   2  10.943   8.644   1.791
   15    HB3  ASP   2           2HB      ASP   2   9.896   8.237   0.431
   16    H    LEU   3           H        LEU   3   6.764  10.161   1.605
   17    HA   LEU   3           HA       LEU   3   6.312   9.062   4.141
   18    HB2  LEU   3           1HB      LEU   3   4.493   9.466   1.770
   19    HB3  LEU   3           2HB      LEU   3   3.862   8.889   3.303
   20    HG   LEU   3           HG       LEU   3   5.536  11.446   3.273
   21   HD11  LEU   3          1HD1      LEU   3   2.565  11.339   2.654
   22   HD12  LEU   3          2HD1      LEU   3   3.837  11.822   1.533
   23   HD13  LEU   3          3HD1      LEU   3   3.500  12.807   2.954
   24   HD21  LEU   3          3HD2      LEU   3   4.891  10.459   5.472
   25   HD22  LEU   3          1HD2      LEU   3   3.193  10.554   5.013
   26   HD23  LEU   3          2HD2      LEU   3   4.137  12.025   5.229
   27    HA   PRO   4           HA       PRO   4   6.586   4.623   3.634
   28    HB2  PRO   4           1HB      PRO   4   3.769   4.519   4.765
   29    HB3  PRO   4           2HB      PRO   4   5.185   3.547   5.227
   30    HG2  PRO   4           1HG      PRO   4   4.431   5.573   6.754
   31    HG3  PRO   4           2HG      PRO   4   6.158   5.336   6.411
   32    HD2  PRO   4           1HD      PRO   4   4.267   7.385   5.216
   33    HD3  PRO   4           2HD      PRO   4   5.965   7.536   5.691
   34    H    ILE   5           H        ILE   5   3.886   6.402   2.381
   35    HA   ILE   5           HA       ILE   5   3.312   4.314   0.298
   36    HB   ILE   5           HB       ILE   5   1.381   6.338   1.529
   37   HG12  ILE   5          1HG1      ILE   5   1.400   3.276   1.784
   38   HG13  ILE   5          2HG1      ILE   5   2.050   4.345   3.014
   39   HG21  ILE   5          1HG2      ILE   5   0.831   5.851  -0.846
   40   HG22  ILE   5          2HG2      ILE   5  -0.345   5.072   0.191
   41   HG23  ILE   5          3HG2      ILE   5   0.947   4.122  -0.538
   42   HD11  ILE   5          3HD1      ILE   5  -0.825   4.408   2.060
   43   HD12  ILE   5          1HD1      ILE   5  -0.117   5.399   3.341
   44   HD13  ILE   5          2HD1      ILE   5  -0.251   3.653   3.538
   45    H    THR   6           H        THR   6   3.549   4.928  -1.737
   46    HA   THR   6           HA       THR   6   3.645   7.831  -2.469
   47    HB   THR   6           HB       THR   6   5.577   7.393  -3.907
   48    HG1  THR   6           HG1      THR   6   5.193   5.259  -4.404
   49   HG21  THR   6          3HG2      THR   6   6.054   6.295  -1.106
   50   HG22  THR   6          1HG2      THR   6   5.982   8.011  -1.516
   51   HG23  THR   6          2HG2      THR   6   7.270   6.998  -2.166
   52    H    LEU   7           H        LEU   7   2.207   8.231  -3.987
   53    HA   LEU   7           HA       LEU   7   1.260   6.060  -5.801
   54    HB2  LEU   7           1HB      LEU   7  -0.090   8.724  -5.167
   55    HB3  LEU   7           2HB      LEU   7  -0.756   7.371  -6.072
   56    HG   LEU   7           HG       LEU   7  -0.110   6.071  -3.677
   57   HD11  LEU   7          1HD1      LEU   7  -0.991   8.873  -2.859
   58   HD12  LEU   7          2HD1      LEU   7   0.623   8.208  -2.616
   59   HD13  LEU   7          3HD1      LEU   7  -0.756   7.490  -1.789
   60   HD21  LEU   7          3HD2      LEU   7  -2.495   6.244  -3.070
   61   HD22  LEU   7          1HD2      LEU   7  -2.310   5.948  -4.797
   62   HD23  LEU   7          2HD2      LEU   7  -2.703   7.567  -4.219
   63    H    SER   8           H        SER   8   1.152   6.407  -7.995
   64    HA   SER   8           HA       SER   8   3.095   8.281  -9.110
   65    HB2  SER   8           1HB      SER   8   2.987   6.025 -10.036
   66    HB3  SER   8           2HB      SER   8   1.276   6.227 -10.407
   67    HG   SER   8           HG       SER   8   3.466   7.690 -11.473
   68    H    LYS   9           H        LYS   9   0.813   9.511  -7.847
   69    HA   LYS   9           HA       LYS   9  -1.100  10.390  -9.800
   70    HB2  LYS   9           1HB      LYS   9  -1.733  12.040  -8.012
   71    HB3  LYS   9           2HB      LYS   9  -1.705  10.370  -7.441
   72    HG2  LYS   9           1HG      LYS   9   0.543  10.725  -6.463
   73    HG3  LYS   9           2HG      LYS   9   0.557  12.380  -7.042
   74    HD2  LYS   9           1HD      LYS   9  -1.445  12.888  -5.655
   75    HD3  LYS   9           2HD      LYS   9  -1.441  11.227  -5.058
   76    HE2  LYS   9           1HE      LYS   9   0.795  11.576  -4.063
   77    HE3  LYS   9           2HE      LYS   9   0.830  13.226  -4.697
   78    HZ1  LYS   9           3HZ      LYS   9  -0.025  12.676  -2.275
   79    HZ2  LYS   9           1HZ      LYS   9  -1.489  12.457  -3.102
   80    HZ3  LYS   9           2HZ      LYS   9  -0.678  13.945  -3.196
   81    H    GLU  10           H        GLU  10   1.228  10.721 -11.075
   82    HA   GLU  10           HA       GLU  10   2.623  13.133 -10.793
   83    HB2  GLU  10           1HB      GLU  10   3.250  11.216 -12.288
   84    HB3  GLU  10           2HB      GLU  10   1.966  11.684 -13.400
   85    HG2  GLU  10           1HG      GLU  10   3.054  13.902 -13.726
   86    HG3  GLU  10           2HG      GLU  10   4.322  13.444 -12.592
   87    H    THR  11           H        THR  11  -0.406  12.434 -12.491
   88    HA   THR  11           HA       THR  11  -0.912  15.357 -12.877
   89    HB   THR  11           HB       THR  11  -2.124  14.763 -14.909
   90    HG1  THR  11           HG1      THR  11  -1.266  12.262 -15.240
   91   HG21  THR  11          3HG2      THR  11  -0.203  14.070 -16.294
   92   HG22  THR  11          1HG2      THR  11   0.648  13.502 -14.859
   93   HG23  THR  11          2HG2      THR  11   0.324  15.225 -15.070
   94    HA   PRO  12           HA       PRO  12  -4.077  13.587  -9.872
   95    HB2  PRO  12           1HB      PRO  12  -4.311  16.625  -9.671
   96    HB3  PRO  12           2HB      PRO  12  -4.504  15.409  -8.377
   97    HG2  PRO  12           1HG      PRO  12  -2.216  16.687  -8.525
   98    HG3  PRO  12           2HG      PRO  12  -2.171  14.913  -8.358
   99    HD2  PRO  12           1HD      PRO  12  -1.754  16.563 -10.880
  100    HD3  PRO  12           2HD      PRO  12  -0.845  15.138 -10.318
  101    H    PHE  13           H        PHE  13  -5.797  12.811 -11.015
  102    HA   PHE  13           HA       PHE  13  -7.851  14.580 -11.983
  103    HB2  PHE  13           1HB      PHE  13  -6.176  14.689 -13.870
  104    HB3  PHE  13           2HB      PHE  13  -6.358  12.954 -14.104
  105    HD1  PHE  13           HD2      PHE  13  -8.131  16.242 -14.235
  106    HD2  PHE  13           HD1      PHE  13  -8.389  12.050 -15.206
  107    HE1  PHE  13           HE2      PHE  13 -10.157  16.672 -15.593
  108    HE2  PHE  13           HE1      PHE  13 -10.413  12.492 -16.560
  109    HZ   PHE  13           HZ       PHE  13 -11.300  14.802 -16.753
  110    H    GLU  14           H        GLU  14  -9.696  13.556 -11.572
  111    HA   GLU  14           HA       GLU  14  -9.881  10.873 -10.719
  112    HB2  GLU  14           1HB      GLU  14 -11.999  12.790 -11.769
  113    HB3  GLU  14           2HB      GLU  14 -12.399  11.227 -11.054
  114    HG2  GLU  14           1HG      GLU  14 -10.816  13.404  -9.602
  115    HG3  GLU  14           2HG      GLU  14 -12.552  13.164  -9.426
  116    H    GLY  15           H        GLY  15 -10.652   9.008 -11.705
  117    HA2  GLY  15           1HA      GLY  15 -11.335   7.608 -13.457
  118    HA3  GLY  15           2HA      GLY  15 -11.236   8.946 -14.587
  119    H    GLU  16           H        GLU  16  -8.518   9.676 -13.679
  120    HA   GLU  16           HA       GLU  16  -7.020   8.088 -15.524
  121    HB2  GLU  16           1HB      GLU  16  -6.505  10.483 -14.921
  122    HB3  GLU  16           2HB      GLU  16  -5.924   9.937 -13.351
  123    HG2  GLU  16           1HG      GLU  16  -4.203   8.533 -14.477
  124    HG3  GLU  16           2HG      GLU  16  -4.795   9.072 -16.049
  125    H    GLU  17           H        GLU  17  -5.818   6.301 -15.221
  126    HA   GLU  17           HA       GLU  17  -6.094   4.764 -12.830
  127    HB2  GLU  17           1HB      GLU  17  -5.770   3.836 -15.158
  128    HB3  GLU  17           2HB      GLU  17  -4.085   4.344 -15.098
  129    HG2  GLU  17           1HG      GLU  17  -3.731   2.911 -13.092
  130    HG3  GLU  17           2HG      GLU  17  -5.421   2.411 -13.145
  131    H    ILE  18           H        ILE  18  -4.743   4.547 -11.115
  132    HA   ILE  18           HA       ILE  18  -2.126   6.004 -11.079
  133    HB   ILE  18           HB       ILE  18  -2.604   6.535  -8.677
  134   HG12  ILE  18          1HG1      ILE  18  -5.462   5.645  -9.336
  135   HG13  ILE  18          2HG1      ILE  18  -4.351   4.698  -8.359
  136   HG21  ILE  18          1HG2      ILE  18  -3.002   8.219 -10.460
  137   HG22  ILE  18          2HG2      ILE  18  -4.170   8.405  -9.157
  138   HG23  ILE  18          3HG2      ILE  18  -4.649   7.621 -10.662
  139   HD11  ILE  18          3HD1      ILE  18  -5.825   5.965  -6.905
  140   HD12  ILE  18          1HD1      ILE  18  -5.367   7.474  -7.691
  141   HD13  ILE  18          2HD1      ILE  18  -4.181   6.577  -6.743
  142    H    THR  19           H        THR  19  -0.475   5.086  -9.975
  143    HA   THR  19           HA       THR  19  -0.693   2.180  -9.522
  144    HB   THR  19           HB       THR  19   1.776   3.970  -9.488
  145    HG1  THR  19           HG1      THR  19   0.979   4.114 -11.500
  146   HG21  THR  19          3HG2      THR  19   2.960   1.837  -9.939
  147   HG22  THR  19          1HG2      THR  19   1.435   0.960  -9.830
  148   HG23  THR  19          2HG2      THR  19   2.101   1.758  -8.404
  149    H    VAL  20           H        VAL  20  -1.294   1.596  -7.543
  150    HA   VAL  20           HA       VAL  20  -0.630   3.242  -5.185
  151    HB   VAL  20           HB       VAL  20  -2.319   0.689  -5.344
  152   HG11  VAL  20          1HG1      VAL  20  -1.525   1.234  -3.061
  153   HG12  VAL  20          2HG1      VAL  20  -3.245   1.587  -3.186
  154   HG13  VAL  20          3HG1      VAL  20  -2.070   2.899  -3.248
  155   HG21  VAL  20          3HG2      VAL  20  -4.264   2.255  -5.347
  156   HG22  VAL  20          1HG2      VAL  20  -3.279   2.469  -6.790
  157   HG23  VAL  20          2HG2      VAL  20  -3.163   3.628  -5.466
  158    H    SER  21           H        SER  21   1.221   2.839  -4.147
  159    HA   SER  21           HA       SER  21   2.266   0.048  -3.914
  160    HB2  SER  21           1HB      SER  21   3.863   2.595  -4.371
  161    HB3  SER  21           2HB      SER  21   4.541   0.985  -4.108
  162    HG   SER  21           HG       SER  21   2.603   1.159  -6.069
  163    H    ALA  22           H        ALA  22   2.844  -0.553  -1.923
  164    HA   ALA  22           HA       ALA  22   2.881   1.456   0.300
  165    HB1  ALA  22           3HB      ALA  22   1.858  -1.410   0.335
  166    HB2  ALA  22           1HB      ALA  22   0.853   0.039   0.345
  167    HB3  ALA  22           2HB      ALA  22   1.906  -0.311   1.719
  168    H    ARG  23           H        ARG  23   4.767   1.540   1.338
  169    HA   ARG  23           HA       ARG  23   6.888  -0.387   0.781
  170    HB2  ARG  23           1HB      ARG  23   6.785   2.030   2.625
  171    HB3  ARG  23           2HB      ARG  23   8.237   1.086   2.284
  172    HG2  ARG  23           1HG      ARG  23   8.043   1.631  -0.127
  173    HG3  ARG  23           2HG      ARG  23   6.578   2.564   0.189
  174    HD2  ARG  23           1HD      ARG  23   8.548   4.051   0.017
  175    HD3  ARG  23           2HD      ARG  23   7.879   4.095   1.644
  176    HE   ARG  23           HE       ARG  23   9.884   2.093   1.506
  177   HH11  ARG  23          1HH2      ARG  23   9.494   5.543   1.457
  178   HH12  ARG  23          2HH2      ARG  23  11.049   5.863   2.149
  179   HH21  ARG  23          1HH1      ARG  23  11.919   2.518   2.419
  180   HH22  ARG  23          2HH1      ARG  23  12.419   4.154   2.692
  181    H    VAL  24           H        VAL  24   6.906  -2.278   1.807
  182    HA   VAL  24           HA       VAL  24   5.746  -2.566   4.515
  183    HB   VAL  24           HB       VAL  24   5.824  -4.962   4.065
  184   HG11  VAL  24          1HG1      VAL  24   4.838  -3.458   1.591
  185   HG12  VAL  24          2HG1      VAL  24   3.947  -3.571   3.104
  186   HG13  VAL  24          3HG1      VAL  24   4.263  -5.026   2.158
  187   HG21  VAL  24          3HG2      VAL  24   6.613  -5.762   1.751
  188   HG22  VAL  24          1HG2      VAL  24   7.897  -5.278   2.847
  189   HG23  VAL  24          2HG2      VAL  24   7.385  -4.194   1.558
  190    H    THR  25           H        THR  25   7.013  -2.566   6.247
  191    HA   THR  25           HA       THR  25   9.957  -2.826   5.961
  192    HB   THR  25           HB       THR  25   8.290  -1.782   8.292
  193    HG1  THR  25           HG1      THR  25   9.600   0.145   7.214
  194   HG21  THR  25          3HG2      THR  25  10.474  -0.796   9.000
  195   HG22  THR  25          1HG2      THR  25  11.277  -1.638   7.677
  196   HG23  THR  25          2HG2      THR  25  10.537  -2.554   8.991
  197    H    ASN  26           H        ASN  26  10.854  -4.693   6.492
  198    HA   ASN  26           HA       ASN  26   9.379  -6.716   8.059
  199    HB2  ASN  26           1HB      ASN  26  11.951  -6.785   6.439
  200    HB3  ASN  26           2HB      ASN  26  11.344  -8.167   7.356
  201   HD21  ASN  26          2HD2      ASN  26  10.062  -9.554   6.129
  202   HD22  ASN  26          1HD2      ASN  26   9.128  -9.097   4.789
  203    H    ARG  27           H        ARG  27   9.679  -6.901  10.155
  204    HA   ARG  27           HA       ARG  27  12.147  -5.809  11.455
  205    HB2  ARG  27           1HB      ARG  27   9.357  -6.266  12.585
  206    HB3  ARG  27           2HB      ARG  27  10.742  -5.630  13.483
  207    HG2  ARG  27           1HG      ARG  27  10.876  -3.709  11.886
  208    HG3  ARG  27           2HG      ARG  27   9.461  -4.334  11.032
  209    HD2  ARG  27           1HD      ARG  27   9.507  -3.511  13.963
  210    HD3  ARG  27           2HD      ARG  27   8.855  -2.536  12.647
  211    HE   ARG  27           HE       ARG  27   7.581  -5.024  12.517
  212   HH11  ARG  27          1HH2      ARG  27   7.856  -2.332  14.698
  213   HH12  ARG  27          2HH2      ARG  27   6.284  -2.559  15.388
  214   HH21  ARG  27          1HH1      ARG  27   5.522  -5.316  13.429
  215   HH22  ARG  27          2HH1      ARG  27   4.966  -4.245  14.673
  216    H    GLY  28           H        GLY  28  13.501  -7.226  12.312
  217    HA2  GLY  28           1HA      GLY  28  12.886  -9.435  13.886
  218    HA3  GLY  28           2HA      GLY  28  13.075 -10.048  12.242
  219    H    ALA  29           H        ALA  29  14.999 -11.078  12.329
  220    HA   ALA  29           HA       ALA  29  17.436  -9.498  12.583
  221    HB1  ALA  29           3HB      ALA  29  18.420 -10.914  14.352
  222    HB2  ALA  29           1HB      ALA  29  16.900 -11.805  14.496
  223    HB3  ALA  29           2HB      ALA  29  16.969 -10.102  14.943
  224    H    ALA  30           H        ALA  30  15.730 -11.587  10.899
  225    HA   ALA  30           HA       ALA  30  18.100 -12.889   9.708
  226    HB1  ALA  30           3HB      ALA  30  16.980 -15.088   9.694
  227    HB2  ALA  30           1HB      ALA  30  15.618 -14.414  10.595
  228    HB3  ALA  30           2HB      ALA  30  17.207 -14.523  11.349
  229    H    GLU  31           H        GLU  31  17.700 -13.716   7.592
  230    HA   GLU  31           HA       GLU  31  16.202 -11.971   5.938
  231    HB2  GLU  31           1HB      GLU  31  17.300 -14.748   5.347
  232    HB3  GLU  31           2HB      GLU  31  16.719 -13.615   4.123
  233    HG2  GLU  31           1HG      GLU  31  18.443 -11.967   4.822
  234    HG3  GLU  31           2HG      GLU  31  19.029 -13.094   6.045
  235    H    ALA  32           H        ALA  32  14.048 -11.863   5.759
  236    HA   ALA  32           HA       ALA  32  12.308 -14.111   6.500
  237    HB1  ALA  32           3HB      ALA  32  11.787 -11.814   7.265
  238    HB2  ALA  32           1HB      ALA  32  10.502 -12.441   6.230
  239    HB3  ALA  32           2HB      ALA  32  11.666 -11.272   5.594
  240    H    HIS  33           H        HIS  33  10.767 -15.003   5.095
  241    HA   HIS  33           HA       HIS  33  10.995 -14.447   2.183
  242    HB2  HIS  33           1HB      HIS  33  11.611 -17.054   3.603
  243    HB3  HIS  33           2HB      HIS  33  10.824 -17.145   2.030
  244    HD1  HIS  33           HD1      HIS  33  12.372 -17.249   0.129
  245    HD2  HIS  33           HD2      HIS  33  14.114 -15.240   3.333
  246    HE1  HIS  33           HE1      HIS  33  14.729 -16.665  -0.585
  247    HE2  HIS  33           HE2      HIS  33  15.801 -15.435   1.358
  248    H    ASN  34           H        ASN  34   9.259 -15.305   0.951
  249    HA   ASN  34           HA       ASN  34   7.010 -15.364   0.499
  250    HB2  ASN  34           1HB      ASN  34   6.930 -16.991   3.070
  251    HB3  ASN  34           2HB      ASN  34   5.709 -16.987   1.796
  252   HD21  ASN  34          2HD2      ASN  34   8.099 -18.924   2.900
  253   HD22  ASN  34          1HD2      ASN  34   8.646 -19.595   1.441
  254    H    VAL  35           H        VAL  35   7.284 -12.976   1.161
  255    HA   VAL  35           HA       VAL  35   5.544 -12.286   3.490
  256    HB   VAL  35           HB       VAL  35   7.623 -10.570   2.099
  257   HG11  VAL  35          1HG1      VAL  35   6.021 -10.168   4.670
  258   HG12  VAL  35          2HG1      VAL  35   5.813  -9.252   3.180
  259   HG13  VAL  35          3HG1      VAL  35   7.302  -9.099   4.101
  260   HG21  VAL  35          3HG2      VAL  35   8.673 -12.469   3.315
  261   HG22  VAL  35          1HG2      VAL  35   7.744 -12.064   4.762
  262   HG23  VAL  35          2HG2      VAL  35   8.975 -10.952   4.152
  263    HA   PRO  36           HA       PRO  36   3.264 -11.012  -0.362
  264    HB2  PRO  36           1HB      PRO  36   0.788 -11.956   0.211
  265    HB3  PRO  36           2HB      PRO  36   2.084 -13.067  -0.304
  266    HG2  PRO  36           1HG      PRO  36   1.152 -12.452   2.501
  267    HG3  PRO  36           2HG      PRO  36   1.416 -14.043   1.744
  268    HD2  PRO  36           1HD      PRO  36   3.316 -12.853   3.336
  269    HD3  PRO  36           2HD      PRO  36   3.775 -13.904   1.976
  270    H    VAL  37           H        VAL  37   1.172  -9.673  -0.471
  271    HA   VAL  37           HA       VAL  37   0.605  -8.068   1.932
  272    HB   VAL  37           HB       VAL  37   2.625  -7.009   0.944
  273   HG11  VAL  37          1HG1      VAL  37   2.534  -5.961  -1.270
  274   HG12  VAL  37          2HG1      VAL  37   0.902  -6.544  -1.527
  275   HG13  VAL  37          3HG1      VAL  37   2.240  -7.687  -1.422
  276   HG21  VAL  37          3HG2      VAL  37   0.107  -5.322   0.559
  277   HG22  VAL  37          1HG2      VAL  37   1.738  -4.708   0.826
  278   HG23  VAL  37          2HG2      VAL  37   0.917  -5.606   2.100
  279    H    ALA  38           H        ALA  38  -1.346  -7.032   1.850
  280    HA   ALA  38           HA       ALA  38  -3.015  -7.295  -0.608
  281    HB1  ALA  38           3HB      ALA  38  -4.905  -7.927   0.841
  282    HB2  ALA  38           1HB      ALA  38  -3.863  -7.858   2.270
  283    HB3  ALA  38           2HB      ALA  38  -3.583  -9.081   1.031
  284    H    VAL  39           H        VAL  39  -4.009  -5.450  -1.130
  285    HA   VAL  39           HA       VAL  39  -4.221  -3.225   0.850
  286    HB   VAL  39           HB       VAL  39  -4.106  -1.800  -1.321
  287   HG11  VAL  39          1HG1      VAL  39  -2.231  -1.906   0.306
  288   HG12  VAL  39          2HG1      VAL  39  -1.625  -1.808  -1.346
  289   HG13  VAL  39          3HG1      VAL  39  -1.624  -3.355  -0.494
  290   HG21  VAL  39          3HG2      VAL  39  -4.450  -3.682  -2.909
  291   HG22  VAL  39          1HG2      VAL  39  -2.880  -4.344  -2.448
  292   HG23  VAL  39          2HG2      VAL  39  -2.977  -2.773  -3.241
  293    H    TYR  40           H        TYR  40  -6.092  -2.093   0.890
  294    HA   TYR  40           HA       TYR  40  -8.287  -2.713  -0.967
  295    HB2  TYR  40           1HB      TYR  40  -9.827  -3.225   0.968
  296    HB3  TYR  40           2HB      TYR  40  -8.598  -4.458   0.689
  297    HD1  TYR  40           HD2      TYR  40  -9.609  -1.641   2.912
  298    HD2  TYR  40           HD1      TYR  40  -6.727  -4.795   2.274
  299    HE1  TYR  40           HE2      TYR  40  -8.751  -1.342   5.213
  300    HE2  TYR  40           HE1      TYR  40  -5.886  -4.483   4.576
  301    HH   TYR  40           HH       TYR  40  -6.686  -1.778   6.473
  302    H    LEU  41           H        LEU  41  -9.912  -1.182  -0.980
  303    HA   LEU  41           HA       LEU  41  -9.166   1.440   0.198
  304    HB2  LEU  41           1HB      LEU  41  -9.627   1.105  -2.329
  305    HB3  LEU  41           2HB      LEU  41 -11.315   0.919  -1.899
  306    HG   LEU  41           HG       LEU  41 -10.838   3.266  -0.542
  307   HD11  LEU  41          1HD1      LEU  41  -8.903   3.424  -2.895
  308   HD12  LEU  41          2HD1      LEU  41  -8.420   3.310  -1.204
  309   HD13  LEU  41          3HD1      LEU  41  -9.308   4.721  -1.769
  310   HD21  LEU  41          3HD2      LEU  41 -11.665   4.502  -2.557
  311   HD22  LEU  41          1HD2      LEU  41 -12.579   3.030  -2.222
  312   HD23  LEU  41          2HD2      LEU  41 -11.388   3.050  -3.522
  313    H    GLY  42           H        GLY  42 -10.289   2.248   1.862
  314    HA2  GLY  42           1HA      GLY  42 -12.505   2.858   2.753
  315    HA3  GLY  42           2HA      GLY  42 -13.034   1.202   2.488
  316    H    ASN  43           H        ASN  43 -13.575   0.988   4.671
  317    HA   ASN  43           HA       ASN  43 -11.289   0.841   6.575
  318    HB2  ASN  43           1HB      ASN  43 -14.216   1.351   7.106
  319    HB3  ASN  43           2HB      ASN  43 -12.971   1.245   8.351
  320   HD21  ASN  43          2HD2      ASN  43 -14.386   3.325   5.911
  321   HD22  ASN  43          1HD2      ASN  43 -13.389   4.668   6.201
  322    HA   PRO  44           HA       PRO  44 -12.276  -3.541   6.757
  323    HB2  PRO  44           1HB      PRO  44 -10.938  -4.329   8.996
  324    HB3  PRO  44           2HB      PRO  44 -10.055  -3.734   7.566
  325    HG2  PRO  44           1HG      PRO  44 -10.866  -2.177  10.030
  326    HG3  PRO  44           2HG      PRO  44  -9.250  -2.310   9.289
  327    HD2  PRO  44           1HD      PRO  44 -10.854  -0.182   8.732
  328    HD3  PRO  44           2HD      PRO  44  -9.826  -0.898   7.463
  329    H    ALA  45           H        ALA  45 -13.360  -1.240   9.027
  330    HA   ALA  45           HA       ALA  45 -14.694  -2.841  10.941
  331    HB1  ALA  45           3HB      ALA  45 -15.432  -0.079   9.903
  332    HB2  ALA  45           1HB      ALA  45 -14.306  -0.414  11.218
  333    HB3  ALA  45           2HB      ALA  45 -16.015  -0.803  11.405
  334    H    GLN  46           H        GLN  46 -15.856  -1.427   7.878
  335    HA   GLN  46           HA       GLN  46 -18.468  -2.737   8.087
  336    HB2  GLN  46           1HB      GLN  46 -17.119  -1.076   5.911
  337    HB3  GLN  46           2HB      GLN  46 -18.729  -1.772   5.717
  338    HG2  GLN  46           1HG      GLN  46 -18.927   0.554   6.475
  339    HG3  GLN  46           2HG      GLN  46 -19.501  -0.526   7.740
  340   HE21  GLN  46          2HE2      GLN  46 -18.831   0.329   9.738
  341   HE22  GLN  46          1HE2      GLN  46 -17.295   0.984  10.041
  342    H    GLY  47           H        GLY  47 -16.213  -2.811   5.339
  343    HA2  GLY  47           1HA      GLY  47 -15.597  -5.552   5.353
  344    HA3  GLY  47           2HA      GLY  47 -17.079  -5.357   4.415
  345    H    GLY  48           H        GLY  48 -13.723  -4.247   4.686
  346    HA2  GLY  48           1HA      GLY  48 -13.576  -2.855   2.215
  347    HA3  GLY  48           2HA      GLY  48 -12.213  -3.512   3.111
  348    H    VAL  49           H        VAL  49 -12.137  -3.596   0.385
  349    HA   VAL  49           HA       VAL  49 -12.359  -6.516  -0.211
  350    HB   VAL  49           HB       VAL  49 -14.229  -5.291  -1.296
  351   HG11  VAL  49          1HG1      VAL  49 -13.811  -3.616  -3.033
  352   HG12  VAL  49          2HG1      VAL  49 -12.073  -3.750  -2.806
  353   HG13  VAL  49          3HG1      VAL  49 -13.078  -3.080  -1.523
  354   HG21  VAL  49          3HG2      VAL  49 -13.221  -7.283  -2.416
  355   HG22  VAL  49          1HG2      VAL  49 -12.122  -6.228  -3.304
  356   HG23  VAL  49          2HG2      VAL  49 -13.856  -6.133  -3.587
  357    H    GLU  50           H        GLU  50 -10.654  -7.397  -1.227
  358    HA   GLU  50           HA       GLU  50  -8.188  -5.910  -1.308
  359    HB2  GLU  50           1HB      GLU  50  -8.305  -8.333  -0.702
  360    HB3  GLU  50           2HB      GLU  50  -8.750  -8.717  -2.363
  361    HG2  GLU  50           1HG      GLU  50  -6.602  -7.737  -3.161
  362    HG3  GLU  50           2HG      GLU  50  -6.169  -7.331  -1.505
  363    H    ILE  51           H        ILE  51  -7.153  -5.042  -3.043
  364    HA   ILE  51           HA       ILE  51  -8.587  -4.920  -5.634
  365    HB   ILE  51           HB       ILE  51  -6.164  -3.350  -4.640
  366   HG12  ILE  51          1HG1      ILE  51  -9.078  -2.447  -4.910
  367   HG13  ILE  51          2HG1      ILE  51  -8.354  -2.929  -3.387
  368   HG21  ILE  51          1HG2      ILE  51  -6.731  -1.858  -6.608
  369   HG22  ILE  51          2HG2      ILE  51  -7.933  -3.033  -7.118
  370   HG23  ILE  51          3HG2      ILE  51  -6.224  -3.458  -7.111
  371   HD11  ILE  51          3HD1      ILE  51  -8.294  -0.502  -3.598
  372   HD12  ILE  51          1HD1      ILE  51  -7.421  -0.624  -5.119
  373   HD13  ILE  51          2HD1      ILE  51  -6.655  -1.138  -3.614
  374    H    GLY  52           H        GLY  52  -5.440  -5.831  -4.239
  375    HA2  GLY  52           1HA      GLY  52  -4.981  -7.922  -6.060
  376    HA3  GLY  52           2HA      GLY  52  -4.135  -6.488  -6.649
  377    H    ARG  53           H        ARG  53  -2.607  -8.601  -6.030
  378    HA   ARG  53           HA       ARG  53  -1.030  -7.631  -3.744
  379    HB2  ARG  53           1HB      ARG  53  -0.808  -9.971  -2.820
  380    HB3  ARG  53           2HB      ARG  53  -2.420  -9.291  -2.613
  381    HG2  ARG  53           1HG      ARG  53  -3.381 -10.662  -4.332
  382    HG3  ARG  53           2HG      ARG  53  -1.821 -11.045  -5.050
  383    HD2  ARG  53           1HD      ARG  53  -2.713 -12.980  -3.793
  384    HD3  ARG  53           2HD      ARG  53  -1.207 -12.399  -3.091
  385    HE   ARG  53           HE       ARG  53  -2.353 -11.720  -1.182
  386   HH11  ARG  53          1HH2      ARG  53  -4.616 -12.535  -3.701
  387   HH12  ARG  53          2HH2      ARG  53  -5.988 -12.532  -2.643
  388   HH21  ARG  53          1HH1      ARG  53  -4.158 -11.704   0.178
  389   HH22  ARG  53          2HH1      ARG  53  -5.729 -12.064  -0.457
  390    H    ASP  54           H        ASP  54   1.082  -8.644  -3.661
  391    HA   ASP  54           HA       ASP  54   2.018 -10.125  -6.026
  392    HB2  ASP  54           1HB      ASP  54   3.061  -7.346  -5.341
  393    HB3  ASP  54           2HB      ASP  54   3.751  -8.424  -6.555
  394    H    THR  55           H        THR  55   3.116 -11.719  -5.093
  395    HA   THR  55           HA       THR  55   4.386 -11.454  -2.505
  396    HB   THR  55           HB       THR  55   4.562 -13.765  -4.496
  397    HG1  THR  55           HG1      THR  55   2.437 -13.416  -4.035
  398   HG21  THR  55          3HG2      THR  55   4.946 -13.631  -1.471
  399   HG22  THR  55          1HG2      THR  55   6.231 -13.875  -2.657
  400   HG23  THR  55          2HG2      THR  55   4.984 -15.100  -2.440
  401    H    ILE  56           H        ILE  56   6.476 -11.031  -2.091
  402    HA   ILE  56           HA       ILE  56   8.267 -10.317  -4.315
  403    HB   ILE  56           HB       ILE  56   8.572 -10.016  -1.293
  404   HG12  ILE  56          1HG1      ILE  56   7.905  -7.887  -3.403
  405   HG13  ILE  56          2HG1      ILE  56   6.688  -8.660  -2.397
  406   HG21  ILE  56          1HG2      ILE  56  10.788 -10.064  -2.375
  407   HG22  ILE  56          2HG2      ILE  56  10.422  -8.398  -1.957
  408   HG23  ILE  56          3HG2      ILE  56  10.244  -8.945  -3.623
  409   HD11  ILE  56          3HD1      ILE  56   7.356  -7.562  -0.473
  410   HD12  ILE  56          1HD1      ILE  56   7.730  -6.341  -1.681
  411   HD13  ILE  56          2HD1      ILE  56   9.017  -7.335  -1.012
  412    H    SER  57           H        SER  57  10.329 -11.209  -4.569
  413    HA   SER  57           HA       SER  57  10.540 -14.019  -4.226
  414    HB2  SER  57           1HB      SER  57  12.847 -13.726  -5.064
  415    HB3  SER  57           2HB      SER  57  11.715 -12.752  -6.001
  416    HG   SER  57           HG       SER  57  12.454 -10.960  -5.074
  417    H    ARG  58           H        ARG  58  12.258 -11.340  -2.592
  418    HA   ARG  58           HA       ARG  58  12.258 -12.625  -0.029
  419    HB2  ARG  58           1HB      ARG  58  14.731 -12.975   0.142
  420    HB3  ARG  58           2HB      ARG  58  13.967 -14.064  -1.015
  421    HG2  ARG  58           1HG      ARG  58  14.654 -12.537  -2.878
  422    HG3  ARG  58           2HG      ARG  58  15.476 -11.506  -1.710
  423    HD2  ARG  58           1HD      ARG  58  16.937 -13.401  -1.063
  424    HD3  ARG  58           2HD      ARG  58  16.121 -14.427  -2.246
  425    HE   ARG  58           HE       ARG  58  17.047 -12.129  -3.580
  426   HH11  ARG  58          1HH2      ARG  58  18.305 -14.929  -1.927
  427   HH12  ARG  58          2HH2      ARG  58  19.759 -14.985  -2.867
  428   HH21  ARG  58          1HH1      ARG  58  18.939 -12.218  -4.792
  429   HH22  ARG  58          2HH1      ARG  58  20.116 -13.452  -4.487
  430    H    ILE  59           H        ILE  59  12.754 -11.186   1.571
  431    HA   ILE  59           HA       ILE  59  13.575  -8.460   0.724
  432    HB   ILE  59           HB       ILE  59  11.923  -9.147   3.167
  433   HG12  ILE  59          1HG1      ILE  59  11.035  -8.084   0.439
  434   HG13  ILE  59          2HG1      ILE  59  10.747  -9.719   1.011
  435   HG21  ILE  59          1HG2      ILE  59  11.469  -6.699   3.173
  436   HG22  ILE  59          2HG2      ILE  59  12.484  -6.498   1.754
  437   HG23  ILE  59          3HG2      ILE  59  13.195  -6.988   3.285
  438   HD11  ILE  59          3HD1      ILE  59   8.736  -8.481   1.380
  439   HD12  ILE  59          1HD1      ILE  59   9.604  -7.169   2.167
  440   HD13  ILE  59          2HD1      ILE  59   9.467  -8.737   2.960
  441    HA   PRO  60           HA       PRO  60  17.101  -9.445   3.428
  442    HB2  PRO  60           1HB      PRO  60  18.608  -7.200   3.117
  443    HB3  PRO  60           2HB      PRO  60  18.385  -8.343   1.768
  444    HG2  PRO  60           1HG      PRO  60  16.872  -5.782   2.321
  445    HG3  PRO  60           2HG      PRO  60  17.657  -6.301   0.809
  446    HD2  PRO  60           1HD      PRO  60  14.985  -6.661   1.209
  447    HD3  PRO  60           2HD      PRO  60  15.934  -7.857   0.287
  448    H    VAL  61           H        VAL  61  18.000  -8.708   5.460
  449    HA   VAL  61           HA       VAL  61  16.041  -7.643   7.260
  450    HB   VAL  61           HB       VAL  61  17.862  -7.914   8.938
  451   HG11  VAL  61          1HG1      VAL  61  18.116 -10.366   8.696
  452   HG12  VAL  61          2HG1      VAL  61  17.616 -10.251   7.009
  453   HG13  VAL  61          3HG1      VAL  61  16.473  -9.864   8.295
  454   HG21  VAL  61          3HG2      VAL  61  20.054  -8.853   8.212
  455   HG22  VAL  61          1HG2      VAL  61  19.802  -7.247   7.541
  456   HG23  VAL  61          2HG2      VAL  61  19.570  -8.670   6.530
  457    H    GLY  62           H        GLY  62  15.971  -5.660   8.293
  458    HA2  GLY  62           1HA      GLY  62  16.359  -3.425   8.697
  459    HA3  GLY  62           2HA      GLY  62  17.998  -3.640   8.092
  460    H    GLY  63           H        GLY  63  15.673  -4.764   5.915
  461    HA2  GLY  63           1HA      GLY  63  15.852  -2.297   4.233
  462    HA3  GLY  63           2HA      GLY  63  15.796  -3.947   3.626
  463    H    THR  64           H        THR  64  14.026  -2.883   2.379
  464    HA   THR  64           HA       THR  64  11.432  -3.456   3.683
  465    HB   THR  64           HB       THR  64  10.442  -1.356   2.936
  466    HG1  THR  64           HG1      THR  64  12.984  -1.010   1.758
  467   HG21  THR  64          3HG2      THR  64  11.766  -1.338   5.136
  468   HG22  THR  64          1HG2      THR  64  11.568   0.241   4.374
  469   HG23  THR  64          2HG2      THR  64  13.096  -0.616   4.228
  470    H    GLY  65           H        GLY  65   9.811  -4.021   2.239
  471    HA2  GLY  65           1HA      GLY  65  10.731  -4.944  -0.415
  472    HA3  GLY  65           2HA      GLY  65   9.243  -5.383   0.416
  473    H    LEU  66           H        LEU  66   9.703  -4.326  -2.327
  474    HA   LEU  66           HA       LEU  66   7.924  -1.919  -2.163
  475    HB2  LEU  66           1HB      LEU  66  10.427  -1.814  -3.174
  476    HB3  LEU  66           2HB      LEU  66   9.652  -2.436  -4.615
  477    HG   LEU  66           HG       LEU  66   9.709  -0.004  -4.783
  478   HD11  LEU  66          1HD1      LEU  66   7.621  -1.174  -5.550
  479   HD12  LEU  66          2HD1      LEU  66   7.377   0.512  -5.115
  480   HD13  LEU  66          3HD1      LEU  66   6.860  -0.751  -4.015
  481   HD21  LEU  66          3HD2      LEU  66   9.736   0.227  -2.080
  482   HD22  LEU  66          1HD2      LEU  66   8.010   0.509  -2.326
  483   HD23  LEU  66          2HD2      LEU  66   9.198   1.530  -3.122
  484    H    ALA  67           H        ALA  67   5.941  -2.539  -2.556
  485    HA   ALA  67           HA       ALA  67   5.343  -4.643  -4.571
  486    HB1  ALA  67           3HB      ALA  67   4.441  -4.888  -2.282
  487    HB2  ALA  67           1HB      ALA  67   3.151  -4.748  -3.478
  488    HB3  ALA  67           2HB      ALA  67   3.571  -3.367  -2.452
  489    H    ARG  68           H        ARG  68   3.739  -4.279  -6.129
  490    HA   ARG  68           HA       ARG  68   3.062  -1.432  -6.724
  491    HB2  ARG  68           1HB      ARG  68   5.015  -2.253  -8.119
  492    HB3  ARG  68           2HB      ARG  68   3.947  -3.457  -8.832
  493    HG2  ARG  68           1HG      ARG  68   2.443  -1.630  -9.636
  494    HG3  ARG  68           2HG      ARG  68   3.524  -0.432  -8.924
  495    HD2  ARG  68           1HD      ARG  68   3.986  -0.630 -11.314
  496    HD3  ARG  68           2HD      ARG  68   5.359  -1.272 -10.408
  497    HE   ARG  68           HE       ARG  68   3.569  -3.389 -10.960
  498   HH11  ARG  68          1HH2      ARG  68   5.691  -1.193 -12.617
  499   HH12  ARG  68          2HH2      ARG  68   6.055  -2.301 -13.897
  500   HH21  ARG  68          1HH1      ARG  68   4.044  -4.831 -12.637
  501   HH22  ARG  68          2HH1      ARG  68   5.123  -4.359 -13.908
  502    H    VAL  69           H        VAL  69   0.975  -1.169  -6.911
  503    HA   VAL  69           HA       VAL  69  -0.722  -3.304  -8.096
  504    HB   VAL  69           HB       VAL  69  -1.458  -1.787  -5.538
  505   HG11  VAL  69          1HG1      VAL  69  -3.428  -2.369  -6.919
  506   HG12  VAL  69          2HG1      VAL  69  -3.376  -3.428  -5.522
  507   HG13  VAL  69          3HG1      VAL  69  -2.853  -4.026  -7.088
  508   HG21  VAL  69          3HG2      VAL  69   0.317  -3.446  -5.088
  509   HG22  VAL  69          1HG2      VAL  69  -0.604  -4.689  -5.937
  510   HG23  VAL  69          2HG2      VAL  69  -1.212  -4.007  -4.429
  511    H    GLN  70           H        GLN  70  -2.174  -2.563  -9.494
  512    HA   GLN  70           HA       GLN  70  -2.394   0.381  -9.924
  513    HB2  GLN  70           1HB      GLN  70  -2.999  -1.978 -11.744
  514    HB3  GLN  70           2HB      GLN  70  -3.216  -0.280 -12.182
  515    HG2  GLN  70           1HG      GLN  70  -0.787   0.124 -11.797
  516    HG3  GLN  70           2HG      GLN  70  -0.573  -1.578 -11.394
  517   HE21  GLN  70          2HE2      GLN  70  -0.388   0.622 -13.956
  518   HE22  GLN  70          1HE2      GLN  70  -0.461  -0.482 -15.241
  519    H    TRP  71           H        TRP  71  -4.320   1.404  -9.814
  520    HA   TRP  71           HA       TRP  71  -6.820  -0.148  -9.499
  521    HB2  TRP  71           1HB      TRP  71  -5.954   0.384  -7.205
  522    HB3  TRP  71           2HB      TRP  71  -5.972   2.094  -7.606
  523    HD1  TRP  71           HD1      TRP  71  -8.552  -0.803  -7.916
  524    HE1  TRP  71           HE1      TRP  71 -10.831   0.059  -7.136
  525    HE3  TRP  71           HE3      TRP  71  -7.302   3.995  -6.692
  526    HZ2  TRP  71           HZ2      TRP  71 -11.997   2.469  -6.140
  527    HZ3  TRP  71           HZ3      TRP  71  -9.025   5.559  -5.838
  528    HH2  TRP  71           HH2      TRP  71 -11.370   4.800  -5.555
  529    H    LYS  72           H        LYS  72  -8.451   0.689 -10.589
  530    HA   LYS  72           HA       LYS  72  -8.057   3.159 -12.116
  531    HB2  LYS  72           1HB      LYS  72  -9.009   1.088 -13.160
  532    HB3  LYS  72           2HB      LYS  72 -10.427   1.231 -12.123
  533    HG2  LYS  72           1HG      LYS  72 -10.931   3.462 -13.100
  534    HG3  LYS  72           2HG      LYS  72  -9.485   3.353 -14.108
  535    HD2  LYS  72           1HD      LYS  72 -10.423   1.345 -15.231
  536    HD3  LYS  72           2HD      LYS  72 -11.872   1.465 -14.230
  537    HE2  LYS  72           1HE      LYS  72 -12.350   3.704 -15.183
  538    HE3  LYS  72           2HE      LYS  72 -10.897   3.588 -16.183
  539    HZ1  LYS  72           3HZ      LYS  72 -11.936   2.297 -17.635
  540    HZ2  LYS  72           1HZ      LYS  72 -13.387   2.702 -16.854
  541    HZ3  LYS  72           2HZ      LYS  72 -12.559   1.282 -16.423
  542    H    ALA  73           H        ALA  73  -8.783   5.085 -11.442
  543    HA   ALA  73           HA       ALA  73 -10.227   5.429  -8.990
  544    HB1  ALA  73           3HB      ALA  73 -10.257   7.828  -9.617
  545    HB2  ALA  73           1HB      ALA  73  -9.702   7.410 -11.244
  546    HB3  ALA  73           2HB      ALA  73  -8.656   7.127  -9.856
  547    H    THR  74           H        THR  74 -12.245   4.522  -8.978
  548    HA   THR  74           HA       THR  74 -14.208   5.189 -11.125
  549    HB   THR  74           HB       THR  74 -13.943   2.793 -10.756
  550    HG1  THR  74           HG1      THR  74 -16.011   3.130 -11.120
  551   HG21  THR  74          3HG2      THR  74 -14.597   3.354  -7.835
  552   HG22  THR  74          1HG2      THR  74 -13.017   2.871  -8.448
  553   HG23  THR  74          2HG2      THR  74 -14.382   1.766  -8.558
  554    H    ARG  75           H        ARG  75 -16.519   5.165 -10.110
  555    HA   ARG  75           HA       ARG  75 -16.755   6.494  -7.520
  556    HB2  ARG  75           1HB      ARG  75 -17.810   8.542  -8.488
  557    HB3  ARG  75           2HB      ARG  75 -16.110   8.391  -8.937
  558    HG2  ARG  75           1HG      ARG  75 -16.762   7.443 -11.139
  559    HG3  ARG  75           2HG      ARG  75 -18.464   7.590 -10.706
  560    HD2  ARG  75           1HD      ARG  75 -18.202  10.045 -10.484
  561    HD3  ARG  75           2HD      ARG  75 -16.503   9.901 -10.940
  562    HE   ARG  75           HE       ARG  75 -18.014   8.659 -12.950
  563   HH11  ARG  75          1HH2      ARG  75 -17.583  11.824 -11.574
  564   HH12  ARG  75          2HH2      ARG  75 -17.942  12.657 -13.050
  565   HH21  ARG  75          1HH1      ARG  75 -18.479   9.755 -14.872
  566   HH22  ARG  75          2HH1      ARG  75 -18.448  11.485 -14.914
  567    H    LYS  76           H        LYS  76 -19.068   7.114  -7.120
  568    HA   LYS  76           HA       LYS  76 -21.075   5.633  -8.667
  569    HB2  LYS  76           1HB      LYS  76 -20.130   3.958  -7.063
  570    HB3  LYS  76           2HB      LYS  76 -20.594   4.998  -5.718
  571    HG2  LYS  76           1HG      LYS  76 -22.981   4.830  -6.398
  572    HG3  LYS  76           2HG      LYS  76 -22.520   3.826  -7.778
  573    HD2  LYS  76           1HD      LYS  76 -21.628   2.105  -6.228
  574    HD3  LYS  76           2HD      LYS  76 -22.079   3.112  -4.847
  575    HE2  LYS  76           1HE      LYS  76 -23.801   1.387  -5.264
  576    HE3  LYS  76           2HE      LYS  76 -24.459   2.999  -5.547
  577    HZ1  LYS  76           3HZ      LYS  76 -24.892   1.200  -7.285
  578    HZ2  LYS  76           1HZ      LYS  76 -23.274   1.421  -7.746
  579    HZ3  LYS  76           2HZ      LYS  76 -24.368   2.719  -7.836
  580    H    LEU  77           H        LEU  77 -23.080   6.472  -8.483
  581    HA   LEU  77           HA       LEU  77 -23.357   9.097  -7.282
  582    HB2  LEU  77           1HB      LEU  77 -25.791   8.804  -8.155
  583    HB3  LEU  77           2HB      LEU  77 -24.513   8.871  -9.357
  584    HG   LEU  77           HG       LEU  77 -25.114   6.067  -8.389
  585   HD11  LEU  77          1HD1      LEU  77 -27.164   7.537 -10.077
  586   HD12  LEU  77          2HD1      LEU  77 -27.405   6.949  -8.430
  587   HD13  LEU  77          3HD1      LEU  77 -27.147   5.803  -9.742
  588   HD21  LEU  77          3HD2      LEU  77 -23.546   6.588 -10.280
  589   HD22  LEU  77          1HD2      LEU  77 -24.906   7.233 -11.198
  590   HD23  LEU  77          2HD2      LEU  77 -24.867   5.525 -10.758
  591    H    ALA  78           H        ALA  78 -23.531   9.174  -5.107
  592    HA   ALA  78           HA       ALA  78 -25.844   8.097  -3.770
  593    HB1  ALA  78           3HB      ALA  78 -23.137   6.884  -3.063
  594    HB2  ALA  78           1HB      ALA  78 -24.468   6.036  -3.846
  595    HB3  ALA  78           2HB      ALA  78 -24.646   6.610  -2.191
  596    H    GLY  79           H        GLY  79 -26.276  10.026  -2.833
  597    HA2  GLY  79           1HA      GLY  79 -26.156  11.740  -1.321
  598    HA3  GLY  79           2HA      GLY  79 -24.817  10.895  -0.549
  599    H    ARG  80           H        ARG  80 -25.694  13.566  -2.446
  600    HA   ARG  80           HA       ARG  80 -23.310  14.033  -3.915
  601    HB2  ARG  80           1HB      ARG  80 -25.472  15.205  -4.341
  602    HB3  ARG  80           2HB      ARG  80 -25.291  16.087  -2.826
  603    HG2  ARG  80           1HG      ARG  80 -23.177  17.109  -3.667
  604    HG3  ARG  80           2HG      ARG  80 -23.342  16.205  -5.173
  605    HD2  ARG  80           1HD      ARG  80 -25.348  18.240  -4.130
  606    HD3  ARG  80           2HD      ARG  80 -24.148  18.560  -5.382
  607    HE   ARG  80           HE       ARG  80 -26.643  17.156  -5.710
  608   HH11  ARG  80          1HH2      ARG  80 -23.360  17.353  -6.850
  609   HH12  ARG  80          2HH2      ARG  80 -23.725  16.689  -8.407
  610   HH21  ARG  80          1HH1      ARG  80 -27.101  16.288  -7.752
  611   HH22  ARG  80          2HH1      ARG  80 -25.834  16.091  -8.916
  612    H    ALA  81           H        ALA  81 -21.443  15.101  -3.389
  613    HA   ALA  81           HA       ALA  81 -21.085  16.478  -0.841
  614    HB1  ALA  81           3HB      ALA  81 -19.563  13.904  -1.426
  615    HB2  ALA  81           1HB      ALA  81 -20.801  14.102  -0.185
  616    HB3  ALA  81           2HB      ALA  81 -19.279  14.982  -0.057
  617    H    ALA  82           H        ALA  82 -19.123  17.634  -0.732
  618    HA   ALA  82           HA       ALA  82 -18.176  18.641  -3.230
  619    HB1  ALA  82           3HB      ALA  82 -17.023  18.966  -0.431
  620    HB2  ALA  82           1HB      ALA  82 -18.237  20.007  -1.171
  621    HB3  ALA  82           2HB      ALA  82 -16.603  19.953  -1.835
  622    H    ASN  83           H        ASN  83 -16.082  17.341  -0.665
  623    HA   ASN  83           HA       ASN  83 -14.141  16.463  -2.593
  624    HB2  ASN  83           1HB      ASN  83 -12.926  15.609  -0.545
  625    HB3  ASN  83           2HB      ASN  83 -13.351  17.321  -0.481
  626   HD21  ASN  83          2HD2      ASN  83 -14.520  14.100   0.610
  627   HD22  ASN  83          1HD2      ASN  83 -15.306  14.699   1.991
  628    HA   PRO  84           HA       PRO  84 -15.838  12.299  -2.972
  629    HB2  PRO  84           1HB      PRO  84 -13.763  10.931  -4.064
  630    HB3  PRO  84           2HB      PRO  84 -14.540  12.263  -4.958
  631    HG2  PRO  84           1HG      PRO  84 -12.044  12.379  -3.249
  632    HG3  PRO  84           2HG      PRO  84 -12.257  12.917  -4.931
  633    HD2  PRO  84           1HD      PRO  84 -12.452  14.696  -2.875
  634    HD3  PRO  84           2HD      PRO  84 -13.517  14.837  -4.299
  635    H    GLY  85           H        GLY  85 -12.685  12.668  -1.374
  636    HA2  GLY  85           1HA      GLY  85 -11.779  11.666   0.502
  637    HA3  GLY  85           2HA      GLY  85 -13.428  11.274   0.978
  638    H    VAL  86           H        VAL  86 -10.710  10.206  -1.013
  639    HA   VAL  86           HA       VAL  86 -11.671   7.372  -0.853
  640    HB   VAL  86           HB       VAL  86 -10.278   7.092  -2.993
  641   HG11  VAL  86          1HG1      VAL  86 -12.755   7.126  -3.034
  642   HG12  VAL  86          2HG1      VAL  86 -12.102   7.939  -4.454
  643   HG13  VAL  86          3HG1      VAL  86 -12.737   8.888  -3.107
  644   HG21  VAL  86          3HG2      VAL  86 -10.541  10.142  -3.070
  645   HG22  VAL  86          1HG2      VAL  86  -9.873   9.118  -4.337
  646   HG23  VAL  86          2HG2      VAL  86  -9.033   9.276  -2.802
  647    HA   PRO  87           HA       PRO  87  -7.527   7.977   1.353
  648    HB2  PRO  87           1HB      PRO  87  -8.213   6.631   3.691
  649    HB3  PRO  87           2HB      PRO  87  -8.534   8.362   3.448
  650    HG2  PRO  87           1HG      PRO  87 -10.406   6.049   2.932
  651    HG3  PRO  87           2HG      PRO  87 -10.700   7.503   3.921
  652    HD2  PRO  87           1HD      PRO  87 -11.618   7.454   1.441
  653    HD3  PRO  87           2HD      PRO  87 -10.782   8.925   1.979
  654    H    VAL  88           H        VAL  88  -5.937   6.421   1.468
  655    HA   VAL  88           HA       VAL  88  -6.635   3.688   0.484
  656    HB   VAL  88           HB       VAL  88  -3.981   5.189   0.280
  657   HG11  VAL  88          1HG1      VAL  88  -3.752   2.708   0.252
  658   HG12  VAL  88          2HG1      VAL  88  -3.435   3.378  -1.333
  659   HG13  VAL  88          3HG1      VAL  88  -4.980   2.602  -1.011
  660   HG21  VAL  88          3HG2      VAL  88  -4.607   5.428  -2.134
  661   HG22  VAL  88          1HG2      VAL  88  -5.721   6.295  -1.086
  662   HG23  VAL  88          2HG2      VAL  88  -6.193   4.745  -1.787
  663    H    TYR  89           H        TYR  89  -5.900   1.938   1.544
  664    HA   TYR  89           HA       TYR  89  -4.260   2.252   4.022
  665    HB2  TYR  89           1HB      TYR  89  -6.834   0.650   3.718
  666    HB3  TYR  89           2HB      TYR  89  -5.762   0.569   5.114
  667    HD1  TYR  89           HD1      TYR  89  -5.283   2.674   6.468
  668    HD2  TYR  89           HD2      TYR  89  -8.438   2.517   3.530
  669    HE1  TYR  89           HE1      TYR  89  -6.330   4.682   7.470
  670    HE2  TYR  89           HE2      TYR  89  -9.474   4.513   4.564
  671    HH   TYR  89           HH       TYR  89  -8.873   5.593   7.513
  672    H    ALA  90           H        ALA  90  -3.062   0.486   4.585
  673    HA   ALA  90           HA       ALA  90  -2.919  -1.845   2.767
  674    HB1  ALA  90           3HB      ALA  90  -1.364  -0.155   1.826
  675    HB2  ALA  90           1HB      ALA  90  -0.484  -1.545   2.461
  676    HB3  ALA  90           2HB      ALA  90  -0.546  -0.031   3.375
  677    H    VAL  91           H        VAL  91  -2.294  -3.666   3.774
  678    HA   VAL  91           HA       VAL  91  -1.262  -3.537   6.567
  679    HB   VAL  91           HB       VAL  91  -3.495  -5.373   5.559
  680   HG11  VAL  91          1HG1      VAL  91  -2.137  -6.488   7.292
  681   HG12  VAL  91          2HG1      VAL  91  -3.650  -5.974   8.025
  682   HG13  VAL  91          3HG1      VAL  91  -2.177  -5.045   8.304
  683   HG21  VAL  91          3HG2      VAL  91  -4.917  -4.064   7.154
  684   HG22  VAL  91          1HG2      VAL  91  -4.293  -3.053   5.850
  685   HG23  VAL  91          2HG2      VAL  91  -3.563  -2.975   7.456
  686    H    VAL  92           H        VAL  92   0.193  -5.052   7.090
  687    HA   VAL  92           HA       VAL  92   1.270  -6.776   4.929
  688    HB   VAL  92           HB       VAL  92   3.276  -6.908   6.518
  689   HG11  VAL  92          1HG1      VAL  92   2.425  -4.127   5.600
  690   HG12  VAL  92          2HG1      VAL  92   3.244  -5.338   4.613
  691   HG13  VAL  92          3HG1      VAL  92   4.079  -4.615   5.986
  692   HG21  VAL  92          3HG2      VAL  92   1.775  -4.696   7.995
  693   HG22  VAL  92          1HG2      VAL  92   3.411  -5.249   8.335
  694   HG23  VAL  92          2HG2      VAL  92   2.050  -6.321   8.609
  695    H    ASP  93           H        ASP  93   1.285  -8.927   5.082
  696    HA   ASP  93           HA       ASP  93  -0.500 -10.349   6.529
  697    HB2  ASP  93           1HB      ASP  93   0.911 -12.371   6.023
  698    HB3  ASP  93           2HB      ASP  93   0.671 -11.298   4.641
  699    HA   PRO  94           HA       PRO  94   1.194 -10.385  10.700
  700    HB2  PRO  94           1HB      PRO  94  -0.188 -12.412  11.875
  701    HB3  PRO  94           2HB      PRO  94  -1.035 -10.960  11.283
  702    HG2  PRO  94           1HG      PRO  94  -0.655 -13.600   9.847
  703    HG3  PRO  94           2HG      PRO  94  -2.177 -12.726  10.164
  704    HD2  PRO  94           1HD      PRO  94  -0.906 -12.442   7.780
  705    HD3  PRO  94           2HD      PRO  94  -1.695 -11.042   8.549
  706    H    ASP  95           H        ASP  95   2.942 -11.254  11.737
  707    HA   ASP  95           HA       ASP  95   4.499 -13.307  10.435
  708    HB2  ASP  95           1HB      ASP  95   4.860 -11.871  13.095
  709    HB3  ASP  95           2HB      ASP  95   6.072 -12.898  12.327
  710    H    ASN  96           H        ASN  96   2.628 -13.084  13.447
  711    HA   ASN  96           HA       ASN  96   1.986 -15.873  13.473
  712    HB2  ASN  96           1HB      ASN  96   3.274 -16.458  15.559
  713    HB3  ASN  96           2HB      ASN  96   4.320 -16.159  14.178
  714   HD21  ASN  96          2HD2      ASN  96   3.706 -15.208  17.420
  715   HD22  ASN  96          1HD2      ASN  96   4.715 -13.843  17.442
  716    H    ARG  97           H        ARG  97  -0.008 -14.544  13.614
  717    HA   ARG  97           HA       ARG  97  -1.783 -13.631  14.757
  718    HB2  ARG  97           1HB      ARG  97  -0.591 -15.302  17.003
  719    HB3  ARG  97           2HB      ARG  97  -2.242 -14.670  16.965
  720    HG2  ARG  97           1HG      ARG  97  -2.699 -15.975  14.898
  721    HG3  ARG  97           2HG      ARG  97  -1.051 -16.614  14.938
  722    HD2  ARG  97           1HD      ARG  97  -3.121 -17.010  17.137
  723    HD3  ARG  97           2HD      ARG  97  -2.694 -18.212  15.917
  724    HE   ARG  97           HE       ARG  97  -0.317 -17.395  17.176
  725   HH11  ARG  97          1HH2      ARG  97  -3.270 -19.071  17.926
  726   HH12  ARG  97          2HH2      ARG  97  -2.555 -20.042  19.171
  727   HH21  ARG  97          1HH1      ARG  97   0.607 -18.662  18.806
  728   HH22  ARG  97          2HH1      ARG  97  -0.364 -19.811  19.667
  729    H    VAL  98           H        VAL  98  -0.196 -11.651  14.517
  730    HA   VAL  98           HA       VAL  98   1.025 -10.570  16.854
  731    HB   VAL  98           HB       VAL  98   1.656  -9.907  14.562
  732   HG11  VAL  98          1HG1      VAL  98  -0.595 -10.008  13.531
  733   HG12  VAL  98          2HG1      VAL  98   0.189  -8.465  13.205
  734   HG13  VAL  98          3HG1      VAL  98  -1.076  -8.569  14.421
  735   HG21  VAL  98          3HG2      VAL  98   1.804  -7.478  14.922
  736   HG22  VAL  98          1HG2      VAL  98   2.061  -8.311  16.452
  737   HG23  VAL  98          2HG2      VAL  98   0.517  -7.536  16.115
  738    H    ALA  99           H        ALA  99   0.291  -9.001  18.278
  739    HA   ALA  99           HA       ALA  99  -2.487  -9.066  18.969
  740    HB1  ALA  99           3HB      ALA  99  -0.688  -8.783  20.646
  741    HB2  ALA  99           1HB      ALA  99  -1.836  -7.445  20.718
  742    HB3  ALA  99           2HB      ALA  99  -0.265  -7.224  19.941
  743    H    GLU 100           H        GLU 100  -3.897  -7.213  19.098
  744    HA   GLU 100           HA       GLU 100  -4.043  -5.759  16.650
  745    HB2  GLU 100           1HB      GLU 100  -6.013  -6.398  18.100
  746    HB3  GLU 100           2HB      GLU 100  -5.511  -5.177  19.263
  747    HG2  GLU 100           1HG      GLU 100  -7.254  -4.219  17.843
  748    HG3  GLU 100           2HG      GLU 100  -5.741  -3.423  17.442
  749    H    SER 101           H        SER 101  -3.711  -4.452  19.964
  750    HA   SER 101           HA       SER 101  -3.084  -1.837  19.446
  751    HB2  SER 101           1HB      SER 101  -1.857  -1.809  21.573
  752    HB3  SER 101           2HB      SER 101  -3.278  -2.841  21.718
  753    HG   SER 101           HG       SER 101  -1.318  -3.785  22.539
  754    H    ASP 102           H        ASP 102  -0.863  -4.591  19.226
  755    HA   ASP 102           HA       ASP 102   1.476  -3.025  18.615
  756    HB2  ASP 102           1HB      ASP 102   1.593  -5.325  19.545
  757    HB3  ASP 102           2HB      ASP 102   0.881  -5.963  18.067
  758    H    LYS 103           H        LYS 103  -0.615  -5.129  16.586
  759    HA   LYS 103           HA       LYS 103   0.454  -4.687  14.101
  760    HB2  LYS 103           1HB      LYS 103  -1.489  -6.173  14.592
  761    HB3  LYS 103           2HB      LYS 103  -2.533  -4.764  14.715
  762    HG2  LYS 103           1HG      LYS 103  -2.034  -4.178  12.351
  763    HG3  LYS 103           2HG      LYS 103  -0.948  -5.564  12.239
  764    HD2  LYS 103           1HD      LYS 103  -2.860  -7.091  12.673
  765    HD3  LYS 103           2HD      LYS 103  -3.943  -5.701  12.782
  766    HE2  LYS 103           1HE      LYS 103  -3.398  -5.087  10.451
  767    HE3  LYS 103           2HE      LYS 103  -2.302  -6.467  10.338
  768    HZ1  LYS 103           3HZ      LYS 103  -4.460  -7.715  11.141
  769    HZ2  LYS 103           1HZ      LYS 103  -4.171  -7.403   9.500
  770    HZ3  LYS 103           2HZ      LYS 103  -5.224  -6.402  10.381
  771    H    ALA 104           H        ALA 104  -1.667  -2.509  15.893
  772    HA   ALA 104           HA       ALA 104  -2.165  -0.566  13.915
  773    HB1  ALA 104           3HB      ALA 104  -1.773  -0.131  16.896
  774    HB2  ALA 104           1HB      ALA 104  -3.282  -0.614  16.126
  775    HB3  ALA 104           2HB      ALA 104  -2.589   0.974  15.790
  776    H    ASN 105           H        ASN 105   0.813  -1.572  14.805
  777    HA   ASN 105           HA       ASN 105   2.202   1.043  14.754
  778    HB2  ASN 105           1HB      ASN 105   3.265  -1.797  15.019
  779    HB3  ASN 105           2HB      ASN 105   4.245  -0.336  15.092
  780   HD21  ASN 105          2HD2      ASN 105   3.791  -2.351  17.259
  781   HD22  ASN 105          1HD2      ASN 105   3.143  -1.476  18.562
  782    H    ASN 106           H        ASN 106   1.661  -1.815  12.715
  783    HA   ASN 106           HA       ASN 106   3.397  -0.765  10.558
  784    HB2  ASN 106           1HB      ASN 106   1.813  -3.361  10.804
  785    HB3  ASN 106           2HB      ASN 106   2.941  -2.965   9.503
  786   HD21  ASN 106          2HD2      ASN 106   3.011  -5.094  11.740
  787   HD22  ASN 106          1HD2      ASN 106   4.540  -4.884  12.446
  788    H    VAL 107           H        VAL 107   0.975   0.683  11.270
  789    HA   VAL 107           HA       VAL 107  -0.811   0.196   8.928
  790    HB   VAL 107           HB       VAL 107  -1.853   0.263  11.209
  791   HG11  VAL 107          1HG1      VAL 107  -1.930   2.300  12.526
  792   HG12  VAL 107          2HG1      VAL 107  -1.168   3.243  11.247
  793   HG13  VAL 107          3HG1      VAL 107  -0.234   2.040  12.123
  794   HG21  VAL 107          3HG2      VAL 107  -3.155   0.904   9.170
  795   HG22  VAL 107          1HG2      VAL 107  -2.669   2.584   9.389
  796   HG23  VAL 107          2HG2      VAL 107  -3.697   1.801  10.584
  797    H    PHE 108           H        PHE 108  -1.002   1.688   7.350
  798    HA   PHE 108           HA       PHE 108   0.115   4.404   7.685
  799    HB2  PHE 108           1HB      PHE 108   0.980   2.574   5.399
  800    HB3  PHE 108           2HB      PHE 108   1.501   4.233   5.678
  801    HD1  PHE 108           HD2      PHE 108   2.503   4.721   8.115
  802    HD2  PHE 108           HD1      PHE 108   2.437   0.826   6.244
  803    HE1  PHE 108           HE2      PHE 108   4.307   3.953   9.622
  804    HE2  PHE 108           HE1      PHE 108   4.239   0.080   7.765
  805    HZ   PHE 108           HZ       PHE 108   5.176   1.637   9.452
  806    H    SER 109           H        SER 109  -0.741   5.906   6.302
  807    HA   SER 109           HA       SER 109  -2.479   5.215   4.096
  808    HB2  SER 109           1HB      SER 109  -4.561   6.065   5.076
  809    HB3  SER 109           2HB      SER 109  -3.951   4.740   6.066
  810    HG   SER 109           HG       SER 109  -3.914   7.516   6.545
  811    H    ARG 110           H        ARG 110  -3.032   7.018   2.873
  812    HA   ARG 110           HA       ARG 110  -1.994   9.680   3.760
  813    HB2  ARG 110           1HB      ARG 110  -0.320   8.540   2.269
  814    HB3  ARG 110           2HB      ARG 110  -1.538   8.447   1.001
  815    HG2  ARG 110           1HG      ARG 110  -1.728  10.951   1.027
  816    HG3  ARG 110           2HG      ARG 110  -0.491  11.014   2.278
  817    HD2  ARG 110           1HD      ARG 110   1.096   9.880   0.689
  818    HD3  ARG 110           2HD      ARG 110  -0.154   9.984  -0.562
  819    HE   ARG 110           HE       ARG 110   0.250  12.556   0.556
  820   HH11  ARG 110          1HH2      ARG 110   1.884  10.194  -1.396
  821   HH12  ARG 110          2HH2      ARG 110   2.820  11.364  -2.262
  822   HH21  ARG 110          1HH1      ARG 110   1.481  14.079  -0.570
  823   HH22  ARG 110          2HH1      ARG 110   2.592  13.563  -1.795
  824    H    ILE 111           H        ILE 111  -3.477  11.190   3.549
  825    HA   ILE 111           HA       ILE 111  -5.973  10.670   2.106
  826    HB   ILE 111           HB       ILE 111  -5.142  13.232   3.568
  827   HG12  ILE 111          1HG1      ILE 111  -4.811  11.384   5.149
  828   HG13  ILE 111          2HG1      ILE 111  -6.265  12.262   5.593
  829   HG21  ILE 111          1HG2      ILE 111  -7.587  13.507   3.851
  830   HG22  ILE 111          2HG2      ILE 111  -7.879  12.004   2.977
  831   HG23  ILE 111          3HG2      ILE 111  -7.170  13.386   2.143
  832   HD11  ILE 111          3HD1      ILE 111  -6.043   9.541   4.279
  833   HD12  ILE 111          1HD1      ILE 111  -7.562  10.441   4.280
  834   HD13  ILE 111          2HD1      ILE 111  -6.820   9.962   5.798
  835    H    VAL 112           H        VAL 112  -5.656  10.801  -0.066
  836    HA   VAL 112           HA       VAL 112  -4.063  12.958  -1.259
  837    HB   VAL 112           HB       VAL 112  -4.635  11.809  -3.416
  838   HG11  VAL 112          1HG1      VAL 112  -3.622   9.942  -1.221
  839   HG12  VAL 112          2HG1      VAL 112  -2.637  11.108  -2.106
  840   HG13  VAL 112          3HG1      VAL 112  -3.349   9.737  -2.953
  841   HG21  VAL 112          3HG2      VAL 112  -6.134   9.864  -1.597
  842   HG22  VAL 112          1HG2      VAL 112  -5.837   9.633  -3.316
  843   HG23  VAL 112          2HG2      VAL 112  -6.880  10.938  -2.776
  844    H    LYS 113           H        LYS 113  -4.869  14.617  -2.483
  845    HA   LYS 113           HA       LYS 113  -7.820  15.081  -2.389
  846    HB2  LYS 113           1HB      LYS 113  -6.493  16.564  -0.875
  847    HB3  LYS 113           2HB      LYS 113  -5.607  17.175  -2.264
  848    HG2  LYS 113           1HG      LYS 113  -7.678  18.045  -3.267
  849    HG3  LYS 113           2HG      LYS 113  -8.656  17.332  -1.992
  850    HD2  LYS 113           1HD      LYS 113  -6.467  19.336  -1.267
  851    HD3  LYS 113           2HD      LYS 113  -8.018  19.914  -1.866
  852    HE2  LYS 113           1HE      LYS 113  -7.674  18.117   0.570
  853    HE3  LYS 113           2HE      LYS 113  -7.984  19.849   0.609
  854    HZ1  LYS 113           3HZ      LYS 113 -10.114  19.240   0.634
  855    HZ2  LYS 113           1HZ      LYS 113  -9.792  17.670   0.081
  856    HZ3  LYS 113           2HZ      LYS 113  -9.920  18.951  -1.028
  857    H    VAL 114           H        VAL 114  -8.797  15.468  -4.246
  858    HA   VAL 114           HA       VAL 114  -7.190  15.984  -6.718
  859    HB   VAL 114           HB       VAL 114  -8.913  14.646  -7.925
  860   HG11  VAL 114          1HG1      VAL 114  -7.570  13.180  -5.605
  861   HG12  VAL 114          2HG1      VAL 114  -6.811  13.571  -7.151
  862   HG13  VAL 114          3HG1      VAL 114  -8.150  12.428  -7.094
  863   HG21  VAL 114          3HG2      VAL 114 -10.827  14.906  -6.379
  864   HG22  VAL 114          1HG2      VAL 114  -9.954  14.050  -5.109
  865   HG23  VAL 114          2HG2      VAL 114 -10.455  13.209  -6.566
  866    H    LEU 115           H        LEU 115  -7.795  17.612  -7.959
  867    HA   LEU 115           HA       LEU 115  -9.858  19.442  -6.985
  868    HB2  LEU 115           1HB      LEU 115  -7.720  19.542  -9.144
  869    HB3  LEU 115           2HB      LEU 115  -8.985  20.769  -9.098
  870    HG   LEU 115           HG       LEU 115  -8.337  21.379  -6.772
  871   HD11  LEU 115          1HD1      LEU 115  -7.483  19.317  -5.878
  872   HD12  LEU 115          2HD1      LEU 115  -6.142  20.447  -5.872
  873   HD13  LEU 115          3HD1      LEU 115  -6.233  19.200  -7.118
  874   HD21  LEU 115          3HD2      LEU 115  -6.168  22.431  -7.324
  875   HD22  LEU 115          1HD2      LEU 115  -7.285  22.549  -8.684
  876   HD23  LEU 115          2HD2      LEU 115  -5.984  21.353  -8.711
  877    H    GLU 116           H        GLU 116 -11.854  19.605  -7.771
  878    HA   GLU 116           HA       GLU 116 -12.957  17.699  -9.548
  879    HB2  GLU 116           1HB      GLU 116 -14.994  19.156  -9.448
  880    HB3  GLU 116           2HB      GLU 116 -14.325  18.798  -7.854
  881    HG2  GLU 116           1HG      GLU 116 -13.167  21.004  -7.845
  882    HG3  GLU 116           2HG      GLU 116 -13.865  21.372  -9.420
  883    H    HIS 117           H        HIS 117 -13.528  17.819 -11.705
  884    HA   HIS 117           HA       HIS 117 -11.911  19.488 -13.386
  885    HB2  HIS 117           1HB      HIS 117 -12.641  17.190 -14.018
  886    HB3  HIS 117           2HB      HIS 117 -14.305  17.752 -14.141
  887    HD1  HIS 117           HD1      HIS 117 -14.927  18.278 -16.495
  888    HD2  HIS 117           HD2      HIS 117 -10.898  19.073 -15.785
  889    HE1  HIS 117           HE1      HIS 117 -13.977  19.161 -18.671
  890    HE2  HIS 117           HE2      HIS 117 -11.519  19.651 -18.254
  891    H    HIS 118           H        HIS 118 -12.330  21.642 -13.400
  892    HA   HIS 118           HA       HIS 118 -14.874  22.835 -12.989
  893    HB2  HIS 118           1HB      HIS 118 -12.372  23.971 -14.314
  894    HB3  HIS 118           2HB      HIS 118 -13.744  24.918 -13.728
  895    HD1  HIS 118           HD1      HIS 118 -14.268  24.549 -11.050
  896    HD2  HIS 118           HD2      HIS 118 -10.453  23.519 -12.377
  897    HE1  HIS 118           HE1      HIS 118 -12.796  24.454  -8.990
  898    HE2  HIS 118           HE2      HIS 118 -10.465  23.828  -9.784
  899    H    HIS 119           H        HIS 119 -16.475  23.318 -14.386
  900    HA   HIS 119           HA       HIS 119 -16.112  23.650 -17.217
  901    HB2  HIS 119           1HB      HIS 119 -15.941  21.160 -17.062
  902    HB3  HIS 119           2HB      HIS 119 -17.523  21.104 -16.293
  903    HD1  HIS 119           HD1      HIS 119 -15.896  22.147 -19.574
  904    HD2  HIS 119           HD2      HIS 119 -19.669  21.155 -18.099
  905    HE1  HIS 119           HE1      HIS 119 -17.442  22.034 -21.577
  906    HE2  HIS 119           HE2      HIS 119 -19.745  21.431 -20.695
  907    H    HIS 120           H        HIS 120 -18.391  22.870 -14.594
  908    HA   HIS 120           HA       HIS 120 -20.495  23.615 -14.115
  909    HB2  HIS 120           1HB      HIS 120 -19.203  25.738 -13.893
  910    HB3  HIS 120           2HB      HIS 120 -19.547  26.117 -15.577
  911    HD1  HIS 120           HD1      HIS 120 -21.748  27.253 -16.055
  912    HD2  HIS 120           HD2      HIS 120 -21.660  25.569 -12.243
  913    HE1  HIS 120           HE1      HIS 120 -23.881  27.981 -14.900
  914    HE2  HIS 120           HE2      HIS 120 -23.843  26.963 -12.574
  915    H    HIS 121           H        HIS 121 -21.877  22.318 -15.281
  916    HA   HIS 121           HA       HIS 121 -22.247  22.273 -18.058
  917    HB2  HIS 121           1HB      HIS 121 -24.268  21.636 -15.871
  918    HB3  HIS 121           2HB      HIS 121 -24.379  21.111 -17.552
  919    HD1  HIS 121           HD1      HIS 121 -22.254  20.633 -14.447
  920    HD2  HIS 121           HD2      HIS 121 -22.796  18.877 -18.189
  921    HE1  HIS 121           HE1      HIS 121 -20.935  18.469 -14.423
  922    HE2  HIS 121           HE2      HIS 121 -21.257  17.388 -16.697
  923    H    HIS 122           H        HIS 122 -22.924  23.873 -19.351
  924    HA   HIS 122           HA       HIS 122 -24.150  26.274 -18.478
  925    HB2  HIS 122           1HB      HIS 122 -24.444  26.701 -20.932
  926    HB3  HIS 122           2HB      HIS 122 -22.809  26.184 -20.523
  927    HD1  HIS 122           HD1      HIS 122 -25.783  25.211 -22.490
  928    HD2  HIS 122           HD2      HIS 122 -22.249  23.409 -21.208
  929    HE1  HIS 122           HE1      HIS 122 -25.520  23.097 -23.861
  930    HE2  HIS 122           HE2      HIS 122 -23.369  21.987 -23.090
  Start of MODEL    4
    1    H1   MET   1           1H       MET   1  13.022  10.124   0.455
    2    H2   MET   1           2H       MET   1  14.465   9.767   1.279
    3    H3   MET   1           3H       MET   1  13.280  10.738   2.015
    4    HA   MET   1           HA       MET   1  13.265   7.825   1.548
    5    HB2  MET   1           1HB      MET   1  12.587   9.642   3.903
    6    HB3  MET   1           2HB      MET   1  12.478   7.882   3.939
    7    HG2  MET   1           1HG      MET   1  14.905   7.717   3.467
    8    HG3  MET   1           2HG      MET   1  15.018   9.478   3.430
    9    HE1  MET   1           3HE      MET   1  16.942   8.023   5.173
   10    HE2  MET   1           1HE      MET   1  16.823   8.865   6.725
   11    HE3  MET   1           2HE      MET   1  16.761   9.774   5.216
   12    H    ASP   2           H        ASP   2  11.306  10.733   1.669
   13    HA   ASP   2           HA       ASP   2   9.086  11.146   1.280
   14    HB2  ASP   2           1HB      ASP   2   9.278   8.573  -0.336
   15    HB3  ASP   2           2HB      ASP   2   8.012   9.783  -0.481
   16    H    LEU   3           H        LEU   3   6.774   9.998   1.352
   17    HA   LEU   3           HA       LEU   3   6.559   8.892   3.990
   18    HB2  LEU   3           1HB      LEU   3   4.596   9.627   1.823
   19    HB3  LEU   3           2HB      LEU   3   4.011   8.651   3.168
   20    HG   LEU   3           HG       LEU   3   4.769  10.400   4.772
   21   HD11  LEU   3          1HD1      LEU   3   6.650  11.386   3.602
   22   HD12  LEU   3          2HD1      LEU   3   5.457  12.657   3.832
   23   HD13  LEU   3          3HD1      LEU   3   5.627  11.886   2.254
   24   HD21  LEU   3          3HD2      LEU   3   3.029  11.502   2.525
   25   HD22  LEU   3          1HD2      LEU   3   3.078  12.115   4.180
   26   HD23  LEU   3          2HD2      LEU   3   2.460  10.496   3.859
   27    HA   PRO   4           HA       PRO   4   6.778   4.480   3.290
   28    HB2  PRO   4           1HB      PRO   4   4.062   4.255   4.650
   29    HB3  PRO   4           2HB      PRO   4   5.540   3.306   4.951
   30    HG2  PRO   4           1HG      PRO   4   4.899   5.238   6.626
   31    HG3  PRO   4           2HG      PRO   4   6.583   5.085   6.091
   32    HD2  PRO   4           1HD      PRO   4   4.489   7.081   5.153
   33    HD3  PRO   4           2HD      PRO   4   6.205   7.331   5.526
   34    H    ILE   5           H        ILE   5   3.831   6.157   2.453
   35    HA   ILE   5           HA       ILE   5   3.139   4.118   0.373
   36    HB   ILE   5           HB       ILE   5   1.381   6.238   1.677
   37   HG12  ILE   5          1HG1      ILE   5   1.294   3.187   2.002
   38   HG13  ILE   5          2HG1      ILE   5   2.078   4.249   3.162
   39   HG21  ILE   5          1HG2      ILE   5   0.621   5.767  -0.627
   40   HG22  ILE   5          2HG2      ILE   5  -0.473   4.961   0.483
   41   HG23  ILE   5          3HG2      ILE   5   0.763   4.030  -0.355
   42   HD11  ILE   5          3HD1      ILE   5  -0.266   3.596   3.768
   43   HD12  ILE   5          1HD1      ILE   5  -0.845   4.536   2.401
   44   HD13  ILE   5          2HD1      ILE   5   0.026   5.332   3.715
   45    H    THR   6           H        THR   6   3.204   4.675  -1.703
   46    HA   THR   6           HA       THR   6   3.246   7.522  -2.544
   47    HB   THR   6           HB       THR   6   5.223   7.187  -3.948
   48    HG1  THR   6           HG1      THR   6   4.810   4.567  -3.190
   49   HG21  THR   6          3HG2      THR   6   5.913   6.148  -1.175
   50   HG22  THR   6          1HG2      THR   6   5.510   7.840  -1.477
   51   HG23  THR   6          2HG2      THR   6   6.932   7.120  -2.233
   52    H    LEU   7           H        LEU   7   2.224   7.867  -4.433
   53    HA   LEU   7           HA       LEU   7   1.506   5.573  -6.190
   54    HB2  LEU   7           1HB      LEU   7  -0.808   6.702  -6.429
   55    HB3  LEU   7           2HB      LEU   7  -0.519   5.823  -4.938
   56    HG   LEU   7           HG       LEU   7   0.233   8.761  -4.847
   57   HD11  LEU   7          1HD1      LEU   7  -2.117   9.487  -4.450
   58   HD12  LEU   7          2HD1      LEU   7  -2.675   7.883  -4.930
   59   HD13  LEU   7          3HD1      LEU   7  -1.870   8.923  -6.102
   60   HD21  LEU   7          3HD2      LEU   7  -0.695   8.591  -2.578
   61   HD22  LEU   7          1HD2      LEU   7   0.380   7.222  -2.860
   62   HD23  LEU   7          2HD2      LEU   7  -1.365   6.997  -2.934
   63    H    SER   8           H        SER   8   0.928   6.161  -8.332
   64    HA   SER   8           HA       SER   8   2.509   8.381  -9.373
   65    HB2  SER   8           1HB      SER   8   0.832   6.261 -10.767
   66    HB3  SER   8           2HB      SER   8   1.913   7.402 -11.569
   67    HG   SER   8           HG       SER   8   3.611   6.348 -10.801
   68    H    LYS   9           H        LYS   9   1.614  10.363  -9.390
   69    HA   LYS   9           HA       LYS   9  -1.093  10.784 -10.492
   70    HB2  LYS   9           1HB      LYS   9  -1.642  12.315  -8.566
   71    HB3  LYS   9           2HB      LYS   9  -1.534  10.614  -8.107
   72    HG2  LYS   9           1HG      LYS   9   0.740  10.943  -7.232
   73    HG3  LYS   9           2HG      LYS   9   0.735  12.625  -7.755
   74    HD2  LYS   9           1HD      LYS   9  -1.150  13.109  -6.217
   75    HD3  LYS   9           2HD      LYS   9  -1.167  11.423  -5.699
   76    HE2  LYS   9           1HE      LYS   9   0.080  12.848  -4.084
   77    HE3  LYS   9           2HE      LYS   9   1.143  11.656  -4.832
   78    HZ1  LYS   9           3HZ      LYS   9   2.338  13.244  -5.803
   79    HZ2  LYS   9           1HZ      LYS   9   1.569  14.339  -4.760
   80    HZ3  LYS   9           2HZ      LYS   9   0.966  14.095  -6.330
   81    H    GLU  10           H        GLU  10   1.087  11.255 -11.934
   82    HA   GLU  10           HA       GLU  10   2.396  13.725 -11.650
   83    HB2  GLU  10           1HB      GLU  10   3.003  11.885 -13.267
   84    HB3  GLU  10           2HB      GLU  10   1.631  12.351 -14.263
   85    HG2  GLU  10           1HG      GLU  10   3.663  13.367 -15.179
   86    HG3  GLU  10           2HG      GLU  10   2.651  14.646 -14.521
   87    H    THR  11           H        THR  11  -0.651  12.933 -13.273
   88    HA   THR  11           HA       THR  11  -1.377  15.844 -13.408
   89    HB   THR  11           HB       THR  11  -2.616  15.317 -15.452
   90    HG1  THR  11           HG1      THR  11  -3.120  13.323 -15.750
   91   HG21  THR  11          3HG2      THR  11   0.222  14.228 -15.607
   92   HG22  THR  11          1HG2      THR  11  -0.193  15.943 -15.647
   93   HG23  THR  11          2HG2      THR  11  -0.716  14.876 -16.951
   94    HA   PRO  12           HA       PRO  12  -4.328  13.605 -10.498
   95    HB2  PRO  12           1HB      PRO  12  -4.779  16.574  -9.967
   96    HB3  PRO  12           2HB      PRO  12  -4.813  15.221  -8.805
   97    HG2  PRO  12           1HG      PRO  12  -2.652  16.716  -8.898
   98    HG3  PRO  12           2HG      PRO  12  -2.450  14.945  -8.902
   99    HD2  PRO  12           1HD      PRO  12  -2.269  16.848 -11.274
  100    HD3  PRO  12           2HD      PRO  12  -1.218  15.466 -10.876
  101    H    PHE  13           H        PHE  13  -6.198  12.894 -11.407
  102    HA   PHE  13           HA       PHE  13  -8.266  14.673 -12.322
  103    HB2  PHE  13           1HB      PHE  13  -6.689  14.703 -14.289
  104    HB3  PHE  13           2HB      PHE  13  -6.891  12.960 -14.451
  105    HD1  PHE  13           HD2      PHE  13  -8.683  16.234 -14.562
  106    HD2  PHE  13           HD1      PHE  13  -8.949  12.036 -15.468
  107    HE1  PHE  13           HE2      PHE  13 -10.774  16.639 -15.825
  108    HE2  PHE  13           HE1      PHE  13 -11.044  12.447 -16.727
  109    HZ   PHE  13           HZ       PHE  13 -11.957  14.746 -16.906
  110    H    GLU  14           H        GLU  14 -10.098  13.669 -11.755
  111    HA   GLU  14           HA       GLU  14 -10.292  11.028 -10.842
  112    HB2  GLU  14           1HB      GLU  14 -12.736  11.397 -10.893
  113    HB3  GLU  14           2HB      GLU  14 -11.897  12.816 -10.278
  114    HG2  GLU  14           1HG      GLU  14 -13.498  13.737 -11.797
  115    HG3  GLU  14           2HG      GLU  14 -12.003  13.740 -12.724
  116    H    GLY  15           H        GLY  15 -11.029   9.105 -11.776
  117    HA2  GLY  15           1HA      GLY  15 -11.767   7.652 -13.460
  118    HA3  GLY  15           2HA      GLY  15 -11.767   8.961 -14.620
  119    H    GLU  16           H        GLU  16  -8.960   9.706 -13.748
  120    HA   GLU  16           HA       GLU  16  -7.552   8.130 -15.690
  121    HB2  GLU  16           1HB      GLU  16  -7.016  10.539 -15.094
  122    HB3  GLU  16           2HB      GLU  16  -6.352   9.971 -13.568
  123    HG2  GLU  16           1HG      GLU  16  -4.508  10.265 -15.143
  124    HG3  GLU  16           2HG      GLU  16  -4.717   8.538 -14.881
  125    H    GLU  17           H        GLU  17  -6.134   6.455 -15.427
  126    HA   GLU  17           HA       GLU  17  -6.399   4.855 -13.052
  127    HB2  GLU  17           1HB      GLU  17  -6.166   3.914 -15.365
  128    HB3  GLU  17           2HB      GLU  17  -4.494   4.468 -15.400
  129    HG2  GLU  17           1HG      GLU  17  -3.995   3.047 -13.414
  130    HG3  GLU  17           2HG      GLU  17  -5.669   2.499 -13.386
  131    H    ILE  18           H        ILE  18  -5.008   4.612 -11.385
  132    HA   ILE  18           HA       ILE  18  -2.381   6.032 -11.414
  133    HB   ILE  18           HB       ILE  18  -2.803   6.757  -9.072
  134   HG12  ILE  18          1HG1      ILE  18  -5.714   5.911  -9.545
  135   HG13  ILE  18          2HG1      ILE  18  -4.591   4.994  -8.552
  136   HG21  ILE  18          1HG2      ILE  18  -3.236   8.311 -10.957
  137   HG22  ILE  18          2HG2      ILE  18  -4.364   8.609  -9.641
  138   HG23  ILE  18          3HG2      ILE  18  -4.895   7.723 -11.069
  139   HD11  ILE  18          3HD1      ILE  18  -4.274   6.969  -7.082
  140   HD12  ILE  18          1HD1      ILE  18  -5.956   6.443  -7.134
  141   HD13  ILE  18          2HD1      ILE  18  -5.451   7.860  -8.048
  142    H    THR  19           H        THR  19  -0.773   5.108 -10.217
  143    HA   THR  19           HA       THR  19  -1.141   2.252  -9.568
  144    HB   THR  19           HB       THR  19   1.421   3.904  -9.734
  145    HG1  THR  19           HG1      THR  19   1.533   3.215 -11.802
  146   HG21  THR  19          3HG2      THR  19   1.676   1.795  -8.449
  147   HG22  THR  19          1HG2      THR  19   2.490   1.672 -10.008
  148   HG23  THR  19          2HG2      THR  19   0.927   0.895  -9.768
  149    H    VAL  20           H        VAL  20  -0.854   1.429  -7.542
  150    HA   VAL  20           HA       VAL  20  -0.343   3.369  -5.289
  151    HB   VAL  20           HB       VAL  20  -2.189   0.930  -5.237
  152   HG11  VAL  20          1HG1      VAL  20  -1.691   3.169  -3.214
  153   HG12  VAL  20          2HG1      VAL  20  -1.201   1.487  -3.020
  154   HG13  VAL  20          3HG1      VAL  20  -2.910   1.905  -3.046
  155   HG21  VAL  20          3HG2      VAL  20  -3.127   2.727  -6.664
  156   HG22  VAL  20          1HG2      VAL  20  -2.840   3.911  -5.386
  157   HG23  VAL  20          2HG2      VAL  20  -4.023   2.624  -5.152
  158    H    SER  21           H        SER  21   1.361   2.894  -4.112
  159    HA   SER  21           HA       SER  21   2.331   0.084  -3.882
  160    HB2  SER  21           1HB      SER  21   4.471   0.621  -4.686
  161    HB3  SER  21           2HB      SER  21   3.523   1.741  -5.648
  162    HG   SER  21           HG       SER  21   5.416   2.272  -3.862
  163    H    ALA  22           H        ALA  22   2.716  -0.465  -1.864
  164    HA   ALA  22           HA       ALA  22   2.997   1.636   0.260
  165    HB1  ALA  22           3HB      ALA  22   1.940  -0.005   1.763
  166    HB2  ALA  22           1HB      ALA  22   1.818  -1.161   0.432
  167    HB3  ALA  22           2HB      ALA  22   0.897   0.340   0.381
  168    H    ARG  23           H        ARG  23   4.810   1.600   1.445
  169    HA   ARG  23           HA       ARG  23   6.849  -0.482   0.954
  170    HB2  ARG  23           1HB      ARG  23   6.947   2.109   2.538
  171    HB3  ARG  23           2HB      ARG  23   8.315   1.016   2.309
  172    HG2  ARG  23           1HG      ARG  23   8.165   1.314  -0.148
  173    HG3  ARG  23           2HG      ARG  23   6.789   2.398   0.057
  174    HD2  ARG  23           1HD      ARG  23   8.211   3.960   1.349
  175    HD3  ARG  23           2HD      ARG  23   9.586   2.874   1.154
  176    HE   ARG  23           HE       ARG  23   8.591   3.468  -1.412
  177   HH11  ARG  23          1HH2      ARG  23  10.099   5.054   1.281
  178   HH12  ARG  23          2HH2      ARG  23  10.878   6.260   0.311
  179   HH21  ARG  23          1HH1      ARG  23   9.628   5.058  -2.684
  180   HH22  ARG  23          2HH1      ARG  23  10.614   6.260  -1.921
  181    H    VAL  24           H        VAL  24   6.893  -2.214   2.148
  182    HA   VAL  24           HA       VAL  24   5.775  -2.182   4.909
  183    HB   VAL  24           HB       VAL  24   6.417  -4.547   3.089
  184   HG11  VAL  24          1HG1      VAL  24   4.971  -5.779   4.734
  185   HG12  VAL  24          2HG1      VAL  24   4.902  -4.328   5.731
  186   HG13  VAL  24          3HG1      VAL  24   6.435  -5.156   5.483
  187   HG21  VAL  24          3HG2      VAL  24   3.923  -4.651   2.810
  188   HG22  VAL  24          1HG2      VAL  24   4.604  -3.179   2.127
  189   HG23  VAL  24          2HG2      VAL  24   3.774  -3.130   3.684
  190    H    THR  25           H        THR  25   7.073  -2.479   6.612
  191    HA   THR  25           HA       THR  25   9.982  -2.871   6.168
  192    HB   THR  25           HB       THR  25   8.467  -1.843   8.594
  193    HG1  THR  25           HG1      THR  25   9.467   0.139   7.850
  194   HG21  THR  25          3HG2      THR  25  10.625  -2.781   9.282
  195   HG22  THR  25          1HG2      THR  25  10.761  -1.025   9.261
  196   HG23  THR  25          2HG2      THR  25  11.449  -1.974   7.948
  197    H    ASN  26           H        ASN  26  10.917  -4.732   6.699
  198    HA   ASN  26           HA       ASN  26   9.366  -6.857   8.025
  199    HB2  ASN  26           1HB      ASN  26  10.650  -7.362   5.986
  200    HB3  ASN  26           2HB      ASN  26  12.149  -6.920   6.790
  201   HD21  ASN  26          2HD2      ASN  26  13.215  -8.639   7.842
  202   HD22  ASN  26          1HD2      ASN  26  12.493 -10.123   8.241
  203    H    ARG  27           H        ARG  27   9.467  -7.152  10.135
  204    HA   ARG  27           HA       ARG  27  11.832  -6.193  11.699
  205    HB2  ARG  27           1HB      ARG  27   8.939  -6.581  12.578
  206    HB3  ARG  27           2HB      ARG  27  10.248  -5.936  13.569
  207    HG2  ARG  27           1HG      ARG  27   9.171  -4.642  11.023
  208    HG3  ARG  27           2HG      ARG  27   8.775  -4.136  12.658
  209    HD2  ARG  27           1HD      ARG  27  11.290  -3.735  13.026
  210    HD3  ARG  27           2HD      ARG  27  11.482  -3.939  11.288
  211    HE   ARG  27           HE       ARG  27  10.583  -1.846  10.967
  212   HH11  ARG  27          1HH2      ARG  27   9.774  -2.961  14.162
  213   HH12  ARG  27          2HH2      ARG  27   9.049  -1.463  14.639
  214   HH21  ARG  27          1HH1      ARG  27   9.618   0.106  11.608
  215   HH22  ARG  27          2HH1      ARG  27   8.962   0.262  13.204
  216    H    GLY  28           H        GLY  28  12.945  -7.609  12.833
  217    HA2  GLY  28           1HA      GLY  28  12.104  -9.846  14.193
  218    HA3  GLY  28           2HA      GLY  28  12.467 -10.441  12.571
  219    H    ALA  29           H        ALA  29  14.438 -11.312  12.494
  220    HA   ALA  29           HA       ALA  29  16.808  -9.854  13.269
  221    HB1  ALA  29           3HB      ALA  29  17.599 -11.445  14.988
  222    HB2  ALA  29           1HB      ALA  29  16.077 -12.332  14.873
  223    HB3  ALA  29           2HB      ALA  29  16.089 -10.681  15.490
  224    H    ALA  30           H        ALA  30  15.256 -11.883  11.309
  225    HA   ALA  30           HA       ALA  30  17.748 -12.941  10.131
  226    HB1  ALA  30           3HB      ALA  30  16.818 -15.223   9.960
  227    HB2  ALA  30           1HB      ALA  30  15.386 -14.717  10.863
  228    HB3  ALA  30           2HB      ALA  30  16.963 -14.736  11.650
  229    H    GLU  31           H        GLU  31  17.403 -13.791   7.972
  230    HA   GLU  31           HA       GLU  31  15.908 -12.029   6.353
  231    HB2  GLU  31           1HB      GLU  31  17.021 -14.787   5.677
  232    HB3  GLU  31           2HB      GLU  31  16.399 -13.640   4.491
  233    HG2  GLU  31           1HG      GLU  31  18.819 -13.396   4.537
  234    HG3  GLU  31           2HG      GLU  31  18.129 -11.961   5.290
  235    H    ALA  32           H        ALA  32  13.768 -11.923   6.093
  236    HA   ALA  32           HA       ALA  32  12.024 -14.232   6.709
  237    HB1  ALA  32           3HB      ALA  32  10.218 -12.546   6.688
  238    HB2  ALA  32           1HB      ALA  32  11.369 -11.303   6.185
  239    HB3  ALA  32           2HB      ALA  32  11.519 -12.053   7.773
  240    H    HIS  33           H        HIS  33  10.366 -14.853   5.259
  241    HA   HIS  33           HA       HIS  33  10.501 -13.934   2.451
  242    HB2  HIS  33           1HB      HIS  33  10.796 -16.855   3.274
  243    HB3  HIS  33           2HB      HIS  33  10.704 -16.242   1.620
  244    HD1  HIS  33           HD1      HIS  33  13.006 -16.538   4.556
  245    HD2  HIS  33           HD2      HIS  33  13.082 -14.878   0.730
  246    HE1  HIS  33           HE1      HIS  33  15.421 -15.943   4.081
  247    HE2  HIS  33           HE2      HIS  33  15.485 -14.927   1.755
  248    H    ASN  34           H        ASN  34   8.794 -15.194   1.179
  249    HA   ASN  34           HA       ASN  34   6.526 -15.373   0.812
  250    HB2  ASN  34           1HB      ASN  34   7.019 -17.554   1.879
  251    HB3  ASN  34           2HB      ASN  34   6.656 -16.863   3.457
  252   HD21  ASN  34          2HD2      ASN  34   5.110 -17.249   0.214
  253   HD22  ASN  34          1HD2      ASN  34   3.547 -17.496   0.829
  254    H    VAL  35           H        VAL  35   6.719 -12.951   1.332
  255    HA   VAL  35           HA       VAL  35   4.898 -12.199   3.601
  256    HB   VAL  35           HB       VAL  35   7.013 -10.494   2.224
  257   HG11  VAL  35          1HG1      VAL  35   5.141  -9.166   3.182
  258   HG12  VAL  35          2HG1      VAL  35   6.596  -8.952   4.146
  259   HG13  VAL  35          3HG1      VAL  35   5.311 -10.015   4.718
  260   HG21  VAL  35          3HG2      VAL  35   8.219 -10.776   4.452
  261   HG22  VAL  35          1HG2      VAL  35   8.106 -12.267   3.521
  262   HG23  VAL  35          2HG2      VAL  35   7.032 -11.992   4.894
  263    HA   PRO  36           HA       PRO  36   2.756 -11.043  -0.337
  264    HB2  PRO  36           1HB      PRO  36   0.313 -12.120   0.067
  265    HB3  PRO  36           2HB      PRO  36   1.693 -13.143  -0.402
  266    HG2  PRO  36           1HG      PRO  36   0.493 -12.738   2.331
  267    HG3  PRO  36           2HG      PRO  36   1.032 -14.246   1.564
  268    HD2  PRO  36           1HD      PRO  36   2.597 -12.791   3.382
  269    HD3  PRO  36           2HD      PRO  36   3.286 -13.891   2.167
  270    H    VAL  37           H        VAL  37   2.252  -8.966  -0.381
  271    HA   VAL  37           HA       VAL  37   1.051  -7.618   1.927
  272    HB   VAL  37           HB       VAL  37   1.885  -6.418  -0.763
  273   HG11  VAL  37          1HG1      VAL  37   0.416  -4.968   0.628
  274   HG12  VAL  37          2HG1      VAL  37   2.054  -4.325   0.577
  275   HG13  VAL  37          3HG1      VAL  37   1.493  -5.188   2.008
  276   HG21  VAL  37          3HG2      VAL  37   4.013  -5.828   0.451
  277   HG22  VAL  37          1HG2      VAL  37   3.818  -7.562   0.211
  278   HG23  VAL  37          2HG2      VAL  37   3.496  -6.851   1.791
  279    H    ALA  38           H        ALA  38  -0.962  -6.731   1.963
  280    HA   ALA  38           HA       ALA  38  -2.755  -7.104  -0.407
  281    HB1  ALA  38           3HB      ALA  38  -3.422  -7.590   2.526
  282    HB2  ALA  38           1HB      ALA  38  -3.181  -8.845   1.311
  283    HB3  ALA  38           2HB      ALA  38  -4.542  -7.731   1.167
  284    H    VAL  39           H        VAL  39  -3.290  -5.135  -1.075
  285    HA   VAL  39           HA       VAL  39  -3.670  -2.915   0.871
  286    HB   VAL  39           HB       VAL  39  -3.253  -2.751  -2.153
  287   HG11  VAL  39          1HG1      VAL  39  -3.032  -0.646   0.048
  288   HG12  VAL  39          2HG1      VAL  39  -4.366  -0.777  -1.096
  289   HG13  VAL  39          3HG1      VAL  39  -2.752  -0.376  -1.674
  290   HG21  VAL  39          3HG2      VAL  39  -1.241  -3.734  -1.101
  291   HG22  VAL  39          1HG2      VAL  39  -1.224  -2.447   0.108
  292   HG23  VAL  39          2HG2      VAL  39  -0.912  -2.075  -1.588
  293    H    TYR  40           H        TYR  40  -5.553  -1.780   0.866
  294    HA   TYR  40           HA       TYR  40  -7.693  -2.364  -1.063
  295    HB2  TYR  40           1HB      TYR  40  -9.301  -2.987   0.773
  296    HB3  TYR  40           2HB      TYR  40  -8.026  -4.182   0.527
  297    HD1  TYR  40           HD1      TYR  40  -9.224  -1.450   2.761
  298    HD2  TYR  40           HD2      TYR  40  -6.250  -4.535   2.217
  299    HE1  TYR  40           HE1      TYR  40  -8.487  -1.174   5.112
  300    HE2  TYR  40           HE2      TYR  40  -5.539  -4.248   4.574
  301    HH   TYR  40           HH       TYR  40  -5.966  -1.764   6.321
  302    H    LEU  41           H        LEU  41  -9.168  -0.743  -1.222
  303    HA   LEU  41           HA       LEU  41  -8.509   1.773   0.193
  304    HB2  LEU  41           1HB      LEU  41  -8.608   1.760  -2.279
  305    HB3  LEU  41           2HB      LEU  41 -10.302   1.300  -2.217
  306    HG   LEU  41           HG       LEU  41  -9.698   3.751  -0.554
  307   HD11  LEU  41          1HD1      LEU  41  -9.349   3.927  -3.554
  308   HD12  LEU  41          2HD1      LEU  41  -8.099   4.198  -2.355
  309   HD13  LEU  41          3HD1      LEU  41  -9.467   5.305  -2.461
  310   HD21  LEU  41          3HD2      LEU  41 -12.003   2.935  -1.100
  311   HD22  LEU  41          1HD2      LEU  41 -11.706   3.296  -2.801
  312   HD23  LEU  41          2HD2      LEU  41 -11.731   4.600  -1.612
  313    H    GLY  42           H        GLY  42  -9.747   2.575   1.746
  314    HA2  GLY  42           1HA      GLY  42 -12.047   3.171   2.454
  315    HA3  GLY  42           2HA      GLY  42 -12.495   1.485   2.226
  316    H    ASN  43           H        ASN  43 -13.159   1.446   4.413
  317    HA   ASN  43           HA       ASN  43 -11.030   1.600   6.485
  318    HB2  ASN  43           1HB      ASN  43 -14.052   1.537   6.683
  319    HB3  ASN  43           2HB      ASN  43 -12.959   1.660   8.062
  320   HD21  ASN  43          2HD2      ASN  43 -13.427   3.352   4.872
  321   HD22  ASN  43          1HD2      ASN  43 -13.164   4.903   5.511
  322    HA   PRO  44           HA       PRO  44 -11.125  -2.903   6.701
  323    HB2  PRO  44           1HB      PRO  44  -9.949  -3.394   9.119
  324    HB3  PRO  44           2HB      PRO  44  -9.027  -2.677   7.774
  325    HG2  PRO  44           1HG      PRO  44 -10.389  -1.248  10.063
  326    HG3  PRO  44           2HG      PRO  44  -8.703  -1.091   9.512
  327    HD2  PRO  44           1HD      PRO  44 -10.582   0.697   8.692
  328    HD3  PRO  44           2HD      PRO  44  -9.322   0.146   7.561
  329    H    ALA  45           H        ALA  45 -12.575  -0.973   9.265
  330    HA   ALA  45           HA       ALA  45 -14.013  -3.045  10.598
  331    HB1  ALA  45           3HB      ALA  45 -15.338  -1.192  11.554
  332    HB2  ALA  45           1HB      ALA  45 -14.656  -0.082  10.359
  333    HB3  ALA  45           2HB      ALA  45 -13.616  -0.808  11.581
  334    H    GLN  46           H        GLN  46 -14.883  -0.841   7.941
  335    HA   GLN  46           HA       GLN  46 -17.594  -1.728   7.697
  336    HB2  GLN  46           1HB      GLN  46 -16.681   0.455   6.808
  337    HB3  GLN  46           2HB      GLN  46 -15.836  -0.446   5.557
  338    HG2  GLN  46           1HG      GLN  46 -17.924   0.411   4.618
  339    HG3  GLN  46           2HG      GLN  46 -18.069  -1.334   4.758
  340   HE21  GLN  46          2HE2      GLN  46 -19.028   1.733   6.365
  341   HE22  GLN  46          1HE2      GLN  46 -20.396   1.081   7.128
  342    H    GLY  47           H        GLY  47 -14.983  -2.196   5.311
  343    HA2  GLY  47           1HA      GLY  47 -14.951  -4.965   5.166
  344    HA3  GLY  47           2HA      GLY  47 -16.251  -4.467   4.084
  345    H    GLY  48           H        GLY  48 -12.796  -4.285   4.703
  346    HA2  GLY  48           1HA      GLY  48 -12.013  -2.700   2.496
  347    HA3  GLY  48           2HA      GLY  48 -11.001  -3.874   3.330
  348    H    VAL  49           H        VAL  49 -11.502  -3.212   0.386
  349    HA   VAL  49           HA       VAL  49 -12.192  -5.960  -0.592
  350    HB   VAL  49           HB       VAL  49 -12.296  -3.319  -2.122
  351   HG11  VAL  49          1HG1      VAL  49 -13.587  -4.679  -3.779
  352   HG12  VAL  49          2HG1      VAL  49 -13.303  -6.119  -2.804
  353   HG13  VAL  49          3HG1      VAL  49 -11.950  -5.297  -3.579
  354   HG21  VAL  49          3HG2      VAL  49 -14.009  -3.362  -0.333
  355   HG22  VAL  49          1HG2      VAL  49 -14.543  -4.958  -0.863
  356   HG23  VAL  49          2HG2      VAL  49 -14.772  -3.554  -1.907
  357    H    GLU  50           H        GLU  50 -10.542  -7.109  -1.326
  358    HA   GLU  50           HA       GLU  50  -7.876  -6.092  -1.520
  359    HB2  GLU  50           1HB      GLU  50  -8.454  -8.467  -0.978
  360    HB3  GLU  50           2HB      GLU  50  -8.988  -8.707  -2.638
  361    HG2  GLU  50           1HG      GLU  50  -6.695  -8.161  -3.448
  362    HG3  GLU  50           2HG      GLU  50  -6.169  -7.911  -1.786
  363    H    ILE  51           H        ILE  51  -6.948  -5.029  -3.162
  364    HA   ILE  51           HA       ILE  51  -8.321  -4.837  -5.794
  365    HB   ILE  51           HB       ILE  51  -5.973  -3.200  -4.721
  366   HG12  ILE  51          1HG1      ILE  51  -8.934  -2.426  -4.887
  367   HG13  ILE  51          2HG1      ILE  51  -8.152  -2.939  -3.402
  368   HG21  ILE  51          1HG2      ILE  51  -6.631  -1.637  -6.587
  369   HG22  ILE  51          2HG2      ILE  51  -7.834  -2.804  -7.114
  370   HG23  ILE  51          3HG2      ILE  51  -6.120  -3.200  -7.203
  371   HD11  ILE  51          3HD1      ILE  51  -7.421  -0.495  -5.045
  372   HD12  ILE  51          1HD1      ILE  51  -6.537  -1.040  -3.619
  373   HD13  ILE  51          2HD1      ILE  51  -8.210  -0.504  -3.471
  374    H    GLY  52           H        GLY  52  -5.189  -5.658  -4.351
  375    HA2  GLY  52           1HA      GLY  52  -4.601  -7.671  -6.249
  376    HA3  GLY  52           2HA      GLY  52  -3.749  -6.200  -6.696
  377    H    ARG  53           H        ARG  53  -2.389  -8.499  -6.020
  378    HA   ARG  53           HA       ARG  53  -0.849  -7.606  -3.682
  379    HB2  ARG  53           1HB      ARG  53  -0.958  -9.905  -2.658
  380    HB3  ARG  53           2HB      ARG  53  -2.509  -9.066  -2.636
  381    HG2  ARG  53           1HG      ARG  53  -3.236 -10.308  -4.652
  382    HG3  ARG  53           2HG      ARG  53  -1.687 -11.146  -4.709
  383    HD2  ARG  53           1HD      ARG  53  -3.616 -11.307  -2.360
  384    HD3  ARG  53           2HD      ARG  53  -3.510 -12.509  -3.648
  385    HE   ARG  53           HE       ARG  53  -0.929 -12.126  -2.576
  386   HH11  ARG  53          1HH2      ARG  53  -4.039 -13.395  -1.646
  387   HH12  ARG  53          2HH2      ARG  53  -3.373 -14.576  -0.568
  388   HH21  ARG  53          1HH1      ARG  53  -0.085 -13.689  -1.174
  389   HH22  ARG  53          2HH1      ARG  53  -1.150 -14.741  -0.303
  390    H    ASP  54           H        ASP  54   1.147  -8.838  -3.441
  391    HA   ASP  54           HA       ASP  54   2.099 -10.534  -5.571
  392    HB2  ASP  54           1HB      ASP  54   2.121  -8.275  -6.685
  393    HB3  ASP  54           2HB      ASP  54   3.232  -7.699  -5.451
  394    H    THR  55           H        THR  55   3.339 -11.901  -4.441
  395    HA   THR  55           HA       THR  55   4.557 -11.187  -1.920
  396    HB   THR  55           HB       THR  55   4.983 -13.710  -3.583
  397    HG1  THR  55           HG1      THR  55   2.931 -12.820  -1.912
  398   HG21  THR  55          3HG2      THR  55   5.486 -14.737  -1.377
  399   HG22  THR  55          1HG2      THR  55   5.274 -13.170  -0.597
  400   HG23  THR  55          2HG2      THR  55   6.609 -13.422  -1.720
  401    H    ILE  56           H        ILE  56   6.645 -10.715  -1.488
  402    HA   ILE  56           HA       ILE  56   8.281  -9.787  -3.689
  403    HB   ILE  56           HB       ILE  56   9.073  -9.980  -0.741
  404   HG12  ILE  56          1HG1      ILE  56   6.918  -8.793  -0.819
  405   HG13  ILE  56          2HG1      ILE  56   8.211  -7.644  -0.504
  406   HG21  ILE  56          1HG2      ILE  56  10.505  -8.018  -1.368
  407   HG22  ILE  56          2HG2      ILE  56   9.979  -8.168  -3.030
  408   HG23  ILE  56          3HG2      ILE  56  10.919  -9.460  -2.282
  409   HD11  ILE  56          3HD1      ILE  56   6.622  -8.026  -3.042
  410   HD12  ILE  56          1HD1      ILE  56   8.165  -7.167  -3.064
  411   HD13  ILE  56          2HD1      ILE  56   6.838  -6.564  -2.079
  412    H    SER  57           H        SER  57  10.338 -10.595  -4.278
  413    HA   SER  57           HA       SER  57  10.628 -13.423  -4.297
  414    HB2  SER  57           1HB      SER  57  12.694 -11.272  -4.881
  415    HB3  SER  57           2HB      SER  57  12.854 -12.978  -5.301
  416    HG   SER  57           HG       SER  57  11.225 -12.779  -6.736
  417    H    ARG  58           H        ARG  58  12.349 -10.882  -2.500
  418    HA   ARG  58           HA       ARG  58  12.736 -12.527  -0.188
  419    HB2  ARG  58           1HB      ARG  58  15.234 -12.679  -0.349
  420    HB3  ARG  58           2HB      ARG  58  14.423 -13.615  -1.599
  421    HG2  ARG  58           1HG      ARG  58  14.771 -11.756  -3.219
  422    HG3  ARG  58           2HG      ARG  58  15.616 -10.841  -1.976
  423    HD2  ARG  58           1HD      ARG  58  16.500 -13.560  -3.002
  424    HD3  ARG  58           2HD      ARG  58  17.186 -12.015  -3.508
  425    HE   ARG  58           HE       ARG  58  17.294 -12.122  -0.705
  426   HH11  ARG  58          1HH2      ARG  58  18.676 -13.714  -3.475
  427   HH12  ARG  58          2HH2      ARG  58  20.149 -14.121  -2.662
  428   HH21  ARG  58          1HH1      ARG  58  19.215 -12.653   0.336
  429   HH22  ARG  58          2HH1      ARG  58  20.453 -13.522  -0.508
  430    H    ILE  59           H        ILE  59  13.104 -11.273   1.553
  431    HA   ILE  59           HA       ILE  59  13.724  -8.382   1.117
  432    HB   ILE  59           HB       ILE  59  12.062  -9.579   3.357
  433   HG12  ILE  59          1HG1      ILE  59  11.169  -7.992   0.908
  434   HG13  ILE  59          2HG1      ILE  59  10.971  -9.732   1.068
  435   HG21  ILE  59          1HG2      ILE  59  12.657  -6.685   2.541
  436   HG22  ILE  59          2HG2      ILE  59  13.146  -7.465   4.043
  437   HG23  ILE  59          3HG2      ILE  59  11.455  -7.134   3.737
  438   HD11  ILE  59          3HD1      ILE  59   9.693  -7.604   2.819
  439   HD12  ILE  59          1HD1      ILE  59   9.583  -9.335   3.108
  440   HD13  ILE  59          2HD1      ILE  59   8.875  -8.643   1.657
  441    HA   PRO  60           HA       PRO  60  17.231  -9.640   3.783
  442    HB2  PRO  60           1HB      PRO  60  18.825  -7.458   3.582
  443    HB3  PRO  60           2HB      PRO  60  18.564  -8.523   2.178
  444    HG2  PRO  60           1HG      PRO  60  17.155  -5.934   2.842
  445    HG3  PRO  60           2HG      PRO  60  17.936  -6.406   1.313
  446    HD2  PRO  60           1HD      PRO  60  15.231  -6.678   1.679
  447    HD3  PRO  60           2HD      PRO  60  16.143  -7.846   0.690
  448    H    VAL  61           H        VAL  61  18.228  -8.868   5.825
  449    HA   VAL  61           HA       VAL  61  16.241  -7.975   7.681
  450    HB   VAL  61           HB       VAL  61  19.252  -8.262   8.106
  451   HG11  VAL  61          1HG1      VAL  61  18.595  -8.610  10.498
  452   HG12  VAL  61          2HG1      VAL  61  16.919  -8.263  10.077
  453   HG13  VAL  61          3HG1      VAL  61  18.143  -7.002   9.939
  454   HG21  VAL  61          3HG2      VAL  61  16.990 -10.276   8.486
  455   HG22  VAL  61          1HG2      VAL  61  18.678 -10.542   8.925
  456   HG23  VAL  61          2HG2      VAL  61  18.229 -10.353   7.234
  457    H    GLY  62           H        GLY  62  15.956  -6.009   8.662
  458    HA2  GLY  62           1HA      GLY  62  16.110  -3.748   9.040
  459    HA3  GLY  62           2HA      GLY  62  17.802  -3.825   8.551
  460    H    GLY  63           H        GLY  63  15.451  -5.071   6.360
  461    HA2  GLY  63           1HA      GLY  63  15.745  -2.725   4.536
  462    HA3  GLY  63           2HA      GLY  63  15.552  -4.403   4.044
  463    H    THR  64           H        THR  64  13.819  -3.173   2.770
  464    HA   THR  64           HA       THR  64  11.226  -3.558   4.159
  465    HB   THR  64           HB       THR  64  10.353  -1.420   3.426
  466    HG1  THR  64           HG1      THR  64  11.327  -1.149   1.488
  467   HG21  THR  64          3HG2      THR  64  11.697   0.148   4.707
  468   HG22  THR  64          1HG2      THR  64  13.146  -0.825   4.479
  469   HG23  THR  64          2HG2      THR  64  11.847  -1.409   5.517
  470    H    GLY  65           H        GLY  65   9.519  -4.074   2.788
  471    HA2  GLY  65           1HA      GLY  65  10.250  -4.991   0.061
  472    HA3  GLY  65           2HA      GLY  65   8.917  -5.567   1.056
  473    H    LEU  66           H        LEU  66   8.752  -4.640  -1.645
  474    HA   LEU  66           HA       LEU  66   6.630  -2.650  -1.290
  475    HB2  LEU  66           1HB      LEU  66   8.686  -1.312  -1.642
  476    HB3  LEU  66           2HB      LEU  66   8.973  -2.157  -3.160
  477    HG   LEU  66           HG       LEU  66   6.875  -1.230  -4.117
  478   HD11  LEU  66          1HD1      LEU  66   5.791   0.732  -2.663
  479   HD12  LEU  66          2HD1      LEU  66   6.455  -0.163  -1.323
  480   HD13  LEU  66          3HD1      LEU  66   5.292  -0.932  -2.385
  481   HD21  LEU  66          3HD2      LEU  66   8.970   0.086  -4.300
  482   HD22  LEU  66          1HD2      LEU  66   8.589   0.892  -2.771
  483   HD23  LEU  66          2HD2      LEU  66   7.568   1.150  -4.192
  484    H    ALA  67           H        ALA  67   5.033  -2.856  -2.720
  485    HA   ALA  67           HA       ALA  67   5.286  -4.836  -4.937
  486    HB1  ALA  67           3HB      ALA  67   4.002  -5.747  -3.045
  487    HB2  ALA  67           1HB      ALA  67   2.930  -5.430  -4.412
  488    HB3  ALA  67           2HB      ALA  67   2.970  -4.321  -3.038
  489    H    ARG  68           H        ARG  68   3.807  -4.496  -6.673
  490    HA   ARG  68           HA       ARG  68   2.993  -1.628  -7.041
  491    HB2  ARG  68           1HB      ARG  68   5.003  -2.261  -8.391
  492    HB3  ARG  68           2HB      ARG  68   4.057  -3.515  -9.188
  493    HG2  ARG  68           1HG      ARG  68   2.479  -1.778 -10.037
  494    HG3  ARG  68           2HG      ARG  68   3.415  -0.530  -9.222
  495    HD2  ARG  68           1HD      ARG  68   5.379  -1.091 -10.623
  496    HD3  ARG  68           2HD      ARG  68   4.442  -2.345 -11.436
  497    HE   ARG  68           HE       ARG  68   3.016   0.078 -11.637
  498   HH11  ARG  68          1HH2      ARG  68   5.987  -1.347 -12.776
  499   HH12  ARG  68          2HH2      ARG  68   6.019  -0.411 -14.234
  500   HH21  ARG  68          1HH1      ARG  68   3.083   1.288 -13.546
  501   HH22  ARG  68          2HH1      ARG  68   4.386   1.070 -14.667
  502    H    VAL  69           H        VAL  69   0.915  -1.365  -7.321
  503    HA   VAL  69           HA       VAL  69  -0.719  -3.443  -8.667
  504    HB   VAL  69           HB       VAL  69  -1.522  -2.064  -6.057
  505   HG11  VAL  69          1HG1      VAL  69  -3.472  -2.570  -7.475
  506   HG12  VAL  69          2HG1      VAL  69  -3.423  -3.732  -6.154
  507   HG13  VAL  69          3HG1      VAL  69  -2.880  -4.204  -7.763
  508   HG21  VAL  69          3HG2      VAL  69   0.223  -3.725  -5.593
  509   HG22  VAL  69          1HG2      VAL  69  -0.597  -4.926  -6.594
  510   HG23  VAL  69          2HG2      VAL  69  -1.328  -4.382  -5.083
  511    H    GLN  70           H        GLN  70  -2.339  -2.659  -9.891
  512    HA   GLN  70           HA       GLN  70  -2.431   0.287 -10.319
  513    HB2  GLN  70           1HB      GLN  70  -3.405  -0.318 -12.529
  514    HB3  GLN  70           2HB      GLN  70  -1.796  -0.997 -12.286
  515    HG2  GLN  70           1HG      GLN  70  -2.793  -3.180 -11.675
  516    HG3  GLN  70           2HG      GLN  70  -4.407  -2.519 -11.905
  517   HE21  GLN  70          2HE2      GLN  70  -5.250  -3.172 -13.887
  518   HE22  GLN  70          1HE2      GLN  70  -4.353  -3.343 -15.318
  519    H    TRP  71           H        TRP  71  -4.310   1.410 -10.161
  520    HA   TRP  71           HA       TRP  71  -6.849  -0.019  -9.630
  521    HB2  TRP  71           1HB      TRP  71  -5.809   0.525  -7.399
  522    HB3  TRP  71           2HB      TRP  71  -5.782   2.223  -7.842
  523    HD1  TRP  71           HD1      TRP  71  -8.478  -0.576  -7.875
  524    HE1  TRP  71           HE1      TRP  71 -10.688   0.418  -7.039
  525    HE3  TRP  71           HE3      TRP  71  -6.981   4.205  -6.924
  526    HZ2  TRP  71           HZ2      TRP  71 -11.709   2.919  -6.101
  527    HZ3  TRP  71           HZ3      TRP  71  -8.593   5.882  -6.063
  528    HH2  TRP  71           HH2      TRP  71 -10.956   5.243  -5.646
  529    H    LYS  72           H        LYS  72  -8.507   0.883 -10.639
  530    HA   LYS  72           HA       LYS  72  -8.086   3.325 -12.210
  531    HB2  LYS  72           1HB      LYS  72  -9.159   1.301 -13.209
  532    HB3  LYS  72           2HB      LYS  72 -10.521   1.496 -12.108
  533    HG2  LYS  72           1HG      LYS  72 -10.995   3.737 -13.071
  534    HG3  LYS  72           2HG      LYS  72  -9.594   3.583 -14.135
  535    HD2  LYS  72           1HD      LYS  72 -10.640   1.602 -15.217
  536    HD3  LYS  72           2HD      LYS  72 -12.046   1.775 -14.163
  537    HE2  LYS  72           1HE      LYS  72 -12.464   2.808 -16.384
  538    HE3  LYS  72           2HE      LYS  72 -12.484   4.028 -15.109
  539    HZ1  LYS  72           3HZ      LYS  72 -10.069   3.384 -16.708
  540    HZ2  LYS  72           1HZ      LYS  72 -10.296   4.700 -15.662
  541    HZ3  LYS  72           2HZ      LYS  72 -11.157   4.622 -17.124
  542    H    ALA  73           H        ALA  73  -8.699   5.275 -11.501
  543    HA   ALA  73           HA       ALA  73  -9.992   5.664  -8.981
  544    HB1  ALA  73           3HB      ALA  73 -10.007   8.063  -9.627
  545    HB2  ALA  73           1HB      ALA  73  -9.549   7.620 -11.275
  546    HB3  ALA  73           2HB      ALA  73  -8.435   7.325  -9.941
  547    H    THR  74           H        THR  74 -12.129   5.759  -8.516
  548    HA   THR  74           HA       THR  74 -14.132   6.577 -10.458
  549    HB   THR  74           HB       THR  74 -13.935   4.250 -11.154
  550    HG1  THR  74           HG1      THR  74 -16.048   3.551 -10.503
  551   HG21  THR  74          3HG2      THR  74 -12.834   3.341  -9.124
  552   HG22  THR  74          1HG2      THR  74 -14.248   2.387  -9.567
  553   HG23  THR  74          2HG2      THR  74 -14.339   3.523  -8.226
  554    H    ARG  75           H        ARG  75 -16.372   6.251  -9.455
  555    HA   ARG  75           HA       ARG  75 -16.421   6.365  -6.515
  556    HB2  ARG  75           1HB      ARG  75 -15.842   8.685  -7.250
  557    HB3  ARG  75           2HB      ARG  75 -17.314   8.735  -8.218
  558    HG2  ARG  75           1HG      ARG  75 -18.677   8.410  -6.156
  559    HG3  ARG  75           2HG      ARG  75 -17.203   8.345  -5.196
  560    HD2  ARG  75           1HD      ARG  75 -16.660  10.666  -5.895
  561    HD3  ARG  75           2HD      ARG  75 -18.151  10.723  -6.838
  562    HE   ARG  75           HE       ARG  75 -18.818   9.989  -4.204
  563   HH11  ARG  75          1HH2      ARG  75 -17.562  12.725  -5.956
  564   HH12  ARG  75          2HH2      ARG  75 -18.187  13.887  -4.833
  565   HH21  ARG  75          1HH1      ARG  75 -19.620  11.522  -2.748
  566   HH22  ARG  75          2HH1      ARG  75 -19.345  13.210  -3.026
  567    H    LYS  76           H        LYS  76 -17.666   4.460  -6.842
  568    HA   LYS  76           HA       LYS  76 -20.064   4.403  -8.385
  569    HB2  LYS  76           1HB      LYS  76 -18.712   2.391  -7.512
  570    HB3  LYS  76           2HB      LYS  76 -19.456   2.669  -5.945
  571    HG2  LYS  76           1HG      LYS  76 -20.969   1.076  -6.848
  572    HG3  LYS  76           2HG      LYS  76 -21.758   2.571  -7.345
  573    HD2  LYS  76           1HD      LYS  76 -20.557   2.362  -9.585
  574    HD3  LYS  76           2HD      LYS  76 -19.946   0.797  -9.055
  575    HE2  LYS  76           1HE      LYS  76 -22.875   1.571  -9.367
  576    HE3  LYS  76           2HE      LYS  76 -21.972   0.476 -10.414
  577    HZ1  LYS  76           3HZ      LYS  76 -23.069   0.037  -7.759
  578    HZ2  LYS  76           1HZ      LYS  76 -21.538  -0.638  -8.037
  579    HZ3  LYS  76           2HZ      LYS  76 -22.845  -1.059  -9.037
  580    H    LEU  77           H        LEU  77 -22.089   5.108  -7.912
  581    HA   LEU  77           HA       LEU  77 -23.778   6.226  -6.858
  582    HB2  LEU  77           1HB      LEU  77 -23.688   4.018  -5.576
  583    HB3  LEU  77           2HB      LEU  77 -22.754   4.849  -4.347
  584    HG   LEU  77           HG       LEU  77 -24.838   6.576  -4.345
  585   HD11  LEU  77          1HD1      LEU  77 -26.162   4.020  -5.357
  586   HD12  LEU  77          2HD1      LEU  77 -26.012   5.512  -6.279
  587   HD13  LEU  77          3HD1      LEU  77 -26.996   5.481  -4.823
  588   HD21  LEU  77          3HD2      LEU  77 -25.015   3.808  -3.083
  589   HD22  LEU  77          1HD2      LEU  77 -25.946   5.219  -2.570
  590   HD23  LEU  77          2HD2      LEU  77 -24.193   5.206  -2.392
  591    H    ALA  78           H        ALA  78 -23.092   8.378  -7.042
  592    HA   ALA  78           HA       ALA  78 -21.100   9.603  -5.420
  593    HB1  ALA  78           3HB      ALA  78 -21.982  11.724  -6.328
  594    HB2  ALA  78           1HB      ALA  78 -23.415  10.884  -6.925
  595    HB3  ALA  78           2HB      ALA  78 -21.830  10.519  -7.605
  596    H    GLY  79           H        GLY  79 -22.311  11.932  -4.474
  597    HA2  GLY  79           1HA      GLY  79 -23.601  12.833  -2.773
  598    HA3  GLY  79           2HA      GLY  79 -24.498  11.323  -2.644
  599    H    ARG  80           H        ARG  80 -24.341  10.880  -0.464
  600    HA   ARG  80           HA       ARG  80 -23.452  10.403   1.599
  601    HB2  ARG  80           1HB      ARG  80 -21.063   9.549  -0.090
  602    HB3  ARG  80           2HB      ARG  80 -21.324   9.108   1.596
  603    HG2  ARG  80           1HG      ARG  80 -23.415   7.933   0.979
  604    HG3  ARG  80           2HG      ARG  80 -23.183   8.388  -0.707
  605    HD2  ARG  80           1HD      ARG  80 -21.068   7.110  -0.778
  606    HD3  ARG  80           2HD      ARG  80 -21.260   6.668   0.918
  607    HE   ARG  80           HE       ARG  80 -22.565   5.445  -1.339
  608   HH11  ARG  80          1HH2      ARG  80 -22.936   6.231   2.032
  609   HH12  ARG  80          2HH2      ARG  80 -24.107   4.990   2.325
  610   HH21  ARG  80          1HH1      ARG  80 -24.097   3.824  -0.936
  611   HH22  ARG  80          2HH1      ARG  80 -24.762   3.635   0.653
  612    H    ALA  81           H        ALA  81 -23.457  12.757   2.005
  613    HA   ALA  81           HA       ALA  81 -22.529  14.708   2.738
  614    HB1  ALA  81           3HB      ALA  81 -20.437  14.544   4.012
  615    HB2  ALA  81           1HB      ALA  81 -20.090  12.973   3.291
  616    HB3  ALA  81           2HB      ALA  81 -21.466  13.157   4.374
  617    H    ALA  82           H        ALA  82 -20.593  16.257   2.410
  618    HA   ALA  82           HA       ALA  82 -20.087  16.447  -0.452
  619    HB1  ALA  82           3HB      ALA  82 -19.006  18.591   0.149
  620    HB2  ALA  82           1HB      ALA  82 -19.140  18.181   1.862
  621    HB3  ALA  82           2HB      ALA  82 -20.595  18.448   0.905
  622    H    ASN  83           H        ASN  83 -17.718  17.242  -0.986
  623    HA   ASN  83           HA       ASN  83 -15.572  16.680  -1.357
  624    HB2  ASN  83           1HB      ASN  83 -15.565  15.669   1.513
  625    HB3  ASN  83           2HB      ASN  83 -14.156  16.102   0.561
  626   HD21  ASN  83          2HD2      ASN  83 -17.153  17.535   1.964
  627   HD22  ASN  83          1HD2      ASN  83 -16.513  19.104   2.079
  628    HA   PRO  84           HA       PRO  84 -15.838  12.353  -2.563
  629    HB2  PRO  84           1HB      PRO  84 -13.289  11.802  -3.435
  630    HB3  PRO  84           2HB      PRO  84 -14.361  12.912  -4.321
  631    HG2  PRO  84           1HG      PRO  84 -12.191  13.604  -2.333
  632    HG3  PRO  84           2HG      PRO  84 -12.474  14.287  -3.945
  633    HD2  PRO  84           1HD      PRO  84 -13.378  15.583  -1.712
  634    HD3  PRO  84           2HD      PRO  84 -14.327  15.599  -3.215
  635    H    GLY  85           H        GLY  85 -12.806  12.976  -0.775
  636    HA2  GLY  85           1HA      GLY  85 -11.798  11.860   0.985
  637    HA3  GLY  85           2HA      GLY  85 -13.422  11.390   1.481
  638    H    VAL  86           H        VAL  86 -10.753  10.562  -0.682
  639    HA   VAL  86           HA       VAL  86 -11.564   7.671  -0.640
  640    HB   VAL  86           HB       VAL  86 -10.381   7.584  -2.904
  641   HG11  VAL  86          1HG1      VAL  86 -12.854   7.551  -2.745
  642   HG12  VAL  86          2HG1      VAL  86 -12.337   8.455  -4.167
  643   HG13  VAL  86          3HG1      VAL  86 -12.886   9.314  -2.727
  644   HG21  VAL  86          3HG2      VAL  86  -9.171   9.775  -2.699
  645   HG22  VAL  86          1HG2      VAL  86 -10.712  10.623  -2.767
  646   HG23  VAL  86          2HG2      VAL  86 -10.147   9.700  -4.157
  647    HA   PRO  87           HA       PRO  87  -7.262   8.412   1.193
  648    HB2  PRO  87           1HB      PRO  87  -7.665   7.040   3.571
  649    HB3  PRO  87           2HB      PRO  87  -8.071   8.764   3.381
  650    HG2  PRO  87           1HG      PRO  87  -9.902   6.379   3.029
  651    HG3  PRO  87           2HG      PRO  87 -10.147   7.811   4.062
  652    HD2  PRO  87           1HD      PRO  87 -11.312   7.749   1.674
  653    HD3  PRO  87           2HD      PRO  87 -10.484   9.244   2.157
  654    H    VAL  88           H        VAL  88  -5.892   6.492   2.207
  655    HA   VAL  88           HA       VAL  88  -6.475   3.917   0.813
  656    HB   VAL  88           HB       VAL  88  -4.072   3.824   0.131
  657   HG11  VAL  88          1HG1      VAL  88  -4.247   5.455  -1.729
  658   HG12  VAL  88          2HG1      VAL  88  -5.557   6.284  -0.890
  659   HG13  VAL  88          3HG1      VAL  88  -5.787   4.635  -1.471
  660   HG21  VAL  88          3HG2      VAL  88  -2.732   5.942   0.194
  661   HG22  VAL  88          1HG2      VAL  88  -3.110   5.367   1.814
  662   HG23  VAL  88          2HG2      VAL  88  -4.012   6.715   1.123
  663    H    TYR  89           H        TYR  89  -5.332   2.120   1.650
  664    HA   TYR  89           HA       TYR  89  -3.964   2.343   4.234
  665    HB2  TYR  89           1HB      TYR  89  -6.654   0.932   3.933
  666    HB3  TYR  89           2HB      TYR  89  -5.578   0.711   5.314
  667    HD1  TYR  89           HD2      TYR  89  -5.073   2.634   6.866
  668    HD2  TYR  89           HD1      TYR  89  -7.964   3.026   3.692
  669    HE1  TYR  89           HE2      TYR  89  -5.969   4.693   7.923
  670    HE2  TYR  89           HE1      TYR  89  -8.849   5.070   4.775
  671    HH   TYR  89           HH       TYR  89  -8.531   5.919   7.715
  672    H    ALA  90           H        ALA  90  -2.782   0.556   4.737
  673    HA   ALA  90           HA       ALA  90  -2.827  -1.811   2.946
  674    HB1  ALA  90           3HB      ALA  90  -0.366  -0.091   3.457
  675    HB2  ALA  90           1HB      ALA  90  -1.240  -0.203   1.931
  676    HB3  ALA  90           2HB      ALA  90  -0.391  -1.615   2.565
  677    H    VAL  91           H        VAL  91  -2.080  -3.656   3.896
  678    HA   VAL  91           HA       VAL  91  -0.982  -3.552   6.650
  679    HB   VAL  91           HB       VAL  91  -3.398  -5.253   5.857
  680   HG11  VAL  91          1HG1      VAL  91  -1.981  -6.310   7.596
  681   HG12  VAL  91          2HG1      VAL  91  -3.482  -5.739   8.312
  682   HG13  VAL  91          3HG1      VAL  91  -1.996  -4.813   8.529
  683   HG21  VAL  91          3HG2      VAL  91  -3.231  -2.731   7.576
  684   HG22  VAL  91          1HG2      VAL  91  -4.657  -3.762   7.448
  685   HG23  VAL  91          2HG2      VAL  91  -4.080  -2.890   6.039
  686    H    VAL  92           H        VAL  92   0.358  -5.208   7.146
  687    HA   VAL  92           HA       VAL  92   1.246  -6.949   4.930
  688    HB   VAL  92           HB       VAL  92   2.892  -5.591   6.182
  689   HG11  VAL  92          1HG1      VAL  92   3.460  -6.028   8.507
  690   HG12  VAL  92          2HG1      VAL  92   2.278  -7.328   8.610
  691   HG13  VAL  92          3HG1      VAL  92   1.737  -5.660   8.421
  692   HG21  VAL  92          3HG2      VAL  92   3.587  -7.761   5.153
  693   HG22  VAL  92          1HG2      VAL  92   3.248  -8.583   6.676
  694   HG23  VAL  92          2HG2      VAL  92   4.539  -7.387   6.588
  695    H    ASP  93           H        ASP  93   0.966  -9.115   4.931
  696    HA   ASP  93           HA       ASP  93  -1.006 -10.413   6.252
  697    HB2  ASP  93           1HB      ASP  93   0.202 -11.315   4.318
  698    HB3  ASP  93           2HB      ASP  93   1.606 -11.628   5.328
  699    HA   PRO  94           HA       PRO  94   0.834 -10.743  10.393
  700    HB2  PRO  94           1HB      PRO  94  -1.103 -12.078  11.752
  701    HB3  PRO  94           2HB      PRO  94  -1.392 -10.441  11.137
  702    HG2  PRO  94           1HG      PRO  94  -2.171 -13.056   9.859
  703    HG3  PRO  94           2HG      PRO  94  -3.195 -11.633  10.181
  704    HD2  PRO  94           1HD      PRO  94  -2.052 -12.030   7.718
  705    HD3  PRO  94           2HD      PRO  94  -2.261 -10.389   8.380
  706    H    ASP  95           H        ASP  95   1.926 -12.267  11.687
  707    HA   ASP  95           HA       ASP  95   2.540 -14.841  10.376
  708    HB2  ASP  95           1HB      ASP  95   4.361 -13.262  11.110
  709    HB3  ASP  95           2HB      ASP  95   3.864 -13.499  12.780
  710    H    ASN  96           H        ASN  96   0.054 -14.097  12.048
  711    HA   ASN  96           HA       ASN  96  -1.340 -15.101  13.529
  712    HB2  ASN  96           1HB      ASN  96  -0.907 -17.050  12.030
  713    HB3  ASN  96           2HB      ASN  96   0.403 -17.549  13.087
  714   HD21  ASN  96          2HD2      ASN  96  -0.483 -19.465  13.981
  715   HD22  ASN  96          1HD2      ASN  96  -1.943 -19.510  14.846
  716    H    ARG  97           H        ARG  97   1.486 -14.064  14.320
  717    HA   ARG  97           HA       ARG  97   1.209 -14.722  17.195
  718    HB2  ARG  97           1HB      ARG  97   3.803 -15.046  15.640
  719    HB3  ARG  97           2HB      ARG  97   3.635 -15.176  17.393
  720    HG2  ARG  97           1HG      ARG  97   2.016 -17.095  17.032
  721    HG3  ARG  97           2HG      ARG  97   2.363 -17.007  15.305
  722    HD2  ARG  97           1HD      ARG  97   4.440 -17.523  17.459
  723    HD3  ARG  97           2HD      ARG  97   3.732 -18.751  16.410
  724    HE   ARG  97           HE       ARG  97   4.756 -16.746  14.750
  725   HH11  ARG  97          1HH2      ARG  97   5.926 -19.081  17.054
  726   HH12  ARG  97          2HH2      ARG  97   7.466 -19.256  16.280
  727   HH21  ARG  97          1HH1      ARG  97   6.764 -16.985  13.760
  728   HH22  ARG  97          2HH1      ARG  97   7.937 -18.073  14.422
  729    H    VAL  98           H        VAL  98   1.849 -12.519  14.696
  730    HA   VAL  98           HA       VAL  98   3.492 -10.621  16.072
  731    HB   VAL  98           HB       VAL  98   3.191 -10.627  13.611
  732   HG11  VAL  98          1HG1      VAL  98   1.120  -9.754  12.596
  733   HG12  VAL  98          2HG1      VAL  98   0.371  -9.613  14.176
  734   HG13  VAL  98          3HG1      VAL  98   0.779 -11.203  13.536
  735   HG21  VAL  98          3HG2      VAL  98   3.902  -8.518  14.763
  736   HG22  VAL  98          1HG2      VAL  98   2.214  -8.011  14.855
  737   HG23  VAL  98          2HG2      VAL  98   2.997  -8.194  13.288
  738    H    ALA  99           H        ALA  99   0.094 -11.372  16.159
  739    HA   ALA  99           HA       ALA  99  -1.578 -10.700  17.546
  740    HB1  ALA  99           3HB      ALA  99   0.428 -10.429  19.249
  741    HB2  ALA  99           1HB      ALA  99  -1.118  -9.675  19.641
  742    HB3  ALA  99           2HB      ALA  99   0.205  -8.702  18.999
  743    H    GLU 100           H        GLU 100  -2.989  -8.808  17.939
  744    HA   GLU 100           HA       GLU 100  -2.979  -7.061  15.596
  745    HB2  GLU 100           1HB      GLU 100  -4.892  -7.265  17.951
  746    HB3  GLU 100           2HB      GLU 100  -5.160  -6.273  16.514
  747    HG2  GLU 100           1HG      GLU 100  -5.080  -8.309  15.092
  748    HG3  GLU 100           2HG      GLU 100  -4.823  -9.302  16.525
  749    H    SER 101           H        SER 101  -3.139  -6.497  19.114
  750    HA   SER 101           HA       SER 101  -2.951  -3.785  19.308
  751    HB2  SER 101           1HB      SER 101  -1.789  -4.095  21.438
  752    HB3  SER 101           2HB      SER 101  -2.967  -5.390  21.224
  753    HG   SER 101           HG       SER 101  -0.862  -6.306  20.082
  754    H    ASP 102           H        ASP 102  -0.205  -5.956  18.641
  755    HA   ASP 102           HA       ASP 102   1.767  -3.845  18.474
  756    HB2  ASP 102           1HB      ASP 102   1.843  -6.670  17.373
  757    HB3  ASP 102           2HB      ASP 102   3.232  -5.614  17.592
  758    H    LYS 103           H        LYS 103   0.069  -5.874  16.062
  759    HA   LYS 103           HA       LYS 103   1.112  -4.938  13.694
  760    HB2  LYS 103           1HB      LYS 103  -0.659  -6.705  13.911
  761    HB3  LYS 103           2HB      LYS 103  -1.858  -5.439  14.148
  762    HG2  LYS 103           1HG      LYS 103  -1.162  -4.482  11.868
  763    HG3  LYS 103           2HG      LYS 103  -0.167  -5.918  11.647
  764    HD2  LYS 103           1HD      LYS 103  -3.199  -5.874  12.030
  765    HD3  LYS 103           2HD      LYS 103  -2.354  -6.171  10.519
  766    HE2  LYS 103           1HE      LYS 103  -1.213  -8.159  11.749
  767    HE3  LYS 103           2HE      LYS 103  -2.506  -7.986  12.937
  768    HZ1  LYS 103           3HZ      LYS 103  -3.948  -7.925  10.741
  769    HZ2  LYS 103           1HZ      LYS 103  -3.521  -9.384  11.494
  770    HZ3  LYS 103           2HZ      LYS 103  -2.644  -8.839  10.146
  771    H    ALA 104           H        ALA 104  -1.469  -3.416  15.595
  772    HA   ALA 104           HA       ALA 104  -2.143  -1.271  13.967
  773    HB1  ALA 104           3HB      ALA 104  -1.909  -1.272  16.986
  774    HB2  ALA 104           1HB      ALA 104  -3.303  -1.839  16.068
  775    HB3  ALA 104           2HB      ALA 104  -2.857  -0.131  16.031
  776    H    ASN 105           H        ASN 105   0.927  -1.940  14.937
  777    HA   ASN 105           HA       ASN 105   1.910   0.816  15.328
  778    HB2  ASN 105           1HB      ASN 105   2.863  -1.082  16.659
  779    HB3  ASN 105           2HB      ASN 105   3.467  -1.800  15.172
  780   HD21  ASN 105          2HD2      ASN 105   5.725  -1.541  15.561
  781   HD22  ASN 105          1HD2      ASN 105   6.472  -0.029  15.751
  782    H    ASN 106           H        ASN 106   1.919  -1.758  12.864
  783    HA   ASN 106           HA       ASN 106   3.557  -0.166  10.995
  784    HB2  ASN 106           1HB      ASN 106   3.406  -2.244   9.585
  785    HB3  ASN 106           2HB      ASN 106   4.097  -2.540  11.178
  786   HD21  ASN 106          2HD2      ASN 106   0.750  -2.476   9.763
  787   HD22  ASN 106          1HD2      ASN 106   0.262  -3.902  10.536
  788    H    VAL 107           H        VAL 107   1.191   1.096  11.571
  789    HA   VAL 107           HA       VAL 107  -0.624   0.590   9.248
  790    HB   VAL 107           HB       VAL 107  -1.041   2.341  11.710
  791   HG11  VAL 107          1HG1      VAL 107  -2.928   1.550   9.430
  792   HG12  VAL 107          2HG1      VAL 107  -2.362   3.182   9.789
  793   HG13  VAL 107          3HG1      VAL 107  -3.443   2.364  10.910
  794   HG21  VAL 107          3HG2      VAL 107  -0.981  -0.092  12.213
  795   HG22  VAL 107          1HG2      VAL 107  -2.195  -0.386  10.969
  796   HG23  VAL 107          2HG2      VAL 107  -2.611   0.556  12.403
  797    H    PHE 108           H        PHE 108  -0.778   1.994   7.633
  798    HA   PHE 108           HA       PHE 108   0.383   4.705   7.838
  799    HB2  PHE 108           1HB      PHE 108   1.129   2.750   5.615
  800    HB3  PHE 108           2HB      PHE 108   1.717   4.399   5.810
  801    HD1  PHE 108           HD1      PHE 108   2.763   4.929   8.252
  802    HD2  PHE 108           HD2      PHE 108   2.584   1.002   6.455
  803    HE1  PHE 108           HE1      PHE 108   4.582   4.154   9.738
  804    HE2  PHE 108           HE2      PHE 108   4.403   0.248   7.959
  805    HZ   PHE 108           HZ       PHE 108   5.404   1.821   9.594
  806    H    SER 109           H        SER 109  -0.541   6.176   6.503
  807    HA   SER 109           HA       SER 109  -2.330   5.480   4.345
  808    HB2  SER 109           1HB      SER 109  -3.772   4.955   6.289
  809    HB3  SER 109           2HB      SER 109  -3.521   6.578   6.923
  810    HG   SER 109           HG       SER 109  -4.433   6.206   4.283
  811    H    ARG 110           H        ARG 110  -2.870   7.261   3.125
  812    HA   ARG 110           HA       ARG 110  -1.882   9.934   4.026
  813    HB2  ARG 110           1HB      ARG 110  -0.178   8.830   2.557
  814    HB3  ARG 110           2HB      ARG 110  -1.381   8.717   1.275
  815    HG2  ARG 110           1HG      ARG 110  -1.618  11.218   1.311
  816    HG3  ARG 110           2HG      ARG 110  -0.387  11.297   2.565
  817    HD2  ARG 110           1HD      ARG 110   1.234  10.226   0.993
  818    HD3  ARG 110           2HD      ARG 110  -0.002  10.261  -0.269
  819    HE   ARG 110           HE       ARG 110   1.613  12.474   0.629
  820   HH11  ARG 110          1HH2      ARG 110  -1.506  11.617  -0.652
  821   HH12  ARG 110          2HH2      ARG 110  -1.815  13.191  -1.304
  822   HH21  ARG 110          1HH1      ARG 110   1.184  14.535  -0.222
  823   HH22  ARG 110          2HH1      ARG 110  -0.301  14.832  -1.062
  824    H    ILE 111           H        ILE 111  -3.344  11.445   3.779
  825    HA   ILE 111           HA       ILE 111  -5.869  10.867   2.450
  826    HB   ILE 111           HB       ILE 111  -4.969  13.520   3.684
  827   HG12  ILE 111          1HG1      ILE 111  -4.617  11.831   5.417
  828   HG13  ILE 111          2HG1      ILE 111  -6.088  12.710   5.802
  829   HG21  ILE 111          1HG2      ILE 111  -7.401  13.845   4.041
  830   HG22  ILE 111          2HG2      ILE 111  -7.727  12.286   3.283
  831   HG23  ILE 111          3HG2      ILE 111  -7.042  13.602   2.330
  832   HD11  ILE 111          3HD1      ILE 111  -7.363  10.775   4.655
  833   HD12  ILE 111          1HD1      ILE 111  -6.585  10.415   6.191
  834   HD13  ILE 111          2HD1      ILE 111  -5.829   9.904   4.689
  835    H    VAL 112           H        VAL 112  -6.458  11.519   0.459
  836    HA   VAL 112           HA       VAL 112  -5.050  13.697  -0.940
  837    HB   VAL 112           HB       VAL 112  -3.691  11.688  -1.442
  838   HG11  VAL 112          1HG1      VAL 112  -4.606   9.795  -2.709
  839   HG12  VAL 112          2HG1      VAL 112  -6.214  10.520  -2.693
  840   HG13  VAL 112          3HG1      VAL 112  -5.480   9.971  -1.187
  841   HG21  VAL 112          3HG2      VAL 112  -3.709  11.862  -3.896
  842   HG22  VAL 112          1HG2      VAL 112  -3.977  13.456  -3.195
  843   HG23  VAL 112          2HG2      VAL 112  -5.331  12.553  -3.870
  844    H    LYS 113           H        LYS 113  -6.274  14.690  -2.463
  845    HA   LYS 113           HA       LYS 113  -8.973  13.594  -3.111
  846    HB2  LYS 113           1HB      LYS 113  -8.335  16.421  -2.149
  847    HB3  LYS 113           2HB      LYS 113  -9.900  15.893  -2.773
  848    HG2  LYS 113           1HG      LYS 113 -10.037  14.190  -0.944
  849    HG3  LYS 113           2HG      LYS 113  -8.500  14.778  -0.306
  850    HD2  LYS 113           1HD      LYS 113  -9.522  17.028   0.048
  851    HD3  LYS 113           2HD      LYS 113 -11.061  16.413  -0.559
  852    HE2  LYS 113           1HE      LYS 113  -9.584  15.385   1.900
  853    HE3  LYS 113           2HE      LYS 113 -11.042  16.377   1.916
  854    HZ1  LYS 113           3HZ      LYS 113 -10.715  13.551   1.249
  855    HZ2  LYS 113           1HZ      LYS 113 -11.882  14.419   0.374
  856    HZ3  LYS 113           2HZ      LYS 113 -11.980  14.334   2.068
  857    H    VAL 114           H        VAL 114  -9.788  14.224  -5.074
  858    HA   VAL 114           HA       VAL 114  -7.794  15.183  -7.048
  859    HB   VAL 114           HB       VAL 114  -9.392  14.251  -8.720
  860   HG11  VAL 114          1HG1      VAL 114  -7.589  12.820  -7.795
  861   HG12  VAL 114          2HG1      VAL 114  -9.025  11.861  -8.149
  862   HG13  VAL 114          3HG1      VAL 114  -8.655  12.312  -6.484
  863   HG21  VAL 114          3HG2      VAL 114 -11.295  12.820  -7.880
  864   HG22  VAL 114          1HG2      VAL 114 -11.528  14.527  -7.518
  865   HG23  VAL 114          2HG2      VAL 114 -10.999  13.422  -6.254
  866    H    LEU 115           H        LEU 115  -8.037  17.051  -8.149
  867    HA   LEU 115           HA       LEU 115 -10.568  18.520  -8.160
  868    HB2  LEU 115           1HB      LEU 115  -9.265  19.130  -5.996
  869    HB3  LEU 115           2HB      LEU 115  -8.089  19.906  -7.042
  870    HG   LEU 115           HG       LEU 115 -10.261  21.184  -8.034
  871   HD11  LEU 115          1HD1      LEU 115 -11.999  21.601  -6.327
  872   HD12  LEU 115          2HD1      LEU 115 -11.200  20.489  -5.215
  873   HD13  LEU 115          3HD1      LEU 115 -11.926  19.883  -6.699
  874   HD21  LEU 115          3HD2      LEU 115  -9.073  21.901  -5.318
  875   HD22  LEU 115          1HD2      LEU 115  -9.955  23.013  -6.369
  876   HD23  LEU 115          2HD2      LEU 115  -8.406  22.352  -6.886
  877    H    GLU 116           H        GLU 116 -10.818  19.662  -9.955
  878    HA   GLU 116           HA       GLU 116  -8.665  20.813 -11.476
  879    HB2  GLU 116           1HB      GLU 116  -8.380  18.358 -12.054
  880    HB3  GLU 116           2HB      GLU 116 -10.005  18.363 -12.726
  881    HG2  GLU 116           1HG      GLU 116  -8.392  18.657 -14.548
  882    HG3  GLU 116           2HG      GLU 116  -9.273  20.161 -14.351
  883    H    HIS 117           H        HIS 117  -9.945  22.639 -11.386
  884    HA   HIS 117           HA       HIS 117 -11.450  24.162 -12.131
  885    HB2  HIS 117           1HB      HIS 117 -10.899  23.127 -14.390
  886    HB3  HIS 117           2HB      HIS 117 -12.318  22.109 -14.219
  887    HD1  HIS 117           HD1      HIS 117 -14.669  23.373 -14.079
  888    HD2  HIS 117           HD2      HIS 117 -11.434  25.709 -15.287
  889    HE1  HIS 117           HE1      HIS 117 -15.646  25.446 -15.160
  890    HE2  HIS 117           HE2      HIS 117 -13.685  26.880 -15.900
  891    H    HIS 118           H        HIS 118 -12.395  21.049 -11.116
  892    HA   HIS 118           HA       HIS 118 -14.239  20.179 -10.105
  893    HB2  HIS 118           1HB      HIS 118 -13.739  22.139  -8.572
  894    HB3  HIS 118           2HB      HIS 118 -14.944  23.078  -9.448
  895    HD1  HIS 118           HD1      HIS 118 -17.444  22.511  -8.998
  896    HD2  HIS 118           HD2      HIS 118 -14.807  19.986  -6.984
  897    HE1  HIS 118           HE1      HIS 118 -18.846  21.142  -7.391
  898    HE2  HIS 118           HE2      HIS 118 -17.252  19.600  -6.157
  899    H    HIS 119           H        HIS 119 -16.805  20.511  -9.961
  900    HA   HIS 119           HA       HIS 119 -18.774  20.399 -11.107
  901    HB2  HIS 119           1HB      HIS 119 -17.660  22.669 -12.816
  902    HB3  HIS 119           2HB      HIS 119 -19.352  22.229 -12.614
  903    HD1  HIS 119           HD1      HIS 119 -20.284  22.472 -10.065
  904    HD2  HIS 119           HD2      HIS 119 -16.723  24.457 -10.934
  905    HE1  HIS 119           HE1      HIS 119 -19.933  24.162  -8.211
  906    HE2  HIS 119           HE2      HIS 119 -17.765  25.380  -8.727
  907    H    HIS 120           H        HIS 120 -16.696  21.368 -13.833
  908    HA   HIS 120           HA       HIS 120 -16.303  20.424 -15.870
  909    HB2  HIS 120           1HB      HIS 120 -14.968  18.884 -14.440
  910    HB3  HIS 120           2HB      HIS 120 -16.368  17.829 -14.271
  911    HD1  HIS 120           HD1      HIS 120 -14.093  19.228 -16.992
  912    HD2  HIS 120           HD2      HIS 120 -16.644  15.992 -16.357
  913    HE1  HIS 120           HE1      HIS 120 -13.879  17.736 -19.028
  914    HE2  HIS 120           HE2      HIS 120 -15.428  15.760 -18.657
  915    H    HIS 121           H        HIS 121 -18.053  20.761 -17.174
  916    HA   HIS 121           HA       HIS 121 -20.008  20.427 -18.291
  917    HB2  HIS 121           1HB      HIS 121 -18.835  18.308 -18.909
  918    HB3  HIS 121           2HB      HIS 121 -19.578  17.506 -17.533
  919    HD1  HIS 121           HD1      HIS 121 -20.674  19.424 -20.649
  920    HD2  HIS 121           HD2      HIS 121 -22.044  16.392 -18.136
  921    HE1  HIS 121           HE1      HIS 121 -22.844  18.587 -21.651
  922    HE2  HIS 121           HE2      HIS 121 -23.692  16.740 -20.130
  923    H    HIS 122           H        HIS 122 -22.323  19.512 -18.050
  924    HA   HIS 122           HA       HIS 122 -24.288  19.597 -16.874
  925    HB2  HIS 122           1HB      HIS 122 -23.437  17.390 -16.108
  926    HB3  HIS 122           2HB      HIS 122 -22.628  18.172 -14.757
  927    HD1  HIS 122           HD1      HIS 122 -24.029  18.744 -12.714
  928    HD2  HIS 122           HD2      HIS 122 -26.353  17.476 -15.935
  929    HE1  HIS 122           HE1      HIS 122 -26.389  18.476 -11.833
  930    HE2  HIS 122           HE2      HIS 122 -27.818  17.705 -13.785
  Start of MODEL    5
    1    H1   MET   1           1H       MET   1  13.145   7.280   6.504
    2    H2   MET   1           2H       MET   1  14.076   6.948   5.121
    3    H3   MET   1           3H       MET   1  12.400   7.197   4.982
    4    HA   MET   1           HA       MET   1  13.262   9.468   6.217
    5    HB2  MET   1           1HB      MET   1  15.202   8.648   4.024
    6    HB3  MET   1           2HB      MET   1  15.128  10.248   4.756
    7    HG2  MET   1           1HG      MET   1  15.659   9.275   6.968
    8    HG3  MET   1           2HG      MET   1  15.738   7.665   6.252
    9    HE1  MET   1           3HE      MET   1  17.951   6.652   5.409
   10    HE2  MET   1           1HE      MET   1  18.945   7.547   4.254
   11    HE3  MET   1           2HE      MET   1  17.228   7.323   3.954
   12    H    ASP   2           H        ASP   2  11.268   7.985   4.591
   13    HA   ASP   2           HA       ASP   2  10.434  10.225   2.892
   14    HB2  ASP   2           1HB      ASP   2  10.906   7.444   1.747
   15    HB3  ASP   2           2HB      ASP   2  10.114   8.774   0.900
   16    H    LEU   3           H        LEU   3   8.283   9.632   1.849
   17    HA   LEU   3           HA       LEU   3   6.520   9.006   3.951
   18    HB2  LEU   3           1HB      LEU   3   6.143   9.536   1.019
   19    HB3  LEU   3           2HB      LEU   3   4.755   9.010   1.967
   20    HG   LEU   3           HG       LEU   3   4.971  11.516   1.721
   21   HD11  LEU   3          1HD1      LEU   3   3.687  10.520   3.603
   22   HD12  LEU   3          2HD1      LEU   3   4.376  12.099   3.972
   23   HD13  LEU   3          3HD1      LEU   3   5.125  10.654   4.615
   24   HD21  LEU   3          3HD2      LEU   3   7.510  11.558   1.915
   25   HD22  LEU   3          1HD2      LEU   3   7.308  11.314   3.654
   26   HD23  LEU   3          2HD2      LEU   3   6.671  12.763   2.888
   27    HA   PRO   4           HA       PRO   4   6.251   4.580   3.551
   28    HB2  PRO   4           1HB      PRO   4   3.832   4.030   4.749
   29    HB3  PRO   4           2HB      PRO   4   5.209   4.668   5.681
   30    HG2  PRO   4           1HG      PRO   4   2.861   6.175   4.527
   31    HG3  PRO   4           2HG      PRO   4   3.544   6.273   6.164
   32    HD2  PRO   4           1HD      PRO   4   4.187   8.110   4.220
   33    HD3  PRO   4           2HD      PRO   4   5.354   7.624   5.464
   34    H    ILE   5           H        ILE   5   3.692   6.588   2.237
   35    HA   ILE   5           HA       ILE   5   3.067   4.499   0.172
   36    HB   ILE   5           HB       ILE   5   1.115   6.477   1.418
   37   HG12  ILE   5          1HG1      ILE   5   1.264   3.437   1.740
   38   HG13  ILE   5          2HG1      ILE   5   1.820   4.575   2.957
   39   HG21  ILE   5          1HG2      ILE   5   0.714   4.212  -0.598
   40   HG22  ILE   5          2HG2      ILE   5   0.557   5.932  -0.955
   41   HG23  ILE   5          3HG2      ILE   5  -0.596   5.154   0.111
   42   HD11  ILE   5          3HD1      ILE   5  -0.414   3.838   3.534
   43   HD12  ILE   5          1HD1      ILE   5  -1.015   4.294   1.945
   44   HD13  ILE   5          2HD1      ILE   5  -0.476   5.538   3.075
   45    H    THR   6           H        THR   6   3.339   5.140  -1.863
   46    HA   THR   6           HA       THR   6   3.322   8.058  -2.530
   47    HB   THR   6           HB       THR   6   5.343   6.065  -3.647
   48    HG1  THR   6           HG1      THR   6   5.875   6.427  -1.540
   49   HG21  THR   6          3HG2      THR   6   5.167   9.101  -3.795
   50   HG22  THR   6          1HG2      THR   6   4.849   7.996  -5.134
   51   HG23  THR   6          2HG2      THR   6   6.471   8.119  -4.458
   52    H    LEU   7           H        LEU   7   1.884   8.474  -4.041
   53    HA   LEU   7           HA       LEU   7   0.911   6.319  -5.853
   54    HB2  LEU   7           1HB      LEU   7  -0.332   9.009  -5.187
   55    HB3  LEU   7           2HB      LEU   7  -1.086   7.693  -6.083
   56    HG   LEU   7           HG       LEU   7  -0.253   7.604  -3.145
   57   HD11  LEU   7          1HD1      LEU   7  -2.242   8.987  -3.524
   58   HD12  LEU   7          2HD1      LEU   7  -2.691   7.492  -2.709
   59   HD13  LEU   7          3HD1      LEU   7  -3.003   7.683  -4.437
   60   HD21  LEU   7          3HD2      LEU   7  -1.473   5.494  -4.967
   61   HD22  LEU   7          1HD2      LEU   7  -1.658   5.404  -3.213
   62   HD23  LEU   7          2HD2      LEU   7  -0.055   5.349  -3.923
   63    H    SER   8           H        SER   8   0.880   6.576  -8.036
   64    HA   SER   8           HA       SER   8   2.821   8.420  -9.171
   65    HB2  SER   8           1HB      SER   8   1.048   6.289 -10.411
   66    HB3  SER   8           2HB      SER   8   2.250   7.223 -11.297
   67    HG   SER   8           HG       SER   8   3.798   6.136 -10.356
   68    H    LYS   9           H        LYS   9   0.771   9.870  -8.009
   69    HA   LYS   9           HA       LYS   9  -1.231  10.678  -9.933
   70    HB2  LYS   9           1HB      LYS   9  -1.721  12.454  -8.245
   71    HB3  LYS   9           2HB      LYS   9  -1.743  10.826  -7.564
   72    HG2  LYS   9           1HG      LYS   9   0.302  11.133  -6.370
   73    HG3  LYS   9           2HG      LYS   9   0.855  12.441  -7.400
   74    HD2  LYS   9           1HD      LYS   9   0.180  13.278  -5.172
   75    HD3  LYS   9           2HD      LYS   9  -0.824  13.963  -6.448
   76    HE2  LYS   9           1HE      LYS   9  -2.111  13.176  -4.382
   77    HE3  LYS   9           2HE      LYS   9  -2.672  12.479  -5.901
   78    HZ1  LYS   9           3HZ      LYS   9  -1.937  10.450  -5.343
   79    HZ2  LYS   9           1HZ      LYS   9  -2.064  11.040  -3.758
   80    HZ3  LYS   9           2HZ      LYS   9  -0.557  11.032  -4.544
   81    H    GLU  10           H        GLU  10   1.055  10.832 -11.326
   82    HA   GLU  10           HA       GLU  10   2.525  13.251 -11.203
   83    HB2  GLU  10           1HB      GLU  10   1.954  11.224 -13.386
   84    HB3  GLU  10           2HB      GLU  10   2.828  12.695 -13.805
   85    HG2  GLU  10           1HG      GLU  10   4.399  10.858 -13.281
   86    HG3  GLU  10           2HG      GLU  10   4.548  12.164 -12.109
   87    H    THR  11           H        THR  11  -0.415  12.435 -13.010
   88    HA   THR  11           HA       THR  11  -0.900  15.341 -13.537
   89    HB   THR  11           HB       THR  11  -2.091  14.623 -15.553
   90    HG1  THR  11           HG1      THR  11  -2.325  12.386 -14.395
   91   HG21  THR  11          3HG2      THR  11  -0.157  13.855 -16.862
   92   HG22  THR  11          1HG2      THR  11   0.655  13.322 -15.388
   93   HG23  THR  11          2HG2      THR  11   0.383  15.042 -15.671
   94    HA   PRO  12           HA       PRO  12  -4.141  13.892 -10.462
   95    HB2  PRO  12           1HB      PRO  12  -4.444  16.925 -10.568
   96    HB3  PRO  12           2HB      PRO  12  -4.619  15.839  -9.163
   97    HG2  PRO  12           1HG      PRO  12  -2.362  17.193  -9.450
   98    HG3  PRO  12           2HG      PRO  12  -2.282  15.468  -9.018
   99    HD2  PRO  12           1HD      PRO  12  -1.765  16.749 -11.718
  100    HD3  PRO  12           2HD      PRO  12  -0.916  15.384 -10.951
  101    H    PHE  13           H        PHE  13  -5.903  13.025 -11.454
  102    HA   PHE  13           HA       PHE  13  -7.892  14.677 -12.714
  103    HB2  PHE  13           1HB      PHE  13  -6.180  14.438 -14.559
  104    HB3  PHE  13           2HB      PHE  13  -6.422  12.697 -14.518
  105    HD1  PHE  13           HD2      PHE  13  -8.007  15.971 -15.302
  106    HD2  PHE  13           HD1      PHE  13  -8.529  11.693 -15.379
  107    HE1  PHE  13           HE2      PHE  13 -10.019  16.234 -16.725
  108    HE2  PHE  13           HE1      PHE  13 -10.541  11.969 -16.799
  109    HZ   PHE  13           HZ       PHE  13 -11.283  14.237 -17.471
  110    H    GLU  14           H        GLU  14  -9.697  13.783 -11.939
  111    HA   GLU  14           HA       GLU  14  -9.927  11.230 -10.805
  112    HB2  GLU  14           1HB      GLU  14 -11.509  13.118 -10.415
  113    HB3  GLU  14           2HB      GLU  14 -12.169  12.880 -12.029
  114    HG2  GLU  14           1HG      GLU  14 -12.872  10.576 -11.405
  115    HG3  GLU  14           2HG      GLU  14 -12.177  10.795  -9.804
  116    H    GLY  15           H        GLY  15 -10.763   9.264 -11.544
  117    HA2  GLY  15           1HA      GLY  15 -11.561   7.697 -13.084
  118    HA3  GLY  15           2HA      GLY  15 -11.496   8.885 -14.373
  119    H    GLU  16           H        GLU  16  -8.675   9.588 -13.502
  120    HA   GLU  16           HA       GLU  16  -7.297   7.845 -15.299
  121    HB2  GLU  16           1HB      GLU  16  -6.632  10.222 -14.836
  122    HB3  GLU  16           2HB      GLU  16  -6.081   9.736 -13.239
  123    HG2  GLU  16           1HG      GLU  16  -4.428   8.195 -14.270
  124    HG3  GLU  16           2HG      GLU  16  -5.010   8.636 -15.871
  125    H    GLU  17           H        GLU  17  -5.782   6.239 -14.883
  126    HA   GLU  17           HA       GLU  17  -6.257   4.697 -12.477
  127    HB2  GLU  17           1HB      GLU  17  -5.913   3.689 -14.760
  128    HB3  GLU  17           2HB      GLU  17  -4.225   4.189 -14.691
  129    HG2  GLU  17           1HG      GLU  17  -3.909   2.823 -12.630
  130    HG3  GLU  17           2HG      GLU  17  -5.598   2.327 -12.703
  131    H    ILE  18           H        ILE  18  -5.018   4.619 -10.699
  132    HA   ILE  18           HA       ILE  18  -2.408   6.099 -10.637
  133    HB   ILE  18           HB       ILE  18  -2.915   6.556  -8.245
  134   HG12  ILE  18          1HG1      ILE  18  -5.724   5.522  -8.892
  135   HG13  ILE  18          2HG1      ILE  18  -4.560   4.631  -7.925
  136   HG21  ILE  18          1HG2      ILE  18  -4.596   8.338  -8.672
  137   HG22  ILE  18          2HG2      ILE  18  -5.044   7.557 -10.185
  138   HG23  ILE  18          3HG2      ILE  18  -3.436   8.252  -9.992
  139   HD11  ILE  18          3HD1      ILE  18  -5.742   7.338  -7.246
  140   HD12  ILE  18          1HD1      ILE  18  -4.473   6.537  -6.315
  141   HD13  ILE  18          2HD1      ILE  18  -6.072   5.806  -6.441
  142    H    THR  19           H        THR  19  -0.710   5.182  -9.584
  143    HA   THR  19           HA       THR  19  -0.861   2.263  -9.197
  144    HB   THR  19           HB       THR  19   1.571   4.096  -9.086
  145    HG1  THR  19           HG1      THR  19   0.844   4.254 -11.118
  146   HG21  THR  19          3HG2      THR  19   2.807   1.995  -9.567
  147   HG22  THR  19          1HG2      THR  19   1.296   1.092  -9.483
  148   HG23  THR  19          2HG2      THR  19   1.937   1.878  -8.040
  149    H    VAL  20           H        VAL  20  -1.363   1.530  -7.230
  150    HA   VAL  20           HA       VAL  20  -0.753   3.163  -4.834
  151    HB   VAL  20           HB       VAL  20  -2.480   0.665  -5.024
  152   HG11  VAL  20          1HG1      VAL  20  -1.706   1.167  -2.723
  153   HG12  VAL  20          2HG1      VAL  20  -3.418   1.573  -2.859
  154   HG13  VAL  20          3HG1      VAL  20  -2.207   2.849  -2.897
  155   HG21  VAL  20          3HG2      VAL  20  -3.277   3.611  -5.122
  156   HG22  VAL  20          1HG2      VAL  20  -4.406   2.259  -5.010
  157   HG23  VAL  20          2HG2      VAL  20  -3.418   2.463  -6.454
  158    H    SER  21           H        SER  21   1.159   2.771  -3.938
  159    HA   SER  21           HA       SER  21   2.167  -0.033  -3.743
  160    HB2  SER  21           1HB      SER  21   4.405   0.821  -3.994
  161    HB3  SER  21           2HB      SER  21   3.441   1.474  -5.319
  162    HG   SER  21           HG       SER  21   4.495   2.729  -3.059
  163    H    ALA  22           H        ALA  22   2.798  -0.702  -1.793
  164    HA   ALA  22           HA       ALA  22   2.708   1.218   0.512
  165    HB1  ALA  22           3HB      ALA  22   0.823  -0.384   0.493
  166    HB2  ALA  22           1HB      ALA  22   1.909  -0.685   1.852
  167    HB3  ALA  22           2HB      ALA  22   1.961  -1.726   0.430
  168    H    ARG  23           H        ARG  23   4.578   1.458   1.518
  169    HA   ARG  23           HA       ARG  23   6.859  -0.306   0.948
  170    HB2  ARG  23           1HB      ARG  23   6.549   2.241   2.590
  171    HB3  ARG  23           2HB      ARG  23   8.080   1.383   2.389
  172    HG2  ARG  23           1HG      ARG  23   7.948   1.682  -0.062
  173    HG3  ARG  23           2HG      ARG  23   6.401   2.510   0.105
  174    HD2  ARG  23           1HD      ARG  23   7.486   4.277   1.420
  175    HD3  ARG  23           2HD      ARG  23   9.034   3.458   1.305
  176    HE   ARG  23           HE       ARG  23   7.781   5.087  -0.725
  177   HH11  ARG  23          1HH2      ARG  23   9.913   2.401  -0.167
  178   HH12  ARG  23          2HH2      ARG  23  10.738   2.569  -1.681
  179   HH21  ARG  23          1HH1      ARG  23   8.860   5.285  -2.719
  180   HH22  ARG  23          2HH1      ARG  23  10.142   4.194  -3.119
  181    H    VAL  24           H        VAL  24   7.018  -2.136   2.067
  182    HA   VAL  24           HA       VAL  24   5.948  -2.371   4.804
  183    HB   VAL  24           HB       VAL  24   7.240  -4.515   3.052
  184   HG11  VAL  24          1HG1      VAL  24   5.397  -4.683   5.477
  185   HG12  VAL  24          2HG1      VAL  24   7.114  -5.069   5.474
  186   HG13  VAL  24          3HG1      VAL  24   5.991  -6.061   4.552
  187   HG21  VAL  24          3HG2      VAL  24   4.884  -5.175   2.509
  188   HG22  VAL  24          1HG2      VAL  24   5.276  -3.575   1.880
  189   HG23  VAL  24          2HG2      VAL  24   4.306  -3.735   3.347
  190    H    THR  25           H        THR  25   7.250  -1.897   6.459
  191    HA   THR  25           HA       THR  25  10.175  -1.853   6.124
  192    HB   THR  25           HB       THR  25   8.428  -1.065   8.493
  193    HG1  THR  25           HG1      THR  25   9.127   1.050   7.713
  194   HG21  THR  25          3HG2      THR  25  10.549   0.197   9.168
  195   HG22  THR  25          1HG2      THR  25  11.423  -0.763   7.977
  196   HG23  THR  25          2HG2      THR  25  10.648  -1.557   9.360
  197    H    ASN  26           H        ASN  26  11.423  -3.530   6.706
  198    HA   ASN  26           HA       ASN  26  10.318  -5.701   8.426
  199    HB2  ASN  26           1HB      ASN  26  12.676  -5.664   6.510
  200    HB3  ASN  26           2HB      ASN  26  12.171  -7.050   7.470
  201   HD21  ASN  26          2HD2      ASN  26  11.376  -8.429   5.807
  202   HD22  ASN  26          1HD2      ASN  26  10.097  -7.999   4.783
  203    H    ARG  27           H        ARG  27  10.793  -5.424  10.474
  204    HA   ARG  27           HA       ARG  27  12.823  -3.822  11.562
  205    HB2  ARG  27           1HB      ARG  27  11.283  -6.188  12.666
  206    HB3  ARG  27           2HB      ARG  27  12.285  -5.146  13.671
  207    HG2  ARG  27           1HG      ARG  27  10.083  -3.898  11.924
  208    HG3  ARG  27           2HG      ARG  27   9.664  -4.623  13.484
  209    HD2  ARG  27           1HD      ARG  27  11.240  -3.111  14.633
  210    HD3  ARG  27           2HD      ARG  27  11.725  -2.416  13.093
  211    HE   ARG  27           HE       ARG  27   8.911  -2.221  13.389
  212   HH11  ARG  27          1HH2      ARG  27  11.888  -0.900  14.604
  213   HH12  ARG  27          2HH2      ARG  27  11.199   0.638  15.004
  214   HH21  ARG  27          1HH1      ARG  27   8.016  -0.195  13.916
  215   HH22  ARG  27          2HH1      ARG  27   9.015   1.035  14.616
  216    H    GLY  28           H        GLY  28  14.894  -4.202  12.153
  217    HA2  GLY  28           1HA      GLY  28  16.374  -6.249  10.862
  218    HA3  GLY  28           2HA      GLY  28  16.978  -5.182  12.134
  219    H    ALA  29           H        ALA  29  16.508  -8.286  11.343
  220    HA   ALA  29           HA       ALA  29  17.031  -9.319  13.942
  221    HB1  ALA  29           3HB      ALA  29  14.207  -9.719  12.870
  222    HB2  ALA  29           1HB      ALA  29  14.635  -8.847  14.336
  223    HB3  ALA  29           2HB      ALA  29  14.890 -10.585  14.248
  224    H    ALA  30           H        ALA  30  14.954 -10.699  11.438
  225    HA   ALA  30           HA       ALA  30  17.168 -12.414  10.443
  226    HB1  ALA  30           3HB      ALA  30  14.491 -13.461  11.446
  227    HB2  ALA  30           1HB      ALA  30  16.034 -13.659  12.269
  228    HB3  ALA  30           2HB      ALA  30  15.770 -14.427  10.702
  229    H    GLU  31           H        GLU  31  16.870 -13.198   8.379
  230    HA   GLU  31           HA       GLU  31  15.473 -11.582   6.551
  231    HB2  GLU  31           1HB      GLU  31  16.473 -14.437   6.221
  232    HB3  GLU  31           2HB      GLU  31  15.985 -13.378   4.894
  233    HG2  GLU  31           1HG      GLU  31  17.746 -11.759   5.534
  234    HG3  GLU  31           2HG      GLU  31  18.236 -12.807   6.861
  235    H    ALA  32           H        ALA  32  13.325 -11.416   6.312
  236    HA   ALA  32           HA       ALA  32  11.517 -13.612   7.096
  237    HB1  ALA  32           3HB      ALA  32  11.017 -11.310   7.862
  238    HB2  ALA  32           1HB      ALA  32   9.742 -11.927   6.808
  239    HB3  ALA  32           2HB      ALA  32  10.921 -10.770   6.186
  240    H    HIS  33           H        HIS  33   9.951 -14.452   5.679
  241    HA   HIS  33           HA       HIS  33  10.197 -13.889   2.775
  242    HB2  HIS  33           1HB      HIS  33  10.370 -16.685   3.980
  243    HB3  HIS  33           2HB      HIS  33  10.387 -16.283   2.260
  244    HD1  HIS  33           HD1      HIS  33  12.548 -16.554   5.233
  245    HD2  HIS  33           HD2      HIS  33  12.805 -14.811   1.455
  246    HE1  HIS  33           HE1      HIS  33  14.993 -16.009   4.861
  247    HE2  HIS  33           HE2      HIS  33  15.167 -14.945   2.563
  248    H    ASN  34           H        ASN  34   8.497 -15.105   1.571
  249    HA   ASN  34           HA       ASN  34   6.229 -15.242   1.143
  250    HB2  ASN  34           1HB      ASN  34   6.312 -16.663   3.828
  251    HB3  ASN  34           2HB      ASN  34   5.001 -16.782   2.654
  252   HD21  ASN  34          2HD2      ASN  34   6.737 -18.990   3.618
  253   HD22  ASN  34          1HD2      ASN  34   7.511 -19.611   2.240
  254    H    VAL  35           H        VAL  35   6.492 -12.782   1.675
  255    HA   VAL  35           HA       VAL  35   4.630 -12.006   3.889
  256    HB   VAL  35           HB       VAL  35   6.736 -10.277   2.527
  257   HG11  VAL  35          1HG1      VAL  35   5.045  -9.865   5.043
  258   HG12  VAL  35          2HG1      VAL  35   4.856  -8.989   3.527
  259   HG13  VAL  35          3HG1      VAL  35   6.316  -8.773   4.488
  260   HG21  VAL  35          3HG2      VAL  35   7.830 -12.087   3.812
  261   HG22  VAL  35          1HG2      VAL  35   6.798 -11.750   5.204
  262   HG23  VAL  35          2HG2      VAL  35   7.997 -10.564   4.687
  263    HA   PRO  36           HA       PRO  36   2.518 -10.907  -0.107
  264    HB2  PRO  36           1HB      PRO  36   0.076 -11.997   0.313
  265    HB3  PRO  36           2HB      PRO  36   1.465 -13.032  -0.104
  266    HG2  PRO  36           1HG      PRO  36   0.316 -12.453   2.632
  267    HG3  PRO  36           2HG      PRO  36   0.724 -14.029   1.916
  268    HD2  PRO  36           1HD      PRO  36   2.428 -12.703   3.615
  269    HD3  PRO  36           2HD      PRO  36   3.031 -13.751   2.314
  270    H    VAL  37           H        VAL  37   2.223  -8.751   0.013
  271    HA   VAL  37           HA       VAL  37   0.967  -7.459   2.278
  272    HB   VAL  37           HB       VAL  37   2.786  -6.398   0.989
  273   HG11  VAL  37          1HG1      VAL  37   0.763  -6.122  -1.283
  274   HG12  VAL  37          2HG1      VAL  37   2.138  -7.227  -1.289
  275   HG13  VAL  37          3HG1      VAL  37   2.402  -5.486  -1.259
  276   HG21  VAL  37          3HG2      VAL  37   0.183  -4.817   0.778
  277   HG22  VAL  37          1HG2      VAL  37   1.813  -4.150   0.842
  278   HG23  VAL  37          2HG2      VAL  37   1.147  -4.981   2.249
  279    H    ALA  38           H        ALA  38  -1.049  -6.469   2.349
  280    HA   ALA  38           HA       ALA  38  -2.970  -7.042   0.125
  281    HB1  ALA  38           3HB      ALA  38  -3.450  -7.311   3.118
  282    HB2  ALA  38           1HB      ALA  38  -3.275  -8.648   1.980
  283    HB3  ALA  38           2HB      ALA  38  -4.657  -7.557   1.852
  284    H    VAL  39           H        VAL  39  -3.802  -5.211  -0.622
  285    HA   VAL  39           HA       VAL  39  -4.042  -2.831   1.163
  286    HB   VAL  39           HB       VAL  39  -3.699  -2.854  -1.865
  287   HG11  VAL  39          1HG1      VAL  39  -3.509  -0.614   0.194
  288   HG12  VAL  39          2HG1      VAL  39  -4.834  -0.832  -0.946
  289   HG13  VAL  39          3HG1      VAL  39  -3.224  -0.441  -1.531
  290   HG21  VAL  39          3HG2      VAL  39  -1.645  -3.718  -0.790
  291   HG22  VAL  39          1HG2      VAL  39  -1.639  -2.352   0.327
  292   HG23  VAL  39          2HG2      VAL  39  -1.366  -2.088  -1.396
  293    H    TYR  40           H        TYR  40  -5.929  -1.720   1.168
  294    HA   TYR  40           HA       TYR  40  -8.109  -2.367  -0.673
  295    HB2  TYR  40           1HB      TYR  40  -9.656  -3.029   1.216
  296    HB3  TYR  40           2HB      TYR  40  -8.384  -4.206   0.895
  297    HD1  TYR  40           HD1      TYR  40  -6.466  -4.488   2.454
  298    HD2  TYR  40           HD2      TYR  40  -9.597  -1.638   3.289
  299    HE1  TYR  40           HE1      TYR  40  -5.649  -4.259   4.788
  300    HE2  TYR  40           HE2      TYR  40  -8.764  -1.422   5.613
  301    HH   TYR  40           HH       TYR  40  -6.889  -3.501   7.109
  302    H    LEU  41           H        LEU  41  -9.350  -0.604  -0.970
  303    HA   LEU  41           HA       LEU  41  -8.824   1.814   0.642
  304    HB2  LEU  41           1HB      LEU  41 -10.116   1.245  -2.027
  305    HB3  LEU  41           2HB      LEU  41 -10.626   2.712  -1.194
  306    HG   LEU  41           HG       LEU  41  -8.253   3.448  -1.062
  307   HD11  LEU  41          1HD1      LEU  41  -7.700   0.923  -2.652
  308   HD12  LEU  41          2HD1      LEU  41  -7.093   1.285  -1.044
  309   HD13  LEU  41          3HD1      LEU  41  -6.523   2.210  -2.427
  310   HD21  LEU  41          3HD2      LEU  41  -9.152   2.700  -3.871
  311   HD22  LEU  41          1HD2      LEU  41  -7.950   3.934  -3.480
  312   HD23  LEU  41          2HD2      LEU  41  -9.629   4.150  -2.986
  313    H    GLY  42           H        GLY  42 -10.064   2.525   2.202
  314    HA2  GLY  42           1HA      GLY  42 -12.341   3.100   2.918
  315    HA3  GLY  42           2HA      GLY  42 -12.828   1.448   2.573
  316    H    ASN  43           H        ASN  43 -13.502   1.153   4.700
  317    HA   ASN  43           HA       ASN  43 -11.320   0.891   6.712
  318    HB2  ASN  43           1HB      ASN  43 -14.197   1.655   7.182
  319    HB3  ASN  43           2HB      ASN  43 -13.000   1.398   8.447
  320   HD21  ASN  43          2HD2      ASN  43 -13.894   3.568   5.762
  321   HD22  ASN  43          1HD2      ASN  43 -12.863   4.833   6.225
  322    HA   PRO  44           HA       PRO  44 -12.259  -3.495   6.889
  323    HB2  PRO  44           1HB      PRO  44 -12.042  -3.151   9.910
  324    HB3  PRO  44           2HB      PRO  44 -11.294  -4.391   8.873
  325    HG2  PRO  44           1HG      PRO  44  -9.835  -2.348   9.783
  326    HG3  PRO  44           2HG      PRO  44  -9.629  -2.930   8.112
  327    HD2  PRO  44           1HD      PRO  44 -11.044  -0.427   9.068
  328    HD3  PRO  44           2HD      PRO  44 -10.080  -0.709   7.599
  329    H    ALA  45           H        ALA  45 -13.877  -1.390   9.252
  330    HA   ALA  45           HA       ALA  45 -16.032  -3.087   9.929
  331    HB1  ALA  45           3HB      ALA  45 -17.137  -1.018  10.713
  332    HB2  ALA  45           1HB      ALA  45 -15.949  -0.050   9.833
  333    HB3  ALA  45           2HB      ALA  45 -15.439  -1.046  11.193
  334    H    GLN  46           H        GLN  46 -15.685  -0.662   7.357
  335    HA   GLN  46           HA       GLN  46 -18.371  -0.970   6.338
  336    HB2  GLN  46           1HB      GLN  46 -15.864   0.220   5.085
  337    HB3  GLN  46           2HB      GLN  46 -17.487   0.351   4.405
  338    HG2  GLN  46           1HG      GLN  46 -18.259   1.528   6.442
  339    HG3  GLN  46           2HG      GLN  46 -16.650   1.394   7.140
  340   HE21  GLN  46          2HE2      GLN  46 -17.176   3.925   7.088
  341   HE22  GLN  46          1HE2      GLN  46 -16.602   4.746   5.718
  342    H    GLY  47           H        GLY  47 -16.107  -3.228   6.518
  343    HA2  GLY  47           1HA      GLY  47 -15.758  -5.221   5.438
  344    HA3  GLY  47           2HA      GLY  47 -17.176  -4.869   4.452
  345    H    GLY  48           H        GLY  48 -13.742  -4.015   4.839
  346    HA2  GLY  48           1HA      GLY  48 -13.356  -2.768   2.334
  347    HA3  GLY  48           2HA      GLY  48 -12.101  -3.503   3.323
  348    H    VAL  49           H        VAL  49 -12.042  -3.639   0.538
  349    HA   VAL  49           HA       VAL  49 -12.327  -6.568   0.078
  350    HB   VAL  49           HB       VAL  49 -14.237  -5.406  -0.997
  351   HG11  VAL  49          1HG1      VAL  49 -13.087  -3.198  -1.384
  352   HG12  VAL  49          2HG1      VAL  49 -13.892  -3.810  -2.829
  353   HG13  VAL  49          3HG1      VAL  49 -12.143  -3.943  -2.676
  354   HG21  VAL  49          3HG2      VAL  49 -13.232  -7.451  -2.064
  355   HG22  VAL  49          1HG2      VAL  49 -12.207  -6.409  -3.053
  356   HG23  VAL  49          2HG2      VAL  49 -13.955  -6.364  -3.250
  357    H    GLU  50           H        GLU  50 -10.693  -7.500  -1.031
  358    HA   GLU  50           HA       GLU  50  -8.214  -6.026  -1.255
  359    HB2  GLU  50           1HB      GLU  50  -8.380  -8.454  -0.559
  360    HB3  GLU  50           2HB      GLU  50  -8.839  -8.858  -2.208
  361    HG2  GLU  50           1HG      GLU  50  -6.429  -9.258  -1.941
  362    HG3  GLU  50           2HG      GLU  50  -6.648  -7.885  -3.014
  363    H    ILE  51           H        ILE  51  -7.272  -5.211  -3.043
  364    HA   ILE  51           HA       ILE  51  -8.782  -5.274  -5.623
  365    HB   ILE  51           HB       ILE  51  -6.620  -3.345  -4.685
  366   HG12  ILE  51          1HG1      ILE  51  -9.647  -2.924  -4.886
  367   HG13  ILE  51          2HG1      ILE  51  -8.803  -3.216  -3.369
  368   HG21  ILE  51          1HG2      ILE  51  -6.790  -3.554  -7.182
  369   HG22  ILE  51          2HG2      ILE  51  -7.377  -1.996  -6.650
  370   HG23  ILE  51          3HG2      ILE  51  -8.525  -3.262  -7.078
  371   HD11  ILE  51          3HD1      ILE  51  -7.421  -1.183  -3.783
  372   HD12  ILE  51          1HD1      ILE  51  -9.143  -0.824  -3.642
  373   HD13  ILE  51          2HD1      ILE  51  -8.375  -0.853  -5.228
  374    H    GLY  52           H        GLY  52  -5.541  -5.650  -4.220
  375    HA2  GLY  52           1HA      GLY  52  -4.795  -7.688  -6.062
  376    HA3  GLY  52           2HA      GLY  52  -4.099  -6.142  -6.550
  377    H    ARG  53           H        ARG  53  -2.572  -8.364  -5.779
  378    HA   ARG  53           HA       ARG  53  -1.038  -7.219  -3.558
  379    HB2  ARG  53           1HB      ARG  53  -0.976  -9.425  -2.359
  380    HB3  ARG  53           2HB      ARG  53  -2.576  -8.682  -2.342
  381    HG2  ARG  53           1HG      ARG  53  -3.287 -10.133  -4.220
  382    HG3  ARG  53           2HG      ARG  53  -1.684 -10.864  -4.280
  383    HD2  ARG  53           1HD      ARG  53  -3.230 -12.312  -3.026
  384    HD3  ARG  53           2HD      ARG  53  -1.973 -11.687  -1.957
  385    HE   ARG  53           HE       ARG  53  -4.226  -9.951  -1.912
  386   HH11  ARG  53          1HH2      ARG  53  -3.183 -13.099  -0.856
  387   HH12  ARG  53          2HH2      ARG  53  -4.257 -13.140   0.503
  388   HH21  ARG  53          1HH1      ARG  53  -5.618 -10.017  -0.134
  389   HH22  ARG  53          2HH1      ARG  53  -5.631 -11.400   0.908
  390    H    ASP  54           H        ASP  54   1.023  -8.340  -3.271
  391    HA   ASP  54           HA       ASP  54   1.964 -10.059  -5.445
  392    HB2  ASP  54           1HB      ASP  54   2.122  -7.754  -6.387
  393    HB3  ASP  54           2HB      ASP  54   3.162  -7.283  -5.047
  394    H    THR  55           H        THR  55   3.062 -11.572  -4.367
  395    HA   THR  55           HA       THR  55   4.231 -11.087  -1.767
  396    HB   THR  55           HB       THR  55   4.542 -13.552  -3.533
  397    HG1  THR  55           HG1      THR  55   2.583 -14.017  -3.025
  398   HG21  THR  55          3HG2      THR  55   6.093 -13.448  -1.584
  399   HG22  THR  55          1HG2      THR  55   4.876 -14.705  -1.363
  400   HG23  THR  55          2HG2      THR  55   4.718 -13.170  -0.516
  401    H    ILE  56           H        ILE  56   6.285 -10.632  -1.286
  402    HA   ILE  56           HA       ILE  56   8.092  -9.891  -3.426
  403    HB   ILE  56           HB       ILE  56   8.636  -9.944  -0.428
  404   HG12  ILE  56          1HG1      ILE  56   6.587  -8.625  -0.802
  405   HG13  ILE  56          2HG1      ILE  56   7.916  -7.556  -0.423
  406   HG21  ILE  56          1HG2      ILE  56   9.877  -8.374  -2.728
  407   HG22  ILE  56          2HG2      ILE  56  10.657  -9.659  -1.804
  408   HG23  ILE  56          3HG2      ILE  56  10.256  -8.131  -1.029
  409   HD11  ILE  56          3HD1      ILE  56   8.172  -7.296  -3.019
  410   HD12  ILE  56          1HD1      ILE  56   6.871  -6.457  -2.181
  411   HD13  ILE  56          2HD1      ILE  56   6.540  -7.957  -3.053
  412    H    SER  57           H        SER  57  10.064 -10.860  -3.908
  413    HA   SER  57           HA       SER  57  10.213 -13.691  -3.699
  414    HB2  SER  57           1HB      SER  57  12.409 -11.697  -4.381
  415    HB3  SER  57           2HB      SER  57  12.468 -13.431  -4.690
  416    HG   SER  57           HG       SER  57  11.343 -11.494  -6.141
  417    H    ARG  58           H        ARG  58  12.060 -11.120  -2.083
  418    HA   ARG  58           HA       ARG  58  12.274 -12.506   0.401
  419    HB2  ARG  58           1HB      ARG  58  14.770 -12.942   0.316
  420    HB3  ARG  58           2HB      ARG  58  13.848 -13.975  -0.768
  421    HG2  ARG  58           1HG      ARG  58  14.366 -12.460  -2.672
  422    HG3  ARG  58           2HG      ARG  58  15.310 -11.437  -1.595
  423    HD2  ARG  58           1HD      ARG  58  15.900 -14.357  -2.165
  424    HD3  ARG  58           2HD      ARG  58  16.750 -12.989  -2.889
  425    HE   ARG  58           HE       ARG  58  16.832 -12.705  -0.079
  426   HH11  ARG  58          1HH2      ARG  58  18.066 -14.738  -2.618
  427   HH12  ARG  58          2HH2      ARG  58  19.501 -15.170  -1.750
  428   HH21  ARG  58          1HH1      ARG  58  18.704 -13.277   1.043
  429   HH22  ARG  58          2HH1      ARG  58  19.859 -14.345   0.320
  430    H    ILE  59           H        ILE  59  12.995 -11.156   1.995
  431    HA   ILE  59           HA       ILE  59  14.005  -8.476   1.170
  432    HB   ILE  59           HB       ILE  59  12.101  -9.053   3.458
  433   HG12  ILE  59          1HG1      ILE  59  11.635  -7.555   0.841
  434   HG13  ILE  59          2HG1      ILE  59  11.102  -9.211   1.120
  435   HG21  ILE  59          1HG2      ILE  59  13.413  -6.468   2.445
  436   HG22  ILE  59          2HG2      ILE  59  13.511  -7.133   4.071
  437   HG23  ILE  59          3HG2      ILE  59  12.009  -6.444   3.491
  438   HD11  ILE  59          3HD1      ILE  59   9.712  -8.426   3.018
  439   HD12  ILE  59          1HD1      ILE  59   9.254  -7.661   1.512
  440   HD13  ILE  59          2HD1      ILE  59  10.195  -6.763   2.683
  441    HA   PRO  60           HA       PRO  60  17.270  -9.833   4.042
  442    HB2  PRO  60           1HB      PRO  60  19.058  -7.785   3.710
  443    HB3  PRO  60           2HB      PRO  60  18.793  -8.998   2.435
  444    HG2  PRO  60           1HG      PRO  60  17.571  -6.244   2.683
  445    HG3  PRO  60           2HG      PRO  60  18.365  -6.982   1.269
  446    HD2  PRO  60           1HD      PRO  60  15.660  -6.966   1.525
  447    HD3  PRO  60           2HD      PRO  60  16.490  -8.349   0.768
  448    H    VAL  61           H        VAL  61  18.322  -8.959   6.007
  449    HA   VAL  61           HA       VAL  61  16.429  -7.781   7.776
  450    HB   VAL  61           HB       VAL  61  18.325  -7.815   9.392
  451   HG11  VAL  61          1HG1      VAL  61  18.670 -10.270   9.362
  452   HG12  VAL  61          2HG1      VAL  61  18.075 -10.327   7.702
  453   HG13  VAL  61          3HG1      VAL  61  16.990  -9.859   9.011
  454   HG21  VAL  61          3HG2      VAL  61  19.961  -8.713   6.980
  455   HG22  VAL  61          1HG2      VAL  61  20.526  -8.771   8.649
  456   HG23  VAL  61          2HG2      VAL  61  20.203  -7.223   7.887
  457    H    GLY  62           H        GLY  62  16.219  -5.727   8.545
  458    HA2  GLY  62           1HA      GLY  62  16.485  -3.446   8.714
  459    HA3  GLY  62           2HA      GLY  62  18.164  -3.644   8.214
  460    H    GLY  63           H        GLY  63  15.631  -4.930   6.228
  461    HA2  GLY  63           1HA      GLY  63  16.012  -2.779   4.189
  462    HA3  GLY  63           2HA      GLY  63  15.795  -4.487   3.838
  463    H    THR  64           H        THR  64  14.105  -3.300   2.484
  464    HA   THR  64           HA       THR  64  11.499  -3.474   3.882
  465    HB   THR  64           HB       THR  64  10.705  -1.402   2.960
  466    HG1  THR  64           HG1      THR  64  12.806  -1.796   1.261
  467   HG21  THR  64          3HG2      THR  64  12.259  -1.214   4.983
  468   HG22  THR  64          1HG2      THR  64  12.154   0.250   4.004
  469   HG23  THR  64          2HG2      THR  64  13.552  -0.813   3.855
  470    H    GLY  65           H        GLY  65   9.845  -2.856   1.873
  471    HA2  GLY  65           1HA      GLY  65  10.538  -4.575  -0.457
  472    HA3  GLY  65           2HA      GLY  65   9.113  -4.948   0.515
  473    H    LEU  66           H        LEU  66   9.334  -4.163  -2.296
  474    HA   LEU  66           HA       LEU  66   7.524  -1.819  -2.209
  475    HB2  LEU  66           1HB      LEU  66  10.081  -1.496  -3.096
  476    HB3  LEU  66           2HB      LEU  66   9.380  -2.107  -4.582
  477    HG   LEU  66           HG       LEU  66   9.269   0.328  -4.627
  478   HD11  LEU  66          1HD1      LEU  66   6.934   0.695  -5.069
  479   HD12  LEU  66          2HD1      LEU  66   6.447  -0.617  -4.009
  480   HD13  LEU  66          3HD1      LEU  66   7.279  -0.973  -5.524
  481   HD21  LEU  66          3HD2      LEU  66   9.143   0.384  -1.900
  482   HD22  LEU  66          1HD2      LEU  66   7.424   0.600  -2.244
  483   HD23  LEU  66          2HD2      LEU  66   8.604   1.722  -2.899
  484    H    ALA  67           H        ALA  67   5.628  -2.428  -2.846
  485    HA   ALA  67           HA       ALA  67   5.320  -4.560  -4.914
  486    HB1  ALA  67           3HB      ALA  67   3.072  -4.839  -3.955
  487    HB2  ALA  67           1HB      ALA  67   3.379  -3.526  -2.811
  488    HB3  ALA  67           2HB      ALA  67   4.311  -5.021  -2.712
  489    H    ARG  68           H        ARG  68   3.735  -4.260  -6.509
  490    HA   ARG  68           HA       ARG  68   2.970  -1.416  -7.065
  491    HB2  ARG  68           1HB      ARG  68   4.876  -2.165  -8.503
  492    HB3  ARG  68           2HB      ARG  68   3.864  -3.460  -9.140
  493    HG2  ARG  68           1HG      ARG  68   2.241  -1.777 -10.006
  494    HG3  ARG  68           2HG      ARG  68   3.227  -0.478  -9.332
  495    HD2  ARG  68           1HD      ARG  68   3.681  -0.731 -11.736
  496    HD3  ARG  68           2HD      ARG  68   5.109  -1.175 -10.797
  497    HE   ARG  68           HE       ARG  68   3.542  -3.490 -11.258
  498   HH11  ARG  68          1HH2      ARG  68   5.540  -1.205 -12.964
  499   HH12  ARG  68          2HH2      ARG  68   6.027  -2.344 -14.174
  500   HH21  ARG  68          1HH1      ARG  68   4.187  -4.961 -12.838
  501   HH22  ARG  68          2HH1      ARG  68   5.263  -4.466 -14.102
  502    H    VAL  69           H        VAL  69   0.890  -1.154  -7.152
  503    HA   VAL  69           HA       VAL  69  -0.856  -3.284  -8.258
  504    HB   VAL  69           HB       VAL  69  -1.481  -1.722  -5.709
  505   HG11  VAL  69          1HG1      VAL  69  -2.898  -4.040  -7.089
  506   HG12  VAL  69          2HG1      VAL  69  -3.489  -2.383  -7.002
  507   HG13  VAL  69          3HG1      VAL  69  -3.366  -3.349  -5.535
  508   HG21  VAL  69          3HG2      VAL  69  -1.176  -3.944  -4.571
  509   HG22  VAL  69          1HG2      VAL  69   0.327  -3.323  -5.251
  510   HG23  VAL  69          2HG2      VAL  69  -0.556  -4.604  -6.085
  511    H    GLN  70           H        GLN  70  -2.371  -2.544  -9.574
  512    HA   GLN  70           HA       GLN  70  -2.642   0.409  -9.967
  513    HB2  GLN  70           1HB      GLN  70  -3.400  -0.209 -12.255
  514    HB3  GLN  70           2HB      GLN  70  -1.751  -0.739 -11.918
  515    HG2  GLN  70           1HG      GLN  70  -2.577  -3.032 -11.440
  516    HG3  GLN  70           2HG      GLN  70  -4.227  -2.517 -11.771
  517   HE21  GLN  70          2HE2      GLN  70  -4.816  -2.053 -14.005
  518   HE22  GLN  70          1HE2      GLN  70  -3.832  -2.565 -15.291
  519    H    TRP  71           H        TRP  71  -4.612   1.349  -9.919
  520    HA   TRP  71           HA       TRP  71  -7.049  -0.312  -9.662
  521    HB2  TRP  71           1HB      TRP  71  -6.312   0.125  -7.334
  522    HB3  TRP  71           2HB      TRP  71  -6.253   1.851  -7.667
  523    HD1  TRP  71           HD1      TRP  71  -8.937  -0.919  -8.201
  524    HE1  TRP  71           HE1      TRP  71 -11.209   0.015  -7.463
  525    HE3  TRP  71           HE3      TRP  71  -7.522   3.756  -6.699
  526    HZ2  TRP  71           HZ2      TRP  71 -12.302   2.426  -6.381
  527    HZ3  TRP  71           HZ3      TRP  71  -9.202   5.354  -5.821
  528    HH2  TRP  71           HH2      TRP  71 -11.591   4.695  -5.660
  529    H    LYS  72           H        LYS  72  -8.742   0.522 -10.653
  530    HA   LYS  72           HA       LYS  72  -8.402   3.027 -12.162
  531    HB2  LYS  72           1HB      LYS  72  -9.266   0.954 -13.258
  532    HB3  LYS  72           2HB      LYS  72 -10.695   1.018 -12.230
  533    HG2  LYS  72           1HG      LYS  72 -11.277   3.247 -13.166
  534    HG3  LYS  72           2HG      LYS  72  -9.822   3.213 -14.162
  535    HD2  LYS  72           1HD      LYS  72 -10.676   1.194 -15.330
  536    HD3  LYS  72           2HD      LYS  72 -12.135   1.240 -14.340
  537    HE2  LYS  72           1HE      LYS  72 -12.688   3.481 -15.256
  538    HE3  LYS  72           2HE      LYS  72 -11.223   3.441 -16.238
  539    HZ1  LYS  72           3HZ      LYS  72 -12.050   1.646 -17.489
  540    HZ2  LYS  72           1HZ      LYS  72 -13.320   2.763 -17.384
  541    HZ3  LYS  72           2HZ      LYS  72 -13.334   1.370 -16.412
  542    H    ALA  73           H        ALA  73  -9.162   4.899 -11.412
  543    HA   ALA  73           HA       ALA  73 -10.755   5.071  -9.016
  544    HB1  ALA  73           3HB      ALA  73  -9.095   6.802  -9.604
  545    HB2  ALA  73           1HB      ALA  73 -10.706   7.507  -9.458
  546    HB3  ALA  73           2HB      ALA  73 -10.013   7.208 -11.053
  547    H    THR  74           H        THR  74 -12.935   5.055  -8.874
  548    HA   THR  74           HA       THR  74 -14.672   6.182 -10.880
  549    HB   THR  74           HB       THR  74 -14.238   4.125 -12.101
  550    HG1  THR  74           HG1      THR  74 -16.292   3.711 -12.391
  551   HG21  THR  74          3HG2      THR  74 -15.105   2.568  -9.630
  552   HG22  THR  74          1HG2      THR  74 -13.417   2.760 -10.111
  553   HG23  THR  74          2HG2      THR  74 -14.548   1.899 -11.155
  554    H    ARG  75           H        ARG  75 -16.503   6.820  -9.915
  555    HA   ARG  75           HA       ARG  75 -17.583   5.386  -7.568
  556    HB2  ARG  75           1HB      ARG  75 -16.800   8.328  -7.480
  557    HB3  ARG  75           2HB      ARG  75 -17.703   7.469  -6.227
  558    HG2  ARG  75           1HG      ARG  75 -15.750   5.907  -5.943
  559    HG3  ARG  75           2HG      ARG  75 -14.847   6.867  -7.117
  560    HD2  ARG  75           1HD      ARG  75 -14.245   7.537  -4.854
  561    HD3  ARG  75           2HD      ARG  75 -15.072   8.863  -5.675
  562    HE   ARG  75           HE       ARG  75 -16.961   7.288  -4.256
  563   HH11  ARG  75          1HH2      ARG  75 -14.365   9.542  -3.735
  564   HH12  ARG  75          2HH2      ARG  75 -14.982  10.105  -2.218
  565   HH21  ARG  75          1HH1      ARG  75 -17.764   8.036  -2.284
  566   HH22  ARG  75          2HH1      ARG  75 -16.908   9.255  -1.402
  567    H    LYS  76           H        LYS  76 -18.080   8.617  -9.008
  568    HA   LYS  76           HA       LYS  76 -20.528   7.849 -10.306
  569    HB2  LYS  76           1HB      LYS  76 -21.214   7.904  -7.895
  570    HB3  LYS  76           2HB      LYS  76 -20.767   9.597  -7.822
  571    HG2  LYS  76           1HG      LYS  76 -22.447  10.182  -9.509
  572    HG3  LYS  76           2HG      LYS  76 -22.838   8.489  -9.788
  573    HD2  LYS  76           1HD      LYS  76 -23.116   9.479  -6.929
  574    HD3  LYS  76           2HD      LYS  76 -24.305  10.081  -8.077
  575    HE2  LYS  76           1HE      LYS  76 -25.021   7.959  -6.897
  576    HE3  LYS  76           2HE      LYS  76 -25.000   7.814  -8.655
  577    HZ1  LYS  76           3HZ      LYS  76 -23.955   5.905  -7.777
  578    HZ2  LYS  76           1HZ      LYS  76 -22.971   6.816  -6.742
  579    HZ3  LYS  76           2HZ      LYS  76 -22.720   6.874  -8.422
  580    H    LEU  77           H        LEU  77 -21.410   9.503 -11.567
  581    HA   LEU  77           HA       LEU  77 -19.548  11.384 -12.604
  582    HB2  LEU  77           1HB      LEU  77 -22.530  10.979 -12.947
  583    HB3  LEU  77           2HB      LEU  77 -21.736  12.354 -13.716
  584    HG   LEU  77           HG       LEU  77 -20.214  10.808 -14.915
  585   HD11  LEU  77          1HD1      LEU  77 -20.826   8.297 -14.872
  586   HD12  LEU  77          2HD1      LEU  77 -21.752   8.652 -13.411
  587   HD13  LEU  77          3HD1      LEU  77 -20.009   8.924 -13.446
  588   HD21  LEU  77          3HD2      LEU  77 -21.904   9.819 -16.444
  589   HD22  LEU  77          1HD2      LEU  77 -22.355  11.458 -15.977
  590   HD23  LEU  77          2HD2      LEU  77 -23.152  10.075 -15.224
  591    H    ALA  78           H        ALA  78 -18.850  12.438 -10.649
  592    HA   ALA  78           HA       ALA  78 -20.690  14.240  -9.261
  593    HB1  ALA  78           3HB      ALA  78 -18.900  13.066  -8.015
  594    HB2  ALA  78           1HB      ALA  78 -18.712  14.819  -7.910
  595    HB3  ALA  78           2HB      ALA  78 -17.679  13.880  -8.992
  596    H    GLY  79           H        GLY  79 -19.682  16.527  -8.886
  597    HA2  GLY  79           1HA      GLY  79 -18.164  17.803 -10.896
  598    HA3  GLY  79           2HA      GLY  79 -19.875  17.970 -11.293
  599    H    ARG  80           H        ARG  80 -17.630  19.807 -10.212
  600    HA   ARG  80           HA       ARG  80 -17.440  21.599  -8.814
  601    HB2  ARG  80           1HB      ARG  80 -19.544  22.165 -10.081
  602    HB3  ARG  80           2HB      ARG  80 -20.480  21.485  -8.754
  603    HG2  ARG  80           1HG      ARG  80 -19.403  23.135  -7.187
  604    HG3  ARG  80           2HG      ARG  80 -18.540  23.830  -8.559
  605    HD2  ARG  80           1HD      ARG  80 -21.565  23.687  -8.272
  606    HD3  ARG  80           2HD      ARG  80 -20.582  25.131  -8.010
  607    HE   ARG  80           HE       ARG  80 -19.999  24.143 -10.580
  608   HH11  ARG  80          1HH2      ARG  80 -22.647  25.542  -8.807
  609   HH12  ARG  80          2HH2      ARG  80 -23.371  26.261 -10.206
  610   HH21  ARG  80          1HH1      ARG  80 -20.957  25.081 -12.396
  611   HH22  ARG  80          2HH1      ARG  80 -22.416  26.000 -12.232
  612    H    ALA  81           H        ALA  81 -16.468  20.791  -6.978
  613    HA   ALA  81           HA       ALA  81 -18.022  20.669  -4.556
  614    HB1  ALA  81           3HB      ALA  81 -18.513  18.404  -5.451
  615    HB2  ALA  81           1HB      ALA  81 -17.540  18.311  -3.982
  616    HB3  ALA  81           2HB      ALA  81 -16.787  18.072  -5.561
  617    H    ALA  82           H        ALA  82 -16.377  19.428  -2.858
  618    HA   ALA  82           HA       ALA  82 -13.583  19.984  -3.282
  619    HB1  ALA  82           3HB      ALA  82 -14.427  22.298  -3.022
  620    HB2  ALA  82           1HB      ALA  82 -13.391  21.842  -1.668
  621    HB3  ALA  82           2HB      ALA  82 -15.145  21.860  -1.473
  622    H    ASN  83           H        ASN  83 -14.208  17.673  -2.651
  623    HA   ASN  83           HA       ASN  83 -13.306  17.253   0.062
  624    HB2  ASN  83           1HB      ASN  83 -15.726  17.686   0.434
  625    HB3  ASN  83           2HB      ASN  83 -16.122  16.334  -0.627
  626   HD21  ASN  83          2HD2      ASN  83 -16.947  14.833   0.953
  627   HD22  ASN  83          1HD2      ASN  83 -16.026  14.255   2.255
  628    HA   PRO  84           HA       PRO  84 -11.897  14.024  -2.975
  629    HB2  PRO  84           1HB      PRO  84 -10.319  13.368  -0.448
  630    HB3  PRO  84           2HB      PRO  84  -9.783  13.296  -2.136
  631    HG2  PRO  84           1HG      PRO  84  -9.096  15.373  -0.646
  632    HG3  PRO  84           2HG      PRO  84  -9.668  15.650  -2.312
  633    HD2  PRO  84           1HD      PRO  84 -11.176  16.069   0.282
  634    HD3  PRO  84           2HD      PRO  84 -11.206  17.051  -1.205
  635    H    GLY  85           H        GLY  85 -11.706  12.556   0.232
  636    HA2  GLY  85           1HA      GLY  85 -13.099  11.012   1.301
  637    HA3  GLY  85           2HA      GLY  85 -14.248  11.110  -0.028
  638    H    VAL  86           H        VAL  86 -11.062  10.688  -1.081
  639    HA   VAL  86           HA       VAL  86 -11.449   7.743  -1.464
  640    HB   VAL  86           HB       VAL  86  -9.753   9.594  -3.194
  641   HG11  VAL  86          1HG1      VAL  86  -9.220   7.157  -3.303
  642   HG12  VAL  86          2HG1      VAL  86  -9.920   7.719  -4.819
  643   HG13  VAL  86          3HG1      VAL  86 -10.906   6.805  -3.678
  644   HG21  VAL  86          3HG2      VAL  86 -11.672   9.458  -4.838
  645   HG22  VAL  86          1HG2      VAL  86 -12.063  10.388  -3.391
  646   HG23  VAL  86          2HG2      VAL  86 -12.646   8.737  -3.560
  647    HA   PRO  87           HA       PRO  87  -7.600   8.490   1.126
  648    HB2  PRO  87           1HB      PRO  87  -8.190   6.955   3.305
  649    HB3  PRO  87           2HB      PRO  87  -8.887   8.583   3.124
  650    HG2  PRO  87           1HG      PRO  87 -10.134   5.932   2.344
  651    HG3  PRO  87           2HG      PRO  87 -10.815   7.198   3.401
  652    HD2  PRO  87           1HD      PRO  87 -11.511   7.119   0.803
  653    HD3  PRO  87           2HD      PRO  87 -11.181   8.679   1.594
  654    H    VAL  88           H        VAL  88  -6.414   6.441   2.353
  655    HA   VAL  88           HA       VAL  88  -6.571   4.005   0.700
  656    HB   VAL  88           HB       VAL  88  -5.051   5.538  -0.536
  657   HG11  VAL  88          1HG1      VAL  88  -4.190   6.789   1.472
  658   HG12  VAL  88          2HG1      VAL  88  -2.905   6.244   0.405
  659   HG13  VAL  88          3HG1      VAL  88  -3.228   5.387   1.909
  660   HG21  VAL  88          3HG2      VAL  88  -4.672   3.072  -0.622
  661   HG22  VAL  88          1HG2      VAL  88  -3.572   3.197   0.753
  662   HG23  VAL  88          2HG2      VAL  88  -3.160   3.967  -0.777
  663    H    TYR  89           H        TYR  89  -5.842   2.201   1.727
  664    HA   TYR  89           HA       TYR  89  -4.443   2.437   4.333
  665    HB2  TYR  89           1HB      TYR  89  -7.079   0.978   3.874
  666    HB3  TYR  89           2HB      TYR  89  -6.080   0.787   5.315
  667    HD1  TYR  89           HD2      TYR  89  -5.693   2.733   6.872
  668    HD2  TYR  89           HD1      TYR  89  -8.434   3.032   3.550
  669    HE1  TYR  89           HE2      TYR  89  -6.671   4.788   7.853
  670    HE2  TYR  89           HE1      TYR  89  -9.396   5.092   4.550
  671    HH   TYR  89           HH       TYR  89  -8.013   6.549   7.463
  672    H    ALA  90           H        ALA  90  -3.074   0.826   4.735
  673    HA   ALA  90           HA       ALA  90  -3.098  -1.647   3.115
  674    HB1  ALA  90           3HB      ALA  90  -0.742  -1.346   2.466
  675    HB2  ALA  90           1HB      ALA  90  -0.708   0.232   3.261
  676    HB3  ALA  90           2HB      ALA  90  -1.721  -0.017   1.840
  677    H    VAL  91           H        VAL  91  -2.247  -3.364   4.146
  678    HA   VAL  91           HA       VAL  91  -0.824  -2.981   6.722
  679    HB   VAL  91           HB       VAL  91  -3.238  -4.827   6.405
  680   HG11  VAL  91          1HG1      VAL  91  -1.578  -5.592   8.086
  681   HG12  VAL  91          2HG1      VAL  91  -3.031  -5.011   8.894
  682   HG13  VAL  91          3HG1      VAL  91  -1.590  -3.997   8.840
  683   HG21  VAL  91          3HG2      VAL  91  -4.057  -2.518   6.374
  684   HG22  VAL  91          1HG2      VAL  91  -3.012  -2.080   7.728
  685   HG23  VAL  91          2HG2      VAL  91  -4.370  -3.179   7.974
  686    H    VAL  92           H        VAL  92   0.599  -4.578   7.210
  687    HA   VAL  92           HA       VAL  92   1.344  -6.409   5.032
  688    HB   VAL  92           HB       VAL  92   3.048  -5.025   6.184
  689   HG11  VAL  92          1HG1      VAL  92   3.715  -5.451   8.496
  690   HG12  VAL  92          2HG1      VAL  92   2.510  -6.724   8.660
  691   HG13  VAL  92          3HG1      VAL  92   1.997  -5.050   8.472
  692   HG21  VAL  92          3HG2      VAL  92   3.418  -8.012   6.703
  693   HG22  VAL  92          1HG2      VAL  92   4.708  -6.821   6.555
  694   HG23  VAL  92          2HG2      VAL  92   3.702  -7.210   5.160
  695    H    ASP  93           H        ASP  93   1.274  -8.626   5.171
  696    HA   ASP  93           HA       ASP  93  -0.663  -9.787   6.893
  697    HB2  ASP  93           1HB      ASP  93   1.294 -10.891   4.879
  698    HB3  ASP  93           2HB      ASP  93   0.366 -12.004   5.887
  699    HA   PRO  94           HA       PRO  94   2.020 -10.692  10.376
  700    HB2  PRO  94           1HB      PRO  94   0.592 -12.585  11.727
  701    HB3  PRO  94           2HB      PRO  94  -0.029 -10.926  11.546
  702    HG2  PRO  94           1HG      PRO  94  -0.699 -13.361   9.875
  703    HG3  PRO  94           2HG      PRO  94  -1.815 -12.218  10.661
  704    HD2  PRO  94           1HD      PRO  94  -1.154 -11.946   8.018
  705    HD3  PRO  94           2HD      PRO  94  -1.419 -10.529   9.059
  706    H    ASP  95           H        ASP  95   3.181 -12.555  11.452
  707    HA   ASP  95           HA       ASP  95   4.506 -14.191   9.483
  708    HB2  ASP  95           1HB      ASP  95   4.732 -14.165  12.516
  709    HB3  ASP  95           2HB      ASP  95   5.837 -14.984  11.414
  710    H    ASN  96           H        ASN  96   1.583 -14.631  10.042
  711    HA   ASN  96           HA       ASN  96   0.129 -16.378  10.058
  712    HB2  ASN  96           1HB      ASN  96   1.901 -17.445   8.552
  713    HB3  ASN  96           2HB      ASN  96   2.523 -18.269   9.973
  714   HD21  ASN  96          2HD2      ASN  96   1.717 -20.368  10.156
  715   HD22  ASN  96          1HD2      ASN  96   0.181 -20.868   9.630
  716    H    ARG  97           H        ARG  97   0.741 -15.200  12.433
  717    HA   ARG  97           HA       ARG  97   0.389 -17.436  14.379
  718    HB2  ARG  97           1HB      ARG  97   2.092 -14.951  14.797
  719    HB3  ARG  97           2HB      ARG  97   1.783 -16.213  15.996
  720    HG2  ARG  97           1HG      ARG  97   2.872 -17.883  14.496
  721    HG3  ARG  97           2HG      ARG  97   3.212 -16.600  13.336
  722    HD2  ARG  97           1HD      ARG  97   5.210 -17.007  14.693
  723    HD3  ARG  97           2HD      ARG  97   4.554 -15.419  15.090
  724    HE   ARG  97           HE       ARG  97   4.091 -16.194  17.229
  725   HH11  ARG  97          1HH2      ARG  97   4.581 -18.899  15.091
  726   HH12  ARG  97          2HH2      ARG  97   4.517 -20.077  16.360
  727   HH21  ARG  97          1HH1      ARG  97   3.994 -17.743  18.865
  728   HH22  ARG  97          2HH1      ARG  97   4.187 -19.422  18.489
  729    H    VAL  98           H        VAL  98  -0.939 -14.760  12.977
  730    HA   VAL  98           HA       VAL  98  -2.655 -13.346  13.506
  731    HB   VAL  98           HB       VAL  98  -3.296 -15.417  15.627
  732   HG11  VAL  98          1HG1      VAL  98  -4.640 -13.347  15.845
  733   HG12  VAL  98          2HG1      VAL  98  -5.647 -14.669  15.265
  734   HG13  VAL  98          3HG1      VAL  98  -5.067 -13.445  14.137
  735   HG21  VAL  98          3HG2      VAL  98  -2.995 -16.502  13.421
  736   HG22  VAL  98          1HG2      VAL  98  -4.088 -15.325  12.691
  737   HG23  VAL  98          2HG2      VAL  98  -4.698 -16.490  13.869
  738    H    ALA  99           H        ALA  99  -1.808 -11.472  14.320
  739    HA   ALA  99           HA       ALA  99  -1.872 -11.046  17.210
  740    HB1  ALA  99           3HB      ALA  99   0.739 -10.757  15.675
  741    HB2  ALA  99           1HB      ALA  99   0.390 -11.994  16.881
  742    HB3  ALA  99           2HB      ALA  99   0.475 -10.296  17.359
  743    H    GLU 100           H        GLU 100  -3.149  -9.298  17.157
  744    HA   GLU 100           HA       GLU 100  -3.113  -7.307  15.075
  745    HB2  GLU 100           1HB      GLU 100  -4.415  -7.280  17.829
  746    HB3  GLU 100           2HB      GLU 100  -4.733  -6.121  16.537
  747    HG2  GLU 100           1HG      GLU 100  -6.509  -7.777  16.434
  748    HG3  GLU 100           2HG      GLU 100  -5.454  -8.080  15.062
  749    H    SER 101           H        SER 101  -0.728  -7.915  17.027
  750    HA   SER 101           HA       SER 101  -0.204  -5.261  18.170
  751    HB2  SER 101           1HB      SER 101   1.461  -7.800  18.103
  752    HB3  SER 101           2HB      SER 101   1.862  -6.341  19.012
  753    HG   SER 101           HG       SER 101  -0.191  -6.623  20.081
  754    H    ASP 102           H        ASP 102   1.416  -7.454  15.842
  755    HA   ASP 102           HA       ASP 102   3.359  -5.623  14.942
  756    HB2  ASP 102           1HB      ASP 102   3.438  -8.069  14.528
  757    HB3  ASP 102           2HB      ASP 102   2.070  -7.931  13.428
  758    H    LYS 103           H        LYS 103   0.082  -6.309  13.756
  759    HA   LYS 103           HA       LYS 103   0.118  -4.707  11.437
  760    HB2  LYS 103           1HB      LYS 103  -2.180  -5.386  13.314
  761    HB3  LYS 103           2HB      LYS 103  -2.384  -4.675  11.710
  762    HG2  LYS 103           1HG      LYS 103  -1.276  -6.642  10.689
  763    HG3  LYS 103           2HG      LYS 103  -1.067  -7.360  12.288
  764    HD2  LYS 103           1HD      LYS 103  -3.527  -7.423  12.595
  765    HD3  LYS 103           2HD      LYS 103  -3.751  -6.676  11.014
  766    HE2  LYS 103           1HE      LYS 103  -2.673  -8.617   9.936
  767    HE3  LYS 103           2HE      LYS 103  -2.423  -9.368  11.511
  768    HZ1  LYS 103           3HZ      LYS 103  -5.002  -8.932  11.666
  769    HZ2  LYS 103           1HZ      LYS 103  -4.376 -10.329  10.937
  770    HZ3  LYS 103           2HZ      LYS 103  -4.883  -9.024   9.974
  771    H    ALA 104           H        ALA 104  -1.297  -3.878  14.618
  772    HA   ALA 104           HA       ALA 104  -1.858  -1.208  14.173
  773    HB1  ALA 104           3HB      ALA 104  -1.705  -0.918  16.622
  774    HB2  ALA 104           1HB      ALA 104  -0.823  -2.445  16.748
  775    HB3  ALA 104           2HB      ALA 104  -2.503  -2.440  16.217
  776    H    ASN 105           H        ASN 105   1.230  -2.669  15.082
  777    HA   ASN 105           HA       ASN 105   2.641  -0.102  15.206
  778    HB2  ASN 105           1HB      ASN 105   3.623  -2.976  15.427
  779    HB3  ASN 105           2HB      ASN 105   4.603  -1.539  15.718
  780   HD21  ASN 105          2HD2      ASN 105   1.238  -2.381  16.750
  781   HD22  ASN 105          1HD2      ASN 105   1.539  -2.134  18.401
  782    H    ASN 106           H        ASN 106   1.358  -0.820  12.689
  783    HA   ASN 106           HA       ASN 106   3.486  -0.193  10.888
  784    HB2  ASN 106           1HB      ASN 106   3.961  -2.656  11.224
  785    HB3  ASN 106           2HB      ASN 106   2.362  -3.019  10.600
  786   HD21  ASN 106          2HD2      ASN 106   2.160  -3.154   8.321
  787   HD22  ASN 106          1HD2      ASN 106   3.390  -2.718   7.236
  788    H    VAL 107           H        VAL 107   1.137   1.077  11.367
  789    HA   VAL 107           HA       VAL 107  -0.631   0.450   9.036
  790    HB   VAL 107           HB       VAL 107  -1.285   2.214  11.436
  791   HG11  VAL 107          1HG1      VAL 107  -2.630   2.695   9.401
  792   HG12  VAL 107          2HG1      VAL 107  -3.628   1.916  10.623
  793   HG13  VAL 107          3HG1      VAL 107  -3.028   0.984   9.251
  794   HG21  VAL 107          3HG2      VAL 107  -1.963  -0.710  10.900
  795   HG22  VAL 107          1HG2      VAL 107  -2.668   0.263  12.194
  796   HG23  VAL 107          2HG2      VAL 107  -0.944  -0.088  12.199
  797    H    PHE 108           H        PHE 108  -0.951   1.941   7.480
  798    HA   PHE 108           HA       PHE 108   0.107   4.689   7.778
  799    HB2  PHE 108           1HB      PHE 108   0.902   2.865   5.464
  800    HB3  PHE 108           2HB      PHE 108   1.401   4.537   5.712
  801    HD1  PHE 108           HD1      PHE 108   2.535   5.084   8.061
  802    HD2  PHE 108           HD2      PHE 108   2.356   1.127   6.332
  803    HE1  PHE 108           HE1      PHE 108   4.429   4.359   9.487
  804    HE2  PHE 108           HE2      PHE 108   4.240   0.424   7.774
  805    HZ   PHE 108           HZ       PHE 108   5.275   2.034   9.346
  806    H    SER 109           H        SER 109  -0.935   6.179   6.553
  807    HA   SER 109           HA       SER 109  -2.624   5.578   4.322
  808    HB2  SER 109           1HB      SER 109  -4.145   4.641   5.969
  809    HB3  SER 109           2HB      SER 109  -3.927   6.034   7.025
  810    HG   SER 109           HG       SER 109  -5.436   6.991   5.936
  811    H    ARG 110           H        ARG 110  -3.023   7.398   3.208
  812    HA   ARG 110           HA       ARG 110  -2.699  10.058   4.525
  813    HB2  ARG 110           1HB      ARG 110  -1.306  10.817   2.662
  814    HB3  ARG 110           2HB      ARG 110  -0.558   9.414   3.432
  815    HG2  ARG 110           1HG      ARG 110  -1.498   7.943   1.644
  816    HG3  ARG 110           2HG      ARG 110  -2.207   9.359   0.863
  817    HD2  ARG 110           1HD      ARG 110   0.756   8.936   1.342
  818    HD3  ARG 110           2HD      ARG 110  -0.075   8.744  -0.205
  819    HE   ARG 110           HE       ARG 110  -0.655  11.317   0.759
  820   HH11  ARG 110          1HH2      ARG 110   2.083   9.469  -0.347
  821   HH12  ARG 110          2HH2      ARG 110   2.932  10.852  -0.950
  822   HH21  ARG 110          1HH1      ARG 110   0.464  13.106  -0.026
  823   HH22  ARG 110          2HH1      ARG 110   2.017  12.907  -0.768
  824    H    ILE 111           H        ILE 111  -3.711  11.778   3.443
  825    HA   ILE 111           HA       ILE 111  -6.160  10.956   2.074
  826    HB   ILE 111           HB       ILE 111  -5.202  13.790   2.682
  827   HG12  ILE 111          1HG1      ILE 111  -5.108  12.604   4.812
  828   HG13  ILE 111          2HG1      ILE 111  -6.568  13.583   4.815
  829   HG21  ILE 111          1HG2      ILE 111  -7.636  14.292   2.708
  830   HG22  ILE 111          2HG2      ILE 111  -7.984  12.607   2.333
  831   HG23  ILE 111          3HG2      ILE 111  -7.145  13.615   1.153
  832   HD11  ILE 111          3HD1      ILE 111  -6.310  10.589   4.500
  833   HD12  ILE 111          1HD1      ILE 111  -7.789  11.422   4.011
  834   HD13  ILE 111          2HD1      ILE 111  -7.251  11.485   5.686
  835    H    VAL 112           H        VAL 112  -6.353  10.833  -0.067
  836    HA   VAL 112           HA       VAL 112  -4.249  11.918  -1.833
  837    HB   VAL 112           HB       VAL 112  -6.661  10.201  -2.591
  838   HG11  VAL 112          1HG1      VAL 112  -5.216   9.592  -4.532
  839   HG12  VAL 112          2HG1      VAL 112  -3.972  10.692  -3.947
  840   HG13  VAL 112          3HG1      VAL 112  -5.520  11.328  -4.490
  841   HG21  VAL 112          3HG2      VAL 112  -3.860   9.391  -1.696
  842   HG22  VAL 112          1HG2      VAL 112  -5.020   8.286  -2.442
  843   HG23  VAL 112          2HG2      VAL 112  -5.372   9.008  -0.874
  844    H    LYS 113           H        LYS 113  -4.560  14.058  -2.205
  845    HA   LYS 113           HA       LYS 113  -7.245  15.178  -2.645
  846    HB2  LYS 113           1HB      LYS 113  -4.483  16.467  -2.657
  847    HB3  LYS 113           2HB      LYS 113  -6.018  17.333  -2.774
  848    HG2  LYS 113           1HG      LYS 113  -6.695  16.410  -0.553
  849    HG3  LYS 113           2HG      LYS 113  -5.138  15.588  -0.432
  850    HD2  LYS 113           1HD      LYS 113  -3.977  17.784  -0.523
  851    HD3  LYS 113           2HD      LYS 113  -5.535  18.601  -0.642
  852    HE2  LYS 113           1HE      LYS 113  -6.181  17.691   1.577
  853    HE3  LYS 113           2HE      LYS 113  -4.614  16.886   1.697
  854    HZ1  LYS 113           3HZ      LYS 113  -3.531  19.039   1.557
  855    HZ2  LYS 113           1HZ      LYS 113  -4.617  19.009   2.860
  856    HZ3  LYS 113           2HZ      LYS 113  -5.036  19.816   1.425
  857    H    VAL 114           H        VAL 114  -8.021  14.562  -4.601
  858    HA   VAL 114           HA       VAL 114  -6.315  14.884  -7.030
  859    HB   VAL 114           HB       VAL 114  -7.308  12.643  -6.615
  860   HG11  VAL 114          1HG1      VAL 114  -9.478  13.538  -5.532
  861   HG12  VAL 114          2HG1      VAL 114  -9.690  12.226  -6.689
  862   HG13  VAL 114          3HG1      VAL 114 -10.051  13.882  -7.166
  863   HG21  VAL 114          3HG2      VAL 114  -8.477  14.061  -9.049
  864   HG22  VAL 114          1HG2      VAL 114  -8.234  12.323  -8.888
  865   HG23  VAL 114          2HG2      VAL 114  -6.842  13.406  -8.946
  866    H    LEU 115           H        LEU 115  -6.716  16.519  -8.346
  867    HA   LEU 115           HA       LEU 115  -9.033  18.295  -7.877
  868    HB2  LEU 115           1HB      LEU 115  -6.441  18.502  -9.439
  869    HB3  LEU 115           2HB      LEU 115  -7.745  19.650  -9.743
  870    HG   LEU 115           HG       LEU 115  -7.722  20.314  -7.351
  871   HD11  LEU 115          1HD1      LEU 115  -5.716  19.498  -5.938
  872   HD12  LEU 115          2HD1      LEU 115  -5.523  18.217  -7.139
  873   HD13  LEU 115          3HD1      LEU 115  -7.015  18.342  -6.203
  874   HD21  LEU 115          3HD2      LEU 115  -4.964  20.405  -8.632
  875   HD22  LEU 115          1HD2      LEU 115  -5.534  21.474  -7.348
  876   HD23  LEU 115          2HD2      LEU 115  -6.278  21.540  -8.945
  877    H    GLU 116           H        GLU 116  -9.888  19.263 -10.020
  878    HA   GLU 116           HA       GLU 116 -10.151  17.534 -12.293
  879    HB2  GLU 116           1HB      GLU 116 -12.592  16.977 -11.929
  880    HB3  GLU 116           2HB      GLU 116 -11.512  16.153 -10.807
  881    HG2  GLU 116           1HG      GLU 116 -11.986  17.863  -9.068
  882    HG3  GLU 116           2HG      GLU 116 -13.058  18.708 -10.179
  883    H    HIS 117           H        HIS 117  -9.481  20.202 -11.996
  884    HA   HIS 117           HA       HIS 117 -11.397  21.434 -13.762
  885    HB2  HIS 117           1HB      HIS 117 -12.491  21.813 -11.556
  886    HB3  HIS 117           2HB      HIS 117 -11.040  22.627 -10.978
  887    HD1  HIS 117           HD1      HIS 117 -11.145  25.112 -11.227
  888    HD2  HIS 117           HD2      HIS 117 -13.426  23.189 -14.137
  889    HE1  HIS 117           HE1      HIS 117 -12.170  26.936 -12.656
  890    HE2  HIS 117           HE2      HIS 117 -13.564  25.777 -14.435
  891    H    HIS 118           H        HIS 118  -9.929  22.081 -15.204
  892    HA   HIS 118           HA       HIS 118  -7.913  24.088 -14.427
  893    HB2  HIS 118           1HB      HIS 118  -7.167  21.526 -15.900
  894    HB3  HIS 118           2HB      HIS 118  -6.089  22.890 -15.593
  895    HD1  HIS 118           HD1      HIS 118  -7.105  19.729 -14.182
  896    HD2  HIS 118           HD2      HIS 118  -5.866  23.385 -12.610
  897    HE1  HIS 118           HE1      HIS 118  -6.408  19.280 -11.794
  898    HE2  HIS 118           HE2      HIS 118  -5.656  21.500 -10.815
  899    H    HIS 119           H        HIS 119  -7.014  25.192 -16.252
  900    HA   HIS 119           HA       HIS 119  -8.016  24.794 -18.902
  901    HB2  HIS 119           1HB      HIS 119 -10.068  25.752 -17.623
  902    HB3  HIS 119           2HB      HIS 119  -9.167  27.253 -17.494
  903    HD1  HIS 119           HD1      HIS 119  -9.872  24.796 -20.331
  904    HD2  HIS 119           HD2      HIS 119  -9.913  28.898 -19.590
  905    HE1  HIS 119           HE1      HIS 119 -10.543  25.908 -22.504
  906    HE2  HIS 119           HE2      HIS 119 -10.574  28.409 -22.070
  907    H    HIS 120           H        HIS 120  -7.996  27.908 -19.098
  908    HA   HIS 120           HA       HIS 120  -6.459  29.440 -19.871
  909    HB2  HIS 120           1HB      HIS 120  -4.820  28.331 -17.557
  910    HB3  HIS 120           2HB      HIS 120  -4.588  29.897 -18.333
  911    HD1  HIS 120           HD1      HIS 120  -7.007  31.371 -18.326
  912    HD2  HIS 120           HD2      HIS 120  -6.403  28.546 -15.319
  913    HE1  HIS 120           HE1      HIS 120  -8.589  31.978 -16.444
  914    HE2  HIS 120           HE2      HIS 120  -8.232  30.265 -14.602
  915    H    HIS 121           H        HIS 121  -6.333  27.798 -21.727
  916    HA   HIS 121           HA       HIS 121  -3.584  27.497 -22.503
  917    HB2  HIS 121           1HB      HIS 121  -3.895  25.494 -20.979
  918    HB3  HIS 121           2HB      HIS 121  -5.150  24.907 -22.067
  919    HD1  HIS 121           HD1      HIS 121  -4.370  23.611 -24.102
  920    HD2  HIS 121           HD2      HIS 121  -1.257  25.702 -22.281
  921    HE1  HIS 121           HE1      HIS 121  -2.250  22.947 -25.321
  922    HE2  HIS 121           HE2      HIS 121  -0.344  24.215 -24.222
  923    H    HIS 122           H        HIS 122  -6.557  28.260 -23.239
  924    HA   HIS 122           HA       HIS 122  -7.823  28.435 -25.137
  925    HB2  HIS 122           1HB      HIS 122  -5.146  27.968 -26.509
  926    HB3  HIS 122           2HB      HIS 122  -6.572  28.696 -27.244
  927    HD1  HIS 122           HD1      HIS 122  -7.439  30.964 -25.990
  928    HD2  HIS 122           HD2      HIS 122  -3.519  29.788 -25.191
  929    HE1  HIS 122           HE1      HIS 122  -6.271  32.984 -25.005
  930    HE2  HIS 122           HE2      HIS 122  -3.881  32.283 -24.512
  Start of MODEL    6
    1    H1   MET   1           1H       MET   1  10.590  10.484   6.578
    2    H2   MET   1           2H       MET   1  11.853  11.310   7.357
    3    H3   MET   1           3H       MET   1  12.172   9.877   6.498
    4    HA   MET   1           HA       MET   1  11.491  12.552   5.460
    5    HB2  MET   1           1HB      MET   1  13.880  11.944   5.816
    6    HB3  MET   1           2HB      MET   1  13.682  10.536   4.783
    7    HG2  MET   1           1HG      MET   1  13.150  11.999   2.859
    8    HG3  MET   1           2HG      MET   1  13.260  13.423   3.888
    9    HE1  MET   1           3HE      MET   1  15.457  14.815   3.944
   10    HE2  MET   1           1HE      MET   1  16.924  14.006   4.507
   11    HE3  MET   1           2HE      MET   1  15.421  13.835   5.406
   12    H    ASP   2           H        ASP   2  12.225   9.326   4.098
   13    HA   ASP   2           HA       ASP   2  10.630   9.743   1.767
   14    HB2  ASP   2           1HB      ASP   2  11.729   7.178   2.994
   15    HB3  ASP   2           2HB      ASP   2  11.064   7.321   1.367
   16    H    LEU   3           H        LEU   3   8.489   9.532   1.527
   17    HA   LEU   3           HA       LEU   3   6.783   8.966   3.692
   18    HB2  LEU   3           1HB      LEU   3   6.182   9.086   0.732
   19    HB3  LEU   3           2HB      LEU   3   4.937   9.059   1.968
   20    HG   LEU   3           HG       LEU   3   7.109  11.211   1.946
   21   HD11  LEU   3          1HD1      LEU   3   4.357  11.370   0.636
   22   HD12  LEU   3          2HD1      LEU   3   5.898  11.343  -0.222
   23   HD13  LEU   3          3HD1      LEU   3   5.486  12.718   0.798
   24   HD21  LEU   3          3HD2      LEU   3   5.911  11.114   4.074
   25   HD22  LEU   3          1HD2      LEU   3   4.353  11.062   3.257
   26   HD23  LEU   3          2HD2      LEU   3   5.334  12.523   3.218
   27    HA   PRO   4           HA       PRO   4   6.629   4.497   3.432
   28    HB2  PRO   4           1HB      PRO   4   4.298   3.909   4.740
   29    HB3  PRO   4           2HB      PRO   4   5.691   4.616   5.594
   30    HG2  PRO   4           1HG      PRO   4   3.276   6.044   4.462
   31    HG3  PRO   4           2HG      PRO   4   3.964   6.160   6.102
   32    HD2  PRO   4           1HD      PRO   4   4.583   8.023   4.204
   33    HD3  PRO   4           2HD      PRO   4   5.819   7.476   5.366
   34    H    ILE   5           H        ILE   5   3.986   6.410   2.182
   35    HA   ILE   5           HA       ILE   5   3.344   4.286   0.159
   36    HB   ILE   5           HB       ILE   5   1.371   6.191   1.508
   37   HG12  ILE   5          1HG1      ILE   5   1.607   3.139   1.744
   38   HG13  ILE   5          2HG1      ILE   5   2.199   4.256   2.964
   39   HG21  ILE   5          1HG2      ILE   5   0.723   5.700  -0.840
   40   HG22  ILE   5          2HG2      ILE   5  -0.344   4.831   0.237
   41   HG23  ILE   5          3HG2      ILE   5   0.968   3.978  -0.572
   42   HD11  ILE   5          3HD1      ILE   5  -0.054   5.150   3.286
   43   HD12  ILE   5          1HD1      ILE   5  -0.021   3.414   3.568
   44   HD13  ILE   5          2HD1      ILE   5  -0.688   4.040   2.070
   45    H    THR   6           H        THR   6   3.460   4.940  -1.892
   46    HA   THR   6           HA       THR   6   3.330   7.845  -2.569
   47    HB   THR   6           HB       THR   6   5.684   7.439  -2.641
   48    HG1  THR   6           HG1      THR   6   4.483   8.155  -4.671
   49   HG21  THR   6          3HG2      THR   6   5.677   4.968  -2.494
   50   HG22  THR   6          1HG2      THR   6   6.702   5.521  -3.817
   51   HG23  THR   6          2HG2      THR   6   5.104   4.875  -4.157
   52    H    LEU   7           H        LEU   7   1.953   8.278  -4.115
   53    HA   LEU   7           HA       LEU   7   0.832   6.109  -5.810
   54    HB2  LEU   7           1HB      LEU   7  -0.224   8.784  -4.858
   55    HB3  LEU   7           2HB      LEU   7  -1.094   7.772  -6.005
   56    HG   LEU   7           HG       LEU   7  -0.240   6.577  -3.313
   57   HD11  LEU   7          1HD1      LEU   7  -1.402   8.622  -2.672
   58   HD12  LEU   7          2HD1      LEU   7  -2.430   7.235  -2.334
   59   HD13  LEU   7          3HD1      LEU   7  -2.744   8.241  -3.752
   60   HD21  LEU   7          3HD2      LEU   7  -1.274   5.179  -5.228
   61   HD22  LEU   7          1HD2      LEU   7  -2.768   6.055  -4.951
   62   HD23  LEU   7          2HD2      LEU   7  -2.074   5.058  -3.675
   63    H    SER   8           H        SER   8   0.728   6.361  -8.008
   64    HA   SER   8           HA       SER   8   2.625   8.174  -9.254
   65    HB2  SER   8           1HB      SER   8   2.357   5.914 -10.144
   66    HB3  SER   8           2HB      SER   8   0.649   6.205 -10.451
   67    HG   SER   8           HG       SER   8   2.772   6.802 -11.964
   68    H    LYS   9           H        LYS   9   0.501   9.520  -7.873
   69    HA   LYS   9           HA       LYS   9  -1.447  10.489  -9.771
   70    HB2  LYS   9           1HB      LYS   9  -1.578  10.379  -7.157
   71    HB3  LYS   9           2HB      LYS   9  -0.691  11.897  -7.165
   72    HG2  LYS   9           1HG      LYS   9  -2.477  12.928  -8.583
   73    HG3  LYS   9           2HG      LYS   9  -3.358  11.396  -8.574
   74    HD2  LYS   9           1HD      LYS   9  -3.387  11.571  -5.987
   75    HD3  LYS   9           2HD      LYS   9  -2.802  13.225  -6.192
   76    HE2  LYS   9           1HE      LYS   9  -5.244  13.232  -5.965
   77    HE3  LYS   9           2HE      LYS   9  -4.828  13.705  -7.609
   78    HZ1  LYS   9           3HZ      LYS   9  -6.317  11.457  -6.698
   79    HZ2  LYS   9           1HZ      LYS   9  -5.007  10.956  -7.652
   80    HZ3  LYS   9           2HZ      LYS   9  -6.141  12.057  -8.277
   81    H    GLU  10           H        GLU  10   0.927  10.713 -11.018
   82    HA   GLU  10           HA       GLU  10   2.351  13.138 -10.761
   83    HB2  GLU  10           1HB      GLU  10   1.794  11.489 -13.265
   84    HB3  GLU  10           2HB      GLU  10   3.071  12.697 -13.109
   85    HG2  GLU  10           1HG      GLU  10   2.844  10.176 -11.403
   86    HG3  GLU  10           2HG      GLU  10   3.917  10.362 -12.782
   87    H    THR  11           H        THR  11  -0.535  12.323 -12.637
   88    HA   THR  11           HA       THR  11  -0.997  15.216 -13.276
   89    HB   THR  11           HB       THR  11  -2.271  14.420 -15.194
   90    HG1  THR  11           HG1      THR  11  -3.052  12.501 -14.787
   91   HG21  THR  11          3HG2      THR  11  -0.430  13.478 -16.523
   92   HG22  THR  11          1HG2      THR  11   0.431  13.021 -15.053
   93   HG23  THR  11          2HG2      THR  11   0.210  14.728 -15.452
   94    HA   PRO  12           HA       PRO  12  -4.228  14.007 -10.075
   95    HB2  PRO  12           1HB      PRO  12  -4.487  17.032 -10.324
   96    HB3  PRO  12           2HB      PRO  12  -4.649  16.018  -8.867
   97    HG2  PRO  12           1HG      PRO  12  -2.385  17.313  -9.237
   98    HG3  PRO  12           2HG      PRO  12  -2.310  15.593  -8.773
   99    HD2  PRO  12           1HD      PRO  12  -1.902  16.798 -11.541
  100    HD3  PRO  12           2HD      PRO  12  -0.989  15.495 -10.736
  101    H    PHE  13           H        PHE  13  -6.004  13.104 -11.022
  102    HA   PHE  13           HA       PHE  13  -8.041  14.702 -12.266
  103    HB2  PHE  13           1HB      PHE  13  -6.376  14.469 -14.169
  104    HB3  PHE  13           2HB      PHE  13  -6.594  12.730 -14.108
  105    HD1  PHE  13           HD1      PHE  13  -8.237  15.976 -14.893
  106    HD2  PHE  13           HD2      PHE  13  -8.724  11.693 -14.887
  107    HE1  PHE  13           HE1      PHE  13 -10.284  16.200 -16.268
  108    HE2  PHE  13           HE2      PHE  13 -10.767  11.928 -16.263
  109    HZ   PHE  13           HZ       PHE  13 -11.551  14.180 -16.954
  110    H    GLU  14           H        GLU  14  -9.802  13.770 -11.411
  111    HA   GLU  14           HA       GLU  14  -9.953  11.200 -10.281
  112    HB2  GLU  14           1HB      GLU  14 -11.555  13.064  -9.823
  113    HB3  GLU  14           2HB      GLU  14 -12.275  12.824 -11.412
  114    HG2  GLU  14           1HG      GLU  14 -12.917  10.503 -10.768
  115    HG3  GLU  14           2HG      GLU  14 -12.167  10.734  -9.190
  116    H    GLY  15           H        GLY  15 -10.764   9.219 -10.996
  117    HA2  GLY  15           1HA      GLY  15 -11.588   7.628 -12.498
  118    HA3  GLY  15           2HA      GLY  15 -11.599   8.822 -13.789
  119    H    GLU  16           H        GLU  16  -8.760   9.585 -13.032
  120    HA   GLU  16           HA       GLU  16  -7.400   7.897 -14.888
  121    HB2  GLU  16           1HB      GLU  16  -6.756  10.266 -14.395
  122    HB3  GLU  16           2HB      GLU  16  -6.170   9.767 -12.811
  123    HG2  GLU  16           1HG      GLU  16  -4.510   8.261 -13.900
  124    HG3  GLU  16           2HG      GLU  16  -5.121   8.733 -15.484
  125    H    GLU  17           H        GLU  17  -5.940   6.243 -14.570
  126    HA   GLU  17           HA       GLU  17  -6.278   4.675 -12.154
  127    HB2  GLU  17           1HB      GLU  17  -6.088   3.670 -14.449
  128    HB3  GLU  17           2HB      GLU  17  -4.404   4.182 -14.517
  129    HG2  GLU  17           1HG      GLU  17  -3.915   2.807 -12.498
  130    HG3  GLU  17           2HG      GLU  17  -5.599   2.303 -12.434
  131    H    ILE  18           H        ILE  18  -4.876   4.448 -10.502
  132    HA   ILE  18           HA       ILE  18  -2.258   5.910 -10.570
  133    HB   ILE  18           HB       ILE  18  -2.602   6.445  -8.189
  134   HG12  ILE  18          1HG1      ILE  18  -5.435   5.348  -8.594
  135   HG13  ILE  18          2HG1      ILE  18  -4.193   4.582  -7.618
  136   HG21  ILE  18          1HG2      ILE  18  -4.286   8.242  -8.532
  137   HG22  ILE  18          2HG2      ILE  18  -4.900   7.410  -9.959
  138   HG23  ILE  18          3HG2      ILE  18  -3.272   8.081  -9.958
  139   HD11  ILE  18          3HD1      ILE  18  -5.966   6.813  -6.947
  140   HD12  ILE  18          1HD1      ILE  18  -4.288   7.186  -6.558
  141   HD13  ILE  18          2HD1      ILE  18  -5.053   5.757  -5.876
  142    H    THR  19           H        THR  19  -0.531   4.952  -9.591
  143    HA   THR  19           HA       THR  19  -0.724   2.042  -9.234
  144    HB   THR  19           HB       THR  19   1.771   3.793  -9.041
  145    HG1  THR  19           HG1      THR  19   0.790   2.392 -11.289
  146   HG21  THR  19          3HG2      THR  19   2.939   1.695  -9.656
  147   HG22  THR  19          1HG2      THR  19   1.400   0.839  -9.708
  148   HG23  THR  19          2HG2      THR  19   2.011   1.461  -8.176
  149    H    VAL  20           H        VAL  20  -1.300   1.303  -7.297
  150    HA   VAL  20           HA       VAL  20  -0.738   2.851  -4.844
  151    HB   VAL  20           HB       VAL  20  -2.320   0.249  -5.136
  152   HG11  VAL  20          1HG1      VAL  20  -2.235   2.391  -2.960
  153   HG12  VAL  20          2HG1      VAL  20  -1.627   0.742  -2.816
  154   HG13  VAL  20          3HG1      VAL  20  -3.356   1.032  -2.988
  155   HG21  VAL  20          3HG2      VAL  20  -3.331   2.015  -6.554
  156   HG22  VAL  20          1HG2      VAL  20  -3.305   3.143  -5.197
  157   HG23  VAL  20          2HG2      VAL  20  -4.338   1.713  -5.147
  158    H    SER  21           H        SER  21   1.172   2.527  -3.923
  159    HA   SER  21           HA       SER  21   2.312  -0.223  -3.711
  160    HB2  SER  21           1HB      SER  21   3.624   0.966  -5.368
  161    HB3  SER  21           2HB      SER  21   3.683   2.406  -4.355
  162    HG   SER  21           HG       SER  21   5.559   0.885  -4.337
  163    H    ALA  22           H        ALA  22   2.918  -0.787  -1.735
  164    HA   ALA  22           HA       ALA  22   2.993   1.254   0.458
  165    HB1  ALA  22           3HB      ALA  22   2.118  -0.530   1.919
  166    HB2  ALA  22           1HB      ALA  22   2.062  -1.639   0.544
  167    HB3  ALA  22           2HB      ALA  22   1.016  -0.222   0.576
  168    H    ARG  23           H        ARG  23   4.908   1.407   1.438
  169    HA   ARG  23           HA       ARG  23   7.067  -0.470   0.826
  170    HB2  ARG  23           1HB      ARG  23   6.939   2.019   2.583
  171    HB3  ARG  23           2HB      ARG  23   8.414   1.089   2.297
  172    HG2  ARG  23           1HG      ARG  23   8.206   1.507  -0.149
  173    HG3  ARG  23           2HG      ARG  23   6.739   2.443   0.135
  174    HD2  ARG  23           1HD      ARG  23   8.027   4.068   1.474
  175    HD3  ARG  23           2HD      ARG  23   9.493   3.122   1.254
  176    HE   ARG  23           HE       ARG  23   8.313   4.953  -0.638
  177   HH11  ARG  23          1HH2      ARG  23  10.189   2.035  -0.345
  178   HH12  ARG  23          2HH2      ARG  23  10.940   2.209  -1.896
  179   HH21  ARG  23          1HH1      ARG  23   9.312   5.166  -2.666
  180   HH22  ARG  23          2HH1      ARG  23  10.445   3.970  -3.203
  181    H    VAL  24           H        VAL  24   7.085  -2.359   1.859
  182    HA   VAL  24           HA       VAL  24   6.021  -2.664   4.583
  183    HB   VAL  24           HB       VAL  24   5.491  -4.304   2.795
  184   HG11  VAL  24          1HG1      VAL  24   8.402  -5.162   2.889
  185   HG12  VAL  24          2HG1      VAL  24   7.719  -4.190   1.596
  186   HG13  VAL  24          3HG1      VAL  24   7.133  -5.826   1.877
  187   HG21  VAL  24          3HG2      VAL  24   5.933  -6.349   4.107
  188   HG22  VAL  24          1HG2      VAL  24   5.509  -5.024   5.187
  189   HG23  VAL  24          2HG2      VAL  24   7.191  -5.519   5.019
  190    H    THR  25           H        THR  25   7.301  -2.546   6.333
  191    HA   THR  25           HA       THR  25  10.253  -2.556   5.988
  192    HB   THR  25           HB       THR  25   8.632  -1.765   8.444
  193    HG1  THR  25           HG1      THR  25   9.835   0.167   6.920
  194   HG21  THR  25          3HG2      THR  25  11.501  -1.163   7.598
  195   HG22  THR  25          1HG2      THR  25  11.032  -2.265   8.892
  196   HG23  THR  25          2HG2      THR  25  10.708  -0.545   9.038
  197    H    ASN  26           H        ASN  26  11.400  -4.300   6.507
  198    HA   ASN  26           HA       ASN  26  10.174  -6.644   7.682
  199    HB2  ASN  26           1HB      ASN  26  11.918  -6.773   5.939
  200    HB3  ASN  26           2HB      ASN  26  13.100  -6.094   7.040
  201   HD21  ASN  26          2HD2      ASN  26  13.952  -8.473   6.235
  202   HD22  ASN  26          1HD2      ASN  26  13.608  -9.724   7.330
  203    H    ARG  27           H        ARG  27   9.676  -6.533   9.787
  204    HA   ARG  27           HA       ARG  27  11.751  -5.626  11.758
  205    HB2  ARG  27           1HB      ARG  27   8.709  -5.410  11.890
  206    HB3  ARG  27           2HB      ARG  27   9.817  -4.966  13.194
  207    HG2  ARG  27           1HG      ARG  27  10.894  -3.288  11.684
  208    HG3  ARG  27           2HG      ARG  27   9.745  -3.712  10.416
  209    HD2  ARG  27           1HD      ARG  27   7.871  -2.988  11.862
  210    HD3  ARG  27           2HD      ARG  27   9.009  -2.576  13.144
  211    HE   ARG  27           HE       ARG  27   8.388  -0.993  10.820
  212   HH11  ARG  27          1HH2      ARG  27  10.945  -1.811  13.038
  213   HH12  ARG  27          2HH2      ARG  27  11.792  -0.317  12.814
  214   HH21  ARG  27          1HH1      ARG  27   9.507   0.964  10.554
  215   HH22  ARG  27          2HH1      ARG  27  10.984   1.242  11.414
  216    H    GLY  28           H        GLY  28  12.512  -7.282  12.872
  217    HA2  GLY  28           1HA      GLY  28  10.987  -9.076  14.386
  218    HA3  GLY  28           2HA      GLY  28  11.425  -9.902  12.888
  219    H    ALA  29           H        ALA  29  13.512 -10.612  12.602
  220    HA   ALA  29           HA       ALA  29  15.768  -9.721  14.135
  221    HB1  ALA  29           3HB      ALA  29  14.559 -12.409  14.898
  222    HB2  ALA  29           1HB      ALA  29  14.608 -10.979  15.927
  223    HB3  ALA  29           2HB      ALA  29  16.108 -11.782  15.473
  224    H    ALA  30           H        ALA  30  14.323 -11.401  11.631
  225    HA   ALA  30           HA       ALA  30  16.915 -12.144  10.457
  226    HB1  ALA  30           3HB      ALA  30  14.701 -14.187  10.888
  227    HB2  ALA  30           1HB      ALA  30  16.250 -14.167  11.727
  228    HB3  ALA  30           2HB      ALA  30  16.196 -14.460   9.988
  229    H    GLU  31           H        GLU  31  16.497 -13.115   8.218
  230    HA   GLU  31           HA       GLU  31  15.099 -11.218   6.648
  231    HB2  GLU  31           1HB      GLU  31  16.091 -14.017   5.963
  232    HB3  GLU  31           2HB      GLU  31  15.506 -12.855   4.765
  233    HG2  GLU  31           1HG      GLU  31  17.280 -11.265   5.423
  234    HG3  GLU  31           2HG      GLU  31  17.864 -12.396   6.641
  235    H    ALA  32           H        ALA  32  12.981 -11.072   6.166
  236    HA   ALA  32           HA       ALA  32  11.091 -13.049   7.139
  237    HB1  ALA  32           3HB      ALA  32  10.605 -10.614   7.199
  238    HB2  ALA  32           1HB      ALA  32   9.386 -11.502   6.284
  239    HB3  ALA  32           2HB      ALA  32  10.622 -10.565   5.437
  240    H    HIS  33           H        HIS  33  10.055 -14.588   5.973
  241    HA   HIS  33           HA       HIS  33  10.716 -14.909   3.082
  242    HB2  HIS  33           1HB      HIS  33   9.750 -16.947   5.127
  243    HB3  HIS  33           2HB      HIS  33  10.130 -17.286   3.435
  244    HD1  HIS  33           HD1      HIS  33  11.634 -18.013   6.412
  245    HD2  HIS  33           HD2      HIS  33  13.026 -15.827   3.133
  246    HE1  HIS  33           HE1      HIS  33  14.163 -18.012   6.575
  247    HE2  HIS  33           HE2      HIS  33  15.025 -16.689   4.585
  248    H    ASN  34           H        ASN  34   9.008 -16.050   1.866
  249    HA   ASN  34           HA       ASN  34   7.025 -15.242   0.742
  250    HB2  ASN  34           1HB      ASN  34   5.221 -16.764   1.627
  251    HB3  ASN  34           2HB      ASN  34   6.768 -17.574   1.366
  252   HD21  ASN  34          2HD2      ASN  34   8.113 -18.030   3.295
  253   HD22  ASN  34          1HD2      ASN  34   7.386 -18.134   4.826
  254    H    VAL  35           H        VAL  35   6.884 -13.006   1.205
  255    HA   VAL  35           HA       VAL  35   5.095 -12.210   3.481
  256    HB   VAL  35           HB       VAL  35   7.127 -10.552   1.938
  257   HG11  VAL  35          1HG1      VAL  35   5.610 -10.012   4.538
  258   HG12  VAL  35          2HG1      VAL  35   5.285  -9.223   2.996
  259   HG13  VAL  35          3HG1      VAL  35   6.812  -8.943   3.820
  260   HG21  VAL  35          3HG2      VAL  35   8.352 -12.237   3.183
  261   HG22  VAL  35          1HG2      VAL  35   7.349 -12.003   4.616
  262   HG23  VAL  35          2HG2      VAL  35   8.468 -10.754   4.109
  263    HA   PRO  36           HA       PRO  36   2.802 -11.163  -0.419
  264    HB2  PRO  36           1HB      PRO  36   0.482 -12.461  -0.058
  265    HB3  PRO  36           2HB      PRO  36   1.953 -13.384  -0.451
  266    HG2  PRO  36           1HG      PRO  36   0.720 -12.923   2.272
  267    HG3  PRO  36           2HG      PRO  36   1.221 -14.457   1.535
  268    HD2  PRO  36           1HD      PRO  36   2.868 -13.042   3.266
  269    HD3  PRO  36           2HD      PRO  36   3.506 -14.060   1.956
  270    H    VAL  37           H        VAL  37   2.604  -9.002   0.057
  271    HA   VAL  37           HA       VAL  37   1.093  -8.000   2.308
  272    HB   VAL  37           HB       VAL  37   3.006  -6.768   1.360
  273   HG11  VAL  37          1HG1      VAL  37   2.698  -7.367  -1.025
  274   HG12  VAL  37          2HG1      VAL  37   2.834  -5.629  -0.805
  275   HG13  VAL  37          3HG1      VAL  37   1.263  -6.344  -1.103
  276   HG21  VAL  37          3HG2      VAL  37   0.401  -5.210   0.997
  277   HG22  VAL  37          1HG2      VAL  37   1.993  -4.529   1.316
  278   HG23  VAL  37          2HG2      VAL  37   1.191  -5.503   2.544
  279    H    ALA  38           H        ALA  38  -0.908  -6.959   2.256
  280    HA   ALA  38           HA       ALA  38  -2.608  -7.335  -0.173
  281    HB1  ALA  38           3HB      ALA  38  -3.065  -9.110   1.504
  282    HB2  ALA  38           1HB      ALA  38  -4.442  -8.020   1.318
  283    HB3  ALA  38           2HB      ALA  38  -3.378  -7.878   2.725
  284    H    VAL  39           H        VAL  39  -3.604  -5.530  -0.748
  285    HA   VAL  39           HA       VAL  39  -3.915  -3.289   1.199
  286    HB   VAL  39           HB       VAL  39  -3.446  -3.096  -1.816
  287   HG11  VAL  39          1HG1      VAL  39  -3.017  -0.709  -1.297
  288   HG12  VAL  39          2HG1      VAL  39  -3.381  -0.999   0.397
  289   HG13  VAL  39          3HG1      VAL  39  -4.647  -1.160  -0.817
  290   HG21  VAL  39          3HG2      VAL  39  -1.145  -2.339  -1.199
  291   HG22  VAL  39          1HG2      VAL  39  -1.426  -4.011  -0.719
  292   HG23  VAL  39          2HG2      VAL  39  -1.475  -2.728   0.490
  293    H    TYR  40           H        TYR  40  -5.831  -2.220   1.192
  294    HA   TYR  40           HA       TYR  40  -7.915  -2.817  -0.773
  295    HB2  TYR  40           1HB      TYR  40  -9.538  -3.535   1.033
  296    HB3  TYR  40           2HB      TYR  40  -8.240  -4.693   0.746
  297    HD1  TYR  40           HD1      TYR  40  -6.369  -4.959   2.371
  298    HD2  TYR  40           HD2      TYR  40  -9.599  -2.197   3.132
  299    HE1  TYR  40           HE1      TYR  40  -5.645  -4.731   4.740
  300    HE2  TYR  40           HE2      TYR  40  -8.862  -1.990   5.482
  301    HH   TYR  40           HH       TYR  40  -6.560  -4.074   6.891
  302    H    LEU  41           H        LEU  41  -9.039  -1.046  -1.161
  303    HA   LEU  41           HA       LEU  41  -8.593   1.343   0.446
  304    HB2  LEU  41           1HB      LEU  41  -8.637   1.435  -2.012
  305    HB3  LEU  41           2HB      LEU  41 -10.307   0.911  -2.028
  306    HG   LEU  41           HG       LEU  41  -9.847   3.332  -0.273
  307   HD11  LEU  41          1HD1      LEU  41  -9.631   4.936  -2.165
  308   HD12  LEU  41          2HD1      LEU  41  -9.388   3.572  -3.257
  309   HD13  LEU  41          3HD1      LEU  41  -8.214   3.900  -2.001
  310   HD21  LEU  41          3HD2      LEU  41 -11.767   2.864  -2.599
  311   HD22  LEU  41          1HD2      LEU  41 -11.875   4.133  -1.376
  312   HD23  LEU  41          2HD2      LEU  41 -12.104   2.450  -0.918
  313    H    GLY  42           H        GLY  42  -9.869   2.083   1.997
  314    HA2  GLY  42           1HA      GLY  42 -12.186   2.636   2.687
  315    HA3  GLY  42           2HA      GLY  42 -12.616   0.958   2.386
  316    H    ASN  43           H        ASN  43 -13.295   0.730   4.527
  317    HA   ASN  43           HA       ASN  43 -11.122   0.621   6.567
  318    HB2  ASN  43           1HB      ASN  43 -14.045   1.290   6.924
  319    HB3  ASN  43           2HB      ASN  43 -12.882   1.140   8.240
  320   HD21  ASN  43          2HD2      ASN  43 -13.484   3.039   5.227
  321   HD22  ASN  43          1HD2      ASN  43 -12.649   4.417   5.760
  322    HA   PRO  44           HA       PRO  44 -11.897  -3.800   6.911
  323    HB2  PRO  44           1HB      PRO  44 -11.831  -3.332   9.909
  324    HB3  PRO  44           2HB      PRO  44 -11.001  -4.582   8.949
  325    HG2  PRO  44           1HG      PRO  44  -9.672  -2.449   9.857
  326    HG3  PRO  44           2HG      PRO  44  -9.331  -3.110   8.240
  327    HD2  PRO  44           1HD      PRO  44 -10.836  -0.585   8.957
  328    HD3  PRO  44           2HD      PRO  44  -9.829  -0.948   7.533
  329    H    ALA  45           H        ALA  45 -13.765  -1.517   8.832
  330    HA   ALA  45           HA       ALA  45 -15.824  -3.196   9.757
  331    HB1  ALA  45           3HB      ALA  45 -15.979  -0.264   8.965
  332    HB2  ALA  45           1HB      ALA  45 -15.481  -0.875  10.544
  333    HB3  ALA  45           2HB      ALA  45 -17.139  -1.116   9.990
  334    H    GLN  46           H        GLN  46 -15.471  -1.424   6.704
  335    HA   GLN  46           HA       GLN  46 -18.034  -1.985   5.629
  336    HB2  GLN  46           1HB      GLN  46 -15.392  -1.533   4.178
  337    HB3  GLN  46           2HB      GLN  46 -16.991  -1.429   3.434
  338    HG2  GLN  46           1HG      GLN  46 -16.022   0.331   5.731
  339    HG3  GLN  46           2HG      GLN  46 -16.064   0.818   4.043
  340   HE21  GLN  46          2HE2      GLN  46 -17.770   1.249   6.817
  341   HE22  GLN  46          1HE2      GLN  46 -19.333   1.432   6.180
  342    H    GLY  47           H        GLY  47 -14.909  -3.635   5.102
  343    HA2  GLY  47           1HA      GLY  47 -15.529  -6.228   5.320
  344    HA3  GLY  47           2HA      GLY  47 -16.214  -5.885   3.734
  345    H    GLY  48           H        GLY  48 -13.734  -3.789   3.981
  346    HA2  GLY  48           1HA      GLY  48 -11.612  -3.682   3.077
  347    HA3  GLY  48           2HA      GLY  48 -11.387  -5.326   3.661
  348    H    VAL  49           H        VAL  49 -12.039  -3.349   0.902
  349    HA   VAL  49           HA       VAL  49 -12.811  -5.541  -0.862
  350    HB   VAL  49           HB       VAL  49 -11.948  -2.698  -1.606
  351   HG11  VAL  49          1HG1      VAL  49 -13.342  -3.134  -3.627
  352   HG12  VAL  49          2HG1      VAL  49 -13.659  -4.773  -3.060
  353   HG13  VAL  49          3HG1      VAL  49 -12.024  -4.295  -3.510
  354   HG21  VAL  49          3HG2      VAL  49 -14.727  -3.783  -0.941
  355   HG22  VAL  49          1HG2      VAL  49 -14.387  -2.173  -1.579
  356   HG23  VAL  49          2HG2      VAL  49 -13.816  -2.620   0.024
  357    H    GLU  50           H        GLU  50 -11.334  -6.985  -1.503
  358    HA   GLU  50           HA       GLU  50  -8.479  -6.497  -1.402
  359    HB2  GLU  50           1HB      GLU  50  -9.509  -8.727  -0.990
  360    HB3  GLU  50           2HB      GLU  50 -10.040  -8.799  -2.668
  361    HG2  GLU  50           1HG      GLU  50  -7.660  -8.703  -3.419
  362    HG3  GLU  50           2HG      GLU  50  -7.140  -8.614  -1.739
  363    H    ILE  51           H        ILE  51  -7.528  -5.218  -2.880
  364    HA   ILE  51           HA       ILE  51  -8.600  -4.933  -5.613
  365    HB   ILE  51           HB       ILE  51  -6.183  -3.569  -4.326
  366   HG12  ILE  51          1HG1      ILE  51  -9.028  -2.473  -4.662
  367   HG13  ILE  51          2HG1      ILE  51  -8.419  -3.120  -3.150
  368   HG21  ILE  51          1HG2      ILE  51  -7.834  -2.899  -6.814
  369   HG22  ILE  51          2HG2      ILE  51  -6.171  -3.486  -6.817
  370   HG23  ILE  51          3HG2      ILE  51  -6.536  -1.900  -6.172
  371   HD11  ILE  51          3HD1      ILE  51  -8.210  -0.696  -3.140
  372   HD12  ILE  51          1HD1      ILE  51  -7.281  -0.734  -4.633
  373   HD13  ILE  51          2HD1      ILE  51  -6.604  -1.416  -3.153
  374    H    GLY  52           H        GLY  52  -5.605  -5.978  -4.000
  375    HA2  GLY  52           1HA      GLY  52  -5.048  -8.120  -5.695
  376    HA3  GLY  52           2HA      GLY  52  -4.206  -6.727  -6.375
  377    H    ARG  53           H        ARG  53  -2.566  -8.634  -5.670
  378    HA   ARG  53           HA       ARG  53  -1.152  -7.566  -3.320
  379    HB2  ARG  53           1HB      ARG  53  -0.778  -9.857  -2.397
  380    HB3  ARG  53           2HB      ARG  53  -2.472  -9.375  -2.322
  381    HG2  ARG  53           1HG      ARG  53  -3.003 -10.716  -4.311
  382    HG3  ARG  53           2HG      ARG  53  -1.306 -11.128  -4.540
  383    HD2  ARG  53           1HD      ARG  53  -2.468 -12.993  -3.450
  384    HD3  ARG  53           2HD      ARG  53  -1.288 -12.293  -2.350
  385    HE   ARG  53           HE       ARG  53  -3.015 -11.593  -0.963
  386   HH11  ARG  53          1HH2      ARG  53  -4.277 -12.508  -4.065
  387   HH12  ARG  53          2HH2      ARG  53  -5.932 -12.428  -3.562
  388   HH21  ARG  53          1HH1      ARG  53  -5.169 -11.503  -0.307
  389   HH22  ARG  53          2HH1      ARG  53  -6.436 -11.867  -1.428
  390    H    ASP  54           H        ASP  54   1.040  -8.316  -3.190
  391    HA   ASP  54           HA       ASP  54   2.200  -9.572  -5.603
  392    HB2  ASP  54           1HB      ASP  54   2.134  -7.107  -6.020
  393    HB3  ASP  54           2HB      ASP  54   3.094  -6.846  -4.570
  394    H    THR  55           H        THR  55   3.328 -11.191  -4.762
  395    HA   THR  55           HA       THR  55   4.515 -11.029  -2.096
  396    HB   THR  55           HB       THR  55   4.660 -13.296  -4.136
  397    HG1  THR  55           HG1      THR  55   2.533 -12.869  -3.587
  398   HG21  THR  55          3HG2      THR  55   5.090 -14.684  -2.120
  399   HG22  THR  55          1HG2      THR  55   5.085 -13.236  -1.117
  400   HG23  THR  55          2HG2      THR  55   6.351 -13.473  -2.323
  401    H    ILE  56           H        ILE  56   6.565 -10.553  -1.671
  402    HA   ILE  56           HA       ILE  56   8.325  -9.773  -3.856
  403    HB   ILE  56           HB       ILE  56   8.982  -9.814  -0.864
  404   HG12  ILE  56          1HG1      ILE  56   6.871  -8.571  -1.097
  405   HG13  ILE  56          2HG1      ILE  56   8.184  -7.435  -0.812
  406   HG21  ILE  56          1HG2      ILE  56  10.911  -9.430  -2.342
  407   HG22  ILE  56          2HG2      ILE  56  10.492  -7.911  -1.569
  408   HG23  ILE  56          3HG2      ILE  56  10.045  -8.183  -3.235
  409   HD11  ILE  56          3HD1      ILE  56   6.682  -7.955  -3.376
  410   HD12  ILE  56          1HD1      ILE  56   8.249  -7.152  -3.407
  411   HD13  ILE  56          2HD1      ILE  56   6.917  -6.432  -2.527
  412    H    SER  57           H        SER  57  10.314 -10.727  -4.360
  413    HA   SER  57           HA       SER  57  10.507 -13.551  -4.151
  414    HB2  SER  57           1HB      SER  57  12.758 -13.258  -5.139
  415    HB3  SER  57           2HB      SER  57  11.569 -12.254  -5.967
  416    HG   SER  57           HG       SER  57  12.530 -10.915  -3.870
  417    H    ARG  58           H        ARG  58  12.244 -10.941  -2.464
  418    HA   ARG  58           HA       ARG  58  12.496 -12.437  -0.033
  419    HB2  ARG  58           1HB      ARG  58  14.244 -13.610  -1.401
  420    HB3  ARG  58           2HB      ARG  58  15.077 -12.078  -1.633
  421    HG2  ARG  58           1HG      ARG  58  15.382 -11.884   0.846
  422    HG3  ARG  58           2HG      ARG  58  14.542 -13.421   1.056
  423    HD2  ARG  58           1HD      ARG  58  17.129 -13.040  -0.507
  424    HD3  ARG  58           2HD      ARG  58  17.011 -13.701   1.126
  425    HE   ARG  58           HE       ARG  58  15.304 -15.195  -0.526
  426   HH11  ARG  58          1HH2      ARG  58  18.710 -14.581  -0.106
  427   HH12  ARG  58          2HH2      ARG  58  19.190 -16.119  -0.742
  428   HH21  ARG  58          1HH1      ARG  58  15.948 -17.179  -1.355
  429   HH22  ARG  58          2HH1      ARG  58  17.630 -17.585  -1.448
  430    H    ILE  59           H        ILE  59  12.863 -11.082   1.626
  431    HA   ILE  59           HA       ILE  59  13.579  -8.253   1.017
  432    HB   ILE  59           HB       ILE  59  11.841  -9.255   3.285
  433   HG12  ILE  59          1HG1      ILE  59  11.075  -7.806   0.711
  434   HG13  ILE  59          2HG1      ILE  59  10.787  -9.516   0.993
  435   HG21  ILE  59          1HG2      ILE  59  11.323  -6.801   3.557
  436   HG22  ILE  59          2HG2      ILE  59  12.484  -6.432   2.293
  437   HG23  ILE  59          3HG2      ILE  59  13.028  -7.127   3.810
  438   HD11  ILE  59          3HD1      ILE  59   8.736  -8.285   1.443
  439   HD12  ILE  59          1HD1      ILE  59   9.584  -7.210   2.536
  440   HD13  ILE  59          2HD1      ILE  59   9.369  -8.889   2.962
  441    HA   PRO  60           HA       PRO  60  16.995  -9.432   3.809
  442    HB2  PRO  60           1HB      PRO  60  18.624  -7.269   3.538
  443    HB3  PRO  60           2HB      PRO  60  18.417  -8.444   2.218
  444    HG2  PRO  60           1HG      PRO  60  17.052  -5.783   2.582
  445    HG3  PRO  60           2HG      PRO  60  17.838  -6.432   1.128
  446    HD2  PRO  60           1HD      PRO  60  15.115  -6.564   1.494
  447    HD3  PRO  60           2HD      PRO  60  15.997  -7.830   0.595
  448    H    VAL  61           H        VAL  61  18.037  -8.489   5.790
  449    HA   VAL  61           HA       VAL  61  16.029  -7.491   7.595
  450    HB   VAL  61           HB       VAL  61  17.910  -7.560   9.255
  451   HG11  VAL  61          1HG1      VAL  61  16.543  -9.579   8.812
  452   HG12  VAL  61          2HG1      VAL  61  18.210 -10.015   9.192
  453   HG13  VAL  61          3HG1      VAL  61  17.651 -10.038   7.521
  454   HG21  VAL  61          3HG2      VAL  61  19.787  -6.962   7.738
  455   HG22  VAL  61          1HG2      VAL  61  19.570  -8.480   6.872
  456   HG23  VAL  61          2HG2      VAL  61  20.100  -8.486   8.551
  457    H    GLY  62           H        GLY  62  15.824  -5.479   8.529
  458    HA2  GLY  62           1HA      GLY  62  16.029  -3.214   8.801
  459    HA3  GLY  62           2HA      GLY  62  17.729  -3.377   8.368
  460    H    GLY  63           H        GLY  63  15.596  -4.683   6.078
  461    HA2  GLY  63           1HA      GLY  63  15.895  -2.338   4.253
  462    HA3  GLY  63           2HA      GLY  63  15.854  -4.020   3.766
  463    H    THR  64           H        THR  64  14.169  -2.775   2.373
  464    HA   THR  64           HA       THR  64  11.506  -3.391   3.513
  465    HB   THR  64           HB       THR  64  10.551  -1.272   2.906
  466    HG1  THR  64           HG1      THR  64  12.194   0.276   1.912
  467   HG21  THR  64          3HG2      THR  64  11.811   0.341   4.218
  468   HG22  THR  64          1HG2      THR  64  13.304  -0.553   3.974
  469   HG23  THR  64          2HG2      THR  64  12.034  -1.223   4.989
  470    H    GLY  65           H        GLY  65   9.923  -3.894   1.970
  471    HA2  GLY  65           1HA      GLY  65  10.961  -4.714  -0.672
  472    HA3  GLY  65           2HA      GLY  65   9.473  -5.241   0.100
  473    H    LEU  66           H        LEU  66   9.712  -4.269  -2.568
  474    HA   LEU  66           HA       LEU  66   8.017  -1.814  -2.378
  475    HB2  LEU  66           1HB      LEU  66  10.466  -1.779  -3.525
  476    HB3  LEU  66           2HB      LEU  66   9.602  -2.418  -4.904
  477    HG   LEU  66           HG       LEU  66   9.673   0.010  -5.127
  478   HD11  LEU  66          1HD1      LEU  66   7.333   0.589  -5.314
  479   HD12  LEU  66          2HD1      LEU  66   6.850  -0.641  -4.174
  480   HD13  LEU  66          3HD1      LEU  66   7.497  -1.102  -5.748
  481   HD21  LEU  66          3HD2      LEU  66   9.295   1.581  -3.465
  482   HD22  LEU  66          1HD2      LEU  66   9.840   0.279  -2.421
  483   HD23  LEU  66          2HD2      LEU  66   8.120   0.611  -2.595
  484    H    ALA  67           H        ALA  67   6.015  -2.367  -2.677
  485    HA   ALA  67           HA       ALA  67   5.268  -4.538  -4.568
  486    HB1  ALA  67           3HB      ALA  67   4.470  -4.666  -2.244
  487    HB2  ALA  67           1HB      ALA  67   3.125  -4.505  -3.376
  488    HB3  ALA  67           2HB      ALA  67   3.660  -3.115  -2.421
  489    H    ARG  68           H        ARG  68   3.578  -4.196  -6.059
  490    HA   ARG  68           HA       ARG  68   2.796  -1.404  -6.667
  491    HB2  ARG  68           1HB      ARG  68   3.388  -1.694  -9.052
  492    HB3  ARG  68           2HB      ARG  68   4.807  -1.802  -8.009
  493    HG2  ARG  68           1HG      ARG  68   4.659  -4.296  -8.113
  494    HG3  ARG  68           2HG      ARG  68   3.313  -4.156  -9.234
  495    HD2  ARG  68           1HD      ARG  68   4.725  -2.951 -10.840
  496    HD3  ARG  68           2HD      ARG  68   6.097  -3.066  -9.733
  497    HE   ARG  68           HE       ARG  68   5.099  -5.167 -11.447
  498   HH11  ARG  68          1HH2      ARG  68   6.704  -4.513  -8.426
  499   HH12  ARG  68          2HH2      ARG  68   7.405  -6.093  -8.307
  500   HH21  ARG  68          1HH1      ARG  68   6.021  -7.244 -11.259
  501   HH22  ARG  68          2HH1      ARG  68   7.019  -7.626  -9.897
  502    H    VAL  69           H        VAL  69   0.722  -1.293  -6.945
  503    HA   VAL  69           HA       VAL  69  -0.786  -3.512  -8.227
  504    HB   VAL  69           HB       VAL  69  -1.665  -2.092  -5.662
  505   HG11  VAL  69          1HG1      VAL  69  -3.561  -2.827  -7.082
  506   HG12  VAL  69          2HG1      VAL  69  -3.446  -3.847  -5.656
  507   HG13  VAL  69          3HG1      VAL  69  -2.859  -4.441  -7.209
  508   HG21  VAL  69          3HG2      VAL  69   0.201  -3.591  -5.134
  509   HG22  VAL  69          1HG2      VAL  69  -0.513  -4.893  -6.092
  510   HG23  VAL  69          2HG2      VAL  69  -1.288  -4.355  -4.600
  511    H    GLN  70           H        GLN  70  -2.257  -2.823  -9.631
  512    HA   GLN  70           HA       GLN  70  -2.532   0.088 -10.105
  513    HB2  GLN  70           1HB      GLN  70  -3.440  -2.320 -11.730
  514    HB3  GLN  70           2HB      GLN  70  -3.621  -0.634 -12.228
  515    HG2  GLN  70           1HG      GLN  70  -1.150  -0.343 -12.131
  516    HG3  GLN  70           2HG      GLN  70  -0.971  -2.032 -11.655
  517   HE21  GLN  70          2HE2      GLN  70   0.408  -1.893 -13.790
  518   HE22  GLN  70          1HE2      GLN  70  -0.417  -2.243 -15.232
  519    H    TRP  71           H        TRP  71  -4.386   1.203  -9.781
  520    HA   TRP  71           HA       TRP  71  -6.906  -0.223  -9.139
  521    HB2  TRP  71           1HB      TRP  71  -5.828   0.310  -6.958
  522    HB3  TRP  71           2HB      TRP  71  -5.695   1.998  -7.427
  523    HD1  TRP  71           HD1      TRP  71  -8.561  -0.620  -7.297
  524    HE1  TRP  71           HE1      TRP  71 -10.682   0.540  -6.449
  525    HE3  TRP  71           HE3      TRP  71  -6.745   4.088  -6.591
  526    HZ2  TRP  71           HZ2      TRP  71 -11.521   3.161  -5.596
  527    HZ3  TRP  71           HZ3      TRP  71  -8.213   5.904  -5.770
  528    HH2  TRP  71           HH2      TRP  71 -10.598   5.453  -5.260
  529    H    LYS  72           H        LYS  72  -8.572   0.643 -10.129
  530    HA   LYS  72           HA       LYS  72  -8.250   3.201 -11.610
  531    HB2  LYS  72           1HB      LYS  72  -9.024   1.149 -12.816
  532    HB3  LYS  72           2HB      LYS  72 -10.471   1.120 -11.813
  533    HG2  LYS  72           1HG      LYS  72 -11.114   3.371 -12.658
  534    HG3  LYS  72           2HG      LYS  72  -9.640   3.434 -13.627
  535    HD2  LYS  72           1HD      LYS  72 -10.406   1.435 -14.904
  536    HD3  LYS  72           2HD      LYS  72 -11.887   1.398 -13.945
  537    HE2  LYS  72           1HE      LYS  72 -12.488   3.659 -14.775
  538    HE3  LYS  72           2HE      LYS  72 -10.999   3.709 -15.722
  539    HZ1  LYS  72           3HZ      LYS  72 -12.998   1.556 -16.054
  540    HZ2  LYS  72           1HZ      LYS  72 -11.743   2.001 -17.105
  541    HZ3  LYS  72           2HZ      LYS  72 -13.091   3.017 -16.916
  542    H    ALA  73           H        ALA  73  -9.104   5.006 -10.801
  543    HA   ALA  73           HA       ALA  73 -10.641   5.057  -8.386
  544    HB1  ALA  73           3HB      ALA  73  -9.184   6.928  -9.067
  545    HB2  ALA  73           1HB      ALA  73 -10.843   7.487  -8.839
  546    HB3  ALA  73           2HB      ALA  73 -10.208   7.234 -10.468
  547    H    THR  74           H        THR  74 -12.824   5.501  -8.079
  548    HA   THR  74           HA       THR  74 -14.656   5.513 -10.427
  549    HB   THR  74           HB       THR  74 -16.011   3.734  -9.539
  550    HG1  THR  74           HG1      THR  74 -14.436   3.135  -7.380
  551   HG21  THR  74          3HG2      THR  74 -14.517   1.812  -9.530
  552   HG22  THR  74          1HG2      THR  74 -13.152   2.820  -9.062
  553   HG23  THR  74          2HG2      THR  74 -13.857   2.983 -10.673
  554    H    ARG  75           H        ARG  75 -17.009   5.311  -8.984
  555    HA   ARG  75           HA       ARG  75 -18.550   6.685  -8.023
  556    HB2  ARG  75           1HB      ARG  75 -17.386   5.823  -5.990
  557    HB3  ARG  75           2HB      ARG  75 -16.281   7.195  -6.047
  558    HG2  ARG  75           1HG      ARG  75 -18.220   8.753  -5.769
  559    HG3  ARG  75           2HG      ARG  75 -19.309   7.373  -5.699
  560    HD2  ARG  75           1HD      ARG  75 -18.141   6.558  -3.672
  561    HD3  ARG  75           2HD      ARG  75 -17.039   7.933  -3.746
  562    HE   ARG  75           HE       ARG  75 -19.730   7.936  -2.723
  563   HH11  ARG  75          1HH2      ARG  75 -17.345   9.894  -4.338
  564   HH12  ARG  75          2HH2      ARG  75 -18.044  11.393  -3.823
  565   HH21  ARG  75          1HH1      ARG  75 -20.625   9.907  -2.061
  566   HH22  ARG  75          2HH1      ARG  75 -19.892  11.399  -2.544
  567    H    LYS  76           H        LYS  76 -18.559   8.122  -9.837
  568    HA   LYS  76           HA       LYS  76 -16.834  10.472  -9.873
  569    HB2  LYS  76           1HB      LYS  76 -19.271   9.709 -11.535
  570    HB3  LYS  76           2HB      LYS  76 -18.241  11.112 -11.844
  571    HG2  LYS  76           1HG      LYS  76 -16.285   9.615 -12.144
  572    HG3  LYS  76           2HG      LYS  76 -17.312   8.209 -11.846
  573    HD2  LYS  76           1HD      LYS  76 -18.690   8.799 -13.834
  574    HD3  LYS  76           2HD      LYS  76 -17.657  10.196 -14.133
  575    HE2  LYS  76           1HE      LYS  76 -15.708   8.688 -14.449
  576    HE3  LYS  76           2HE      LYS  76 -16.744   7.291 -14.156
  577    HZ1  LYS  76           3HZ      LYS  76 -17.163   7.313 -16.322
  578    HZ2  LYS  76           1HZ      LYS  76 -16.405   8.815 -16.539
  579    HZ3  LYS  76           2HZ      LYS  76 -18.042   8.747 -16.088
  580    H    LEU  77           H        LEU  77 -17.242  12.361  -8.937
  581    HA   LEU  77           HA       LEU  77 -19.890  13.407  -8.566
  582    HB2  LEU  77           1HB      LEU  77 -19.377  11.615  -6.600
  583    HB3  LEU  77           2HB      LEU  77 -18.507  12.954  -5.879
  584    HG   LEU  77           HG       LEU  77 -21.468  12.945  -6.690
  585   HD11  LEU  77          1HD1      LEU  77 -20.965  11.642  -4.633
  586   HD12  LEU  77          2HD1      LEU  77 -21.881  13.098  -4.256
  587   HD13  LEU  77          3HD1      LEU  77 -20.142  13.044  -3.944
  588   HD21  LEU  77          3HD2      LEU  77 -21.476  15.188  -5.454
  589   HD22  LEU  77          1HD2      LEU  77 -20.652  15.194  -7.003
  590   HD23  LEU  77          2HD2      LEU  77 -19.718  15.151  -5.509
  591    H    ALA  78           H        ALA  78 -19.572  15.485  -9.022
  592    HA   ALA  78           HA       ALA  78 -17.274  16.988  -7.829
  593    HB1  ALA  78           3HB      ALA  78 -18.186  17.099 -10.732
  594    HB2  ALA  78           1HB      ALA  78 -16.676  16.398 -10.151
  595    HB3  ALA  78           2HB      ALA  78 -16.954  18.133 -10.003
  596    H    GLY  79           H        GLY  79 -17.765  18.990  -7.132
  597    HA2  GLY  79           1HA      GLY  79 -19.760  20.708  -8.048
  598    HA3  GLY  79           2HA      GLY  79 -20.479  19.766  -6.741
  599    H    ARG  80           H        ARG  80 -20.093  20.404  -4.676
  600    HA   ARG  80           HA       ARG  80 -18.880  22.897  -4.098
  601    HB2  ARG  80           1HB      ARG  80 -19.590  20.577  -2.257
  602    HB3  ARG  80           2HB      ARG  80 -19.191  22.213  -1.715
  603    HG2  ARG  80           1HG      ARG  80 -21.127  23.105  -3.001
  604    HG3  ARG  80           2HG      ARG  80 -21.537  21.467  -3.515
  605    HD2  ARG  80           1HD      ARG  80 -21.433  22.403  -0.618
  606    HD3  ARG  80           2HD      ARG  80 -22.906  22.204  -1.565
  607    HE   ARG  80           HE       ARG  80 -21.510  19.775  -1.676
  608   HH11  ARG  80          1HH2      ARG  80 -23.096  21.787   0.689
  609   HH12  ARG  80          2HH2      ARG  80 -23.545  20.454   1.701
  610   HH21  ARG  80          1HH1      ARG  80 -22.105  18.058  -0.341
  611   HH22  ARG  80          2HH1      ARG  80 -22.988  18.355   1.120
  612    H    ALA  81           H        ALA  81 -17.687  19.584  -4.010
  613    HA   ALA  81           HA       ALA  81 -15.635  18.673  -3.583
  614    HB1  ALA  81           3HB      ALA  81 -15.072  20.019  -5.586
  615    HB2  ALA  81           1HB      ALA  81 -13.702  19.908  -4.479
  616    HB3  ALA  81           2HB      ALA  81 -14.665  21.386  -4.551
  617    H    ALA  82           H        ALA  82 -16.940  19.859  -1.358
  618    HA   ALA  82           HA       ALA  82 -15.282  21.501   0.242
  619    HB1  ALA  82           3HB      ALA  82 -17.364  19.442   1.066
  620    HB2  ALA  82           1HB      ALA  82 -17.691  21.126   0.663
  621    HB3  ALA  82           2HB      ALA  82 -16.737  20.732   2.095
  622    H    ASN  83           H        ASN  83 -15.340  18.051  -0.356
  623    HA   ASN  83           HA       ASN  83 -12.773  17.754   1.033
  624    HB2  ASN  83           1HB      ASN  83 -15.248  16.195   1.849
  625    HB3  ASN  83           2HB      ASN  83 -13.618  15.800   2.382
  626   HD21  ASN  83          2HD2      ASN  83 -16.349  17.894   2.978
  627   HD22  ASN  83          1HD2      ASN  83 -15.630  18.798   4.223
  628    HA   PRO  84           HA       PRO  84 -12.271  14.969  -2.434
  629    HB2  PRO  84           1HB      PRO  84 -10.090  13.465  -1.673
  630    HB3  PRO  84           2HB      PRO  84  -9.964  15.179  -2.111
  631    HG2  PRO  84           1HG      PRO  84 -10.112  13.972   0.652
  632    HG3  PRO  84           2HG      PRO  84  -9.008  15.215   0.044
  633    HD2  PRO  84           1HD      PRO  84 -11.243  15.886   1.479
  634    HD3  PRO  84           2HD      PRO  84 -10.642  16.928   0.162
  635    H    GLY  85           H        GLY  85 -11.524  12.992   0.445
  636    HA2  GLY  85           1HA      GLY  85 -12.581  11.134   1.325
  637    HA3  GLY  85           2HA      GLY  85 -13.913  11.357   0.196
  638    H    VAL  86           H        VAL  86 -10.539  10.292   0.406
  639    HA   VAL  86           HA       VAL  86 -11.044   7.887  -1.079
  640    HB   VAL  86           HB       VAL  86 -11.011   9.592  -2.917
  641   HG11  VAL  86          1HG1      VAL  86  -9.186  10.981  -3.424
  642   HG12  VAL  86          2HG1      VAL  86  -8.018   9.962  -2.614
  643   HG13  VAL  86          3HG1      VAL  86  -9.089  10.986  -1.668
  644   HG21  VAL  86          3HG2      VAL  86 -10.330   7.244  -3.361
  645   HG22  VAL  86          1HG2      VAL  86  -8.654   7.670  -3.042
  646   HG23  VAL  86          2HG2      VAL  86  -9.488   8.381  -4.407
  647    HA   PRO  87           HA       PRO  87  -7.211   8.153   1.650
  648    HB2  PRO  87           1HB      PRO  87  -8.010   6.743   3.831
  649    HB3  PRO  87           2HB      PRO  87  -8.503   8.441   3.619
  650    HG2  PRO  87           1HG      PRO  87 -10.063   5.944   2.917
  651    HG3  PRO  87           2HG      PRO  87 -10.595   7.343   3.885
  652    HD2  PRO  87           1HD      PRO  87 -11.204   7.138   1.217
  653    HD3  PRO  87           2HD      PRO  87 -10.866   8.720   1.963
  654    H    VAL  88           H        VAL  88  -5.786   6.353   2.204
  655    HA   VAL  88           HA       VAL  88  -6.480   3.740   0.917
  656    HB   VAL  88           HB       VAL  88  -3.788   5.168   0.687
  657   HG11  VAL  88          1HG1      VAL  88  -3.622   2.682   0.619
  658   HG12  VAL  88          2HG1      VAL  88  -3.311   3.368  -0.967
  659   HG13  VAL  88          3HG1      VAL  88  -4.874   2.629  -0.625
  660   HG21  VAL  88          3HG2      VAL  88  -4.414   5.486  -1.700
  661   HG22  VAL  88          1HG2      VAL  88  -5.544   6.326  -0.641
  662   HG23  VAL  88          2HG2      VAL  88  -6.003   4.793  -1.381
  663    H    TYR  89           H        TYR  89  -5.987   2.006   2.081
  664    HA   TYR  89           HA       TYR  89  -4.199   2.231   4.467
  665    HB2  TYR  89           1HB      TYR  89  -6.870   0.781   4.271
  666    HB3  TYR  89           2HB      TYR  89  -5.760   0.679   5.643
  667    HD1  TYR  89           HD1      TYR  89  -5.217   2.744   7.001
  668    HD2  TYR  89           HD2      TYR  89  -8.301   2.783   3.988
  669    HE1  TYR  89           HE1      TYR  89  -6.134   4.844   7.950
  670    HE2  TYR  89           HE2      TYR  89  -9.215   4.867   4.968
  671    HH   TYR  89           HH       TYR  89  -7.573   6.539   7.614
  672    H    ALA  90           H        ALA  90  -3.013   0.454   4.955
  673    HA   ALA  90           HA       ALA  90  -3.122  -1.948   3.222
  674    HB1  ALA  90           3HB      ALA  90  -1.583  -0.374   2.094
  675    HB2  ALA  90           1HB      ALA  90  -0.706  -1.768   2.732
  676    HB3  ALA  90           2HB      ALA  90  -0.646  -0.217   3.576
  677    H    VAL  91           H        VAL  91  -2.271  -3.761   4.167
  678    HA   VAL  91           HA       VAL  91  -1.133  -3.568   6.905
  679    HB   VAL  91           HB       VAL  91  -3.374  -5.501   6.119
  680   HG11  VAL  91          1HG1      VAL  91  -3.453  -5.919   8.577
  681   HG12  VAL  91          2HG1      VAL  91  -2.094  -4.821   8.814
  682   HG13  VAL  91          3HG1      VAL  91  -1.871  -6.325   7.923
  683   HG21  VAL  91          3HG2      VAL  91  -4.797  -4.094   7.622
  684   HG22  VAL  91          1HG2      VAL  91  -4.282  -3.213   6.190
  685   HG23  VAL  91          2HG2      VAL  91  -3.496  -2.913   7.743
  686    H    VAL  92           H        VAL  92   0.346  -5.086   7.382
  687    HA   VAL  92           HA       VAL  92   1.412  -6.680   5.176
  688    HB   VAL  92           HB       VAL  92   2.479  -6.417   8.037
  689   HG11  VAL  92          1HG1      VAL  92   3.437  -8.277   6.685
  690   HG12  VAL  92          2HG1      VAL  92   4.637  -7.017   6.961
  691   HG13  VAL  92          3HG1      VAL  92   3.833  -7.143   5.393
  692   HG21  VAL  92          3HG2      VAL  92   3.083  -4.709   5.575
  693   HG22  VAL  92          1HG2      VAL  92   3.951  -4.619   7.110
  694   HG23  VAL  92          2HG2      VAL  92   2.255  -4.158   7.033
  695    H    ASP  93           H        ASP  93   1.324  -8.876   5.049
  696    HA   ASP  93           HA       ASP  93  -0.666 -10.408   6.022
  697    HB2  ASP  93           1HB      ASP  93   0.869 -12.411   5.623
  698    HB3  ASP  93           2HB      ASP  93   0.799 -11.250   4.302
  699    HA   PRO  94           HA       PRO  94   0.194 -10.913  10.396
  700    HB2  PRO  94           1HB      PRO  94  -1.293 -13.101  11.067
  701    HB3  PRO  94           2HB      PRO  94  -2.067 -11.593  10.524
  702    HG2  PRO  94           1HG      PRO  94  -1.384 -14.033   8.864
  703    HG3  PRO  94           2HG      PRO  94  -2.957 -13.205   9.012
  704    HD2  PRO  94           1HD      PRO  94  -1.307 -12.636   6.928
  705    HD3  PRO  94           2HD      PRO  94  -2.231 -11.326   7.719
  706    H    ASP  95           H        ASP  95   1.994 -11.645  11.400
  707    HA   ASP  95           HA       ASP  95   3.725 -13.610  10.285
  708    HB2  ASP  95           1HB      ASP  95   4.482 -11.679  11.670
  709    HB3  ASP  95           2HB      ASP  95   3.733 -12.406  13.085
  710    H    ASN  96           H        ASN  96   1.296 -13.664  12.825
  711    HA   ASN  96           HA       ASN  96   1.081 -16.544  12.700
  712    HB2  ASN  96           1HB      ASN  96   3.048 -16.265  14.210
  713    HB3  ASN  96           2HB      ASN  96   2.074 -15.272  15.288
  714   HD21  ASN  96          2HD2      ASN  96   1.907 -16.676  17.096
  715   HD22  ASN  96          1HD2      ASN  96   1.230 -18.230  17.019
  716    H    ARG  97           H        ARG  97  -0.978 -15.656  12.008
  717    HA   ARG  97           HA       ARG  97  -3.192 -15.234  12.306
  718    HB2  ARG  97           1HB      ARG  97  -2.692 -16.137  15.171
  719    HB3  ARG  97           2HB      ARG  97  -4.258 -16.037  14.375
  720    HG2  ARG  97           1HG      ARG  97  -3.566 -17.744  12.728
  721    HG3  ARG  97           2HG      ARG  97  -1.962 -17.825  13.461
  722    HD2  ARG  97           1HD      ARG  97  -2.965 -18.598  15.594
  723    HD3  ARG  97           2HD      ARG  97  -4.572 -18.520  14.868
  724    HE   ARG  97           HE       ARG  97  -2.928 -20.164  13.256
  725   HH11  ARG  97          1HH2      ARG  97  -4.406 -20.128  16.415
  726   HH12  ARG  97          2HH2      ARG  97  -4.547 -21.852  16.508
  727   HH21  ARG  97          1HH1      ARG  97  -3.124 -22.420  13.406
  728   HH22  ARG  97          2HH1      ARG  97  -3.827 -23.139  14.816
  729    H    VAL  98           H        VAL  98  -2.047 -14.352  15.550
  730    HA   VAL  98           HA       VAL  98  -3.582 -12.031  15.816
  731    HB   VAL  98           HB       VAL  98  -0.881 -12.626  17.109
  732   HG11  VAL  98          1HG1      VAL  98  -3.205 -10.849  18.001
  733   HG12  VAL  98          2HG1      VAL  98  -1.619 -10.279  17.482
  734   HG13  VAL  98          3HG1      VAL  98  -1.774 -11.200  18.968
  735   HG21  VAL  98          3HG2      VAL  98  -2.249 -13.641  18.928
  736   HG22  VAL  98          1HG2      VAL  98  -2.486 -14.497  17.407
  737   HG23  VAL  98          2HG2      VAL  98  -3.712 -13.366  17.982
  738    H    ALA  99           H        ALA  99  -3.180  -9.850  15.457
  739    HA   ALA  99           HA       ALA  99  -0.700  -8.813  14.429
  740    HB1  ALA  99           3HB      ALA  99  -3.023  -9.138  12.488
  741    HB2  ALA  99           1HB      ALA  99  -1.495 -10.012  12.409
  742    HB3  ALA  99           2HB      ALA  99  -1.523  -8.266  12.156
  743    H    GLU 100           H        GLU 100  -3.713  -8.517  15.826
  744    HA   GLU 100           HA       GLU 100  -4.607  -5.953  15.193
  745    HB2  GLU 100           1HB      GLU 100  -5.855  -7.521  16.616
  746    HB3  GLU 100           2HB      GLU 100  -4.638  -7.389  17.878
  747    HG2  GLU 100           1HG      GLU 100  -6.144  -4.907  16.896
  748    HG3  GLU 100           2HG      GLU 100  -6.841  -5.955  18.120
  749    H    SER 101           H        SER 101  -1.754  -6.911  16.903
  750    HA   SER 101           HA       SER 101  -1.239  -4.259  18.073
  751    HB2  SER 101           1HB      SER 101  -0.630  -6.320  19.314
  752    HB3  SER 101           2HB      SER 101   0.453  -6.789  18.007
  753    HG   SER 101           HG       SER 101   0.654  -4.253  19.230
  754    H    ASP 102           H        ASP 102   0.416  -6.472  15.788
  755    HA   ASP 102           HA       ASP 102   2.363  -4.666  14.880
  756    HB2  ASP 102           1HB      ASP 102   2.442  -7.124  14.532
  757    HB3  ASP 102           2HB      ASP 102   1.081  -7.014  13.421
  758    H    LYS 103           H        LYS 103  -0.968  -5.213  13.877
  759    HA   LYS 103           HA       LYS 103  -0.952  -3.805  11.430
  760    HB2  LYS 103           1HB      LYS 103  -2.846  -5.212  12.148
  761    HB3  LYS 103           2HB      LYS 103  -3.187  -4.105  13.477
  762    HG2  LYS 103           1HG      LYS 103  -3.703  -2.292  11.860
  763    HG3  LYS 103           2HG      LYS 103  -3.296  -3.367  10.519
  764    HD2  LYS 103           1HD      LYS 103  -5.164  -4.863  11.136
  765    HD3  LYS 103           2HD      LYS 103  -5.538  -3.846  12.533
  766    HE2  LYS 103           1HE      LYS 103  -6.017  -1.942  11.041
  767    HE3  LYS 103           2HE      LYS 103  -5.613  -2.923   9.636
  768    HZ1  LYS 103           3HZ      LYS 103  -7.946  -2.899   9.896
  769    HZ2  LYS 103           1HZ      LYS 103  -7.853  -3.343  11.527
  770    HZ3  LYS 103           2HZ      LYS 103  -7.414  -4.452  10.316
  771    H    ALA 104           H        ALA 104  -2.053  -2.612  14.626
  772    HA   ALA 104           HA       ALA 104  -2.352   0.076  13.905
  773    HB1  ALA 104           3HB      ALA 104  -1.570  -1.059  16.616
  774    HB2  ALA 104           1HB      ALA 104  -3.218  -0.891  16.014
  775    HB3  ALA 104           2HB      ALA 104  -2.247   0.546  16.328
  776    H    ASN 105           H        ASN 105   0.484  -1.615  15.239
  777    HA   ASN 105           HA       ASN 105   2.183   0.657  15.427
  778    HB2  ASN 105           1HB      ASN 105   2.952  -2.254  14.962
  779    HB3  ASN 105           2HB      ASN 105   4.005  -0.985  15.593
  780   HD21  ASN 105          2HD2      ASN 105   2.054   0.274  17.344
  781   HD22  ASN 105          1HD2      ASN 105   1.717  -0.818  18.597
  782    H    ASN 106           H        ASN 106   1.981  -1.874  12.896
  783    HA   ASN 106           HA       ASN 106   3.627  -0.274  11.046
  784    HB2  ASN 106           1HB      ASN 106   2.377  -3.029  10.677
  785    HB3  ASN 106           2HB      ASN 106   3.585  -2.273   9.641
  786   HD21  ASN 106          2HD2      ASN 106   3.140  -3.208  13.107
  787   HD22  ASN 106          1HD2      ASN 106   4.768  -3.630  13.337
  788    H    VAL 107           H        VAL 107   1.379   1.124  11.532
  789    HA   VAL 107           HA       VAL 107  -0.542   0.592   9.311
  790    HB   VAL 107           HB       VAL 107  -1.427   0.974  11.639
  791   HG11  VAL 107          1HG1      VAL 107  -1.304   3.131  12.721
  792   HG12  VAL 107          2HG1      VAL 107  -0.619   3.900  11.289
  793   HG13  VAL 107          3HG1      VAL 107   0.351   2.775  12.226
  794   HG21  VAL 107          3HG2      VAL 107  -3.210   2.555  10.955
  795   HG22  VAL 107          1HG2      VAL 107  -2.827   1.461   9.626
  796   HG23  VAL 107          2HG2      VAL 107  -2.218   3.116   9.610
  797    H    PHE 108           H        PHE 108  -0.631   1.896   7.572
  798    HA   PHE 108           HA       PHE 108   0.684   4.546   7.601
  799    HB2  PHE 108           1HB      PHE 108   1.240   2.459   5.451
  800    HB3  PHE 108           2HB      PHE 108   1.938   4.072   5.559
  801    HD1  PHE 108           HD2      PHE 108   3.102   4.639   7.934
  802    HD2  PHE 108           HD1      PHE 108   2.583   0.648   6.349
  803    HE1  PHE 108           HE2      PHE 108   4.895   3.801   9.417
  804    HE2  PHE 108           HE1      PHE 108   4.376  -0.164   7.846
  805    HZ   PHE 108           HZ       PHE 108   5.535   1.406   9.377
  806    H    SER 109           H        SER 109  -0.380   6.019   6.467
  807    HA   SER 109           HA       SER 109  -2.225   5.346   4.308
  808    HB2  SER 109           1HB      SER 109  -3.262   6.538   6.908
  809    HB3  SER 109           2HB      SER 109  -4.196   6.322   5.426
  810    HG   SER 109           HG       SER 109  -4.138   4.623   7.241
  811    H    ARG 110           H        ARG 110  -2.655   7.103   3.028
  812    HA   ARG 110           HA       ARG 110  -1.776   9.799   3.895
  813    HB2  ARG 110           1HB      ARG 110   0.161   8.594   2.744
  814    HB3  ARG 110           2HB      ARG 110  -0.804   8.565   1.271
  815    HG2  ARG 110           1HG      ARG 110  -0.986  11.091   1.406
  816    HG3  ARG 110           2HG      ARG 110   0.080  11.056   2.804
  817    HD2  ARG 110           1HD      ARG 110   1.825   9.926   1.363
  818    HD3  ARG 110           2HD      ARG 110   0.764  10.177  -0.031
  819    HE   ARG 110           HE       ARG 110   2.440  12.146   1.247
  820   HH11  ARG 110          1HH2      ARG 110  -0.578  11.706  -0.408
  821   HH12  ARG 110          2HH2      ARG 110  -0.680  13.352  -0.939
  822   HH21  ARG 110          1HH1      ARG 110   2.291  14.309   0.547
  823   HH22  ARG 110          2HH1      ARG 110   0.932  14.815  -0.401
  824    H    ILE 111           H        ILE 111  -3.228  11.248   3.329
  825    HA   ILE 111           HA       ILE 111  -5.396  10.550   1.480
  826    HB   ILE 111           HB       ILE 111  -4.989  13.017   3.241
  827   HG12  ILE 111          1HG1      ILE 111  -6.877  11.965   4.589
  828   HG13  ILE 111          2HG1      ILE 111  -6.746  10.525   3.587
  829   HG21  ILE 111          1HG2      ILE 111  -7.357  12.103   1.540
  830   HG22  ILE 111          2HG2      ILE 111  -6.437  13.597   1.360
  831   HG23  ILE 111          3HG2      ILE 111  -7.464  13.369   2.765
  832   HD11  ILE 111          3HD1      ILE 111  -4.249  11.487   4.972
  833   HD12  ILE 111          1HD1      ILE 111  -4.795   9.850   4.603
  834   HD13  ILE 111          2HD1      ILE 111  -5.511  10.739   5.937
  835    H    VAL 112           H        VAL 112  -5.845  11.690  -0.375
  836    HA   VAL 112           HA       VAL 112  -3.881  13.714  -1.348
  837    HB   VAL 112           HB       VAL 112  -3.972  12.579  -3.631
  838   HG11  VAL 112          1HG1      VAL 112  -2.287  10.859  -3.075
  839   HG12  VAL 112          2HG1      VAL 112  -2.730  10.959  -1.369
  840   HG13  VAL 112          3HG1      VAL 112  -1.998  12.344  -2.177
  841   HG21  VAL 112          3HG2      VAL 112  -4.608  10.178  -3.680
  842   HG22  VAL 112          1HG2      VAL 112  -5.983  11.190  -3.242
  843   HG23  VAL 112          2HG2      VAL 112  -5.130  10.270  -2.000
  844    H    LYS 113           H        LYS 113  -4.710  15.310  -2.552
  845    HA   LYS 113           HA       LYS 113  -7.650  15.514  -2.713
  846    HB2  LYS 113           1HB      LYS 113  -5.466  17.591  -3.088
  847    HB3  LYS 113           2HB      LYS 113  -7.200  17.921  -3.157
  848    HG2  LYS 113           1HG      LYS 113  -7.437  17.096  -0.811
  849    HG3  LYS 113           2HG      LYS 113  -5.693  16.819  -0.743
  850    HD2  LYS 113           1HD      LYS 113  -5.297  19.248  -1.130
  851    HD3  LYS 113           2HD      LYS 113  -7.040  19.519  -1.194
  852    HE2  LYS 113           1HE      LYS 113  -6.150  20.064   1.059
  853    HE3  LYS 113           2HE      LYS 113  -7.259  18.693   1.141
  854    HZ1  LYS 113           3HZ      LYS 113  -5.641  17.390   1.877
  855    HZ2  LYS 113           1HZ      LYS 113  -4.660  18.765   2.034
  856    HZ3  LYS 113           2HZ      LYS 113  -4.598  17.836   0.613
  857    H    VAL 114           H        VAL 114  -8.740  15.780  -4.613
  858    HA   VAL 114           HA       VAL 114  -7.221  15.637  -7.182
  859    HB   VAL 114           HB       VAL 114  -8.132  13.410  -6.555
  860   HG11  VAL 114          1HG1      VAL 114 -10.537  12.989  -6.460
  861   HG12  VAL 114          2HG1      VAL 114 -10.897  14.683  -6.775
  862   HG13  VAL 114          3HG1      VAL 114 -10.135  14.214  -5.257
  863   HG21  VAL 114          3HG2      VAL 114  -9.609  14.671  -8.914
  864   HG22  VAL 114          1HG2      VAL 114  -9.287  12.953  -8.679
  865   HG23  VAL 114          2HG2      VAL 114  -7.953  14.065  -8.956
  866    H    LEU 115           H        LEU 115  -7.878  16.975  -8.732
  867    HA   LEU 115           HA       LEU 115 -10.193  18.771  -8.173
  868    HB2  LEU 115           1HB      LEU 115  -7.828  19.722  -8.481
  869    HB3  LEU 115           2HB      LEU 115  -7.947  19.261 -10.165
  870    HG   LEU 115           HG       LEU 115 -10.279  20.666 -10.051
  871   HD11  LEU 115          1HD1      LEU 115 -10.139  22.602  -8.524
  872   HD12  LEU 115          2HD1      LEU 115  -8.623  22.001  -7.856
  873   HD13  LEU 115          3HD1      LEU 115 -10.117  21.113  -7.587
  874   HD21  LEU 115          3HD2      LEU 115  -7.555  22.037 -10.162
  875   HD22  LEU 115          1HD2      LEU 115  -9.065  22.717 -10.775
  876   HD23  LEU 115          2HD2      LEU 115  -8.381  21.277 -11.524
  877    H    GLU 116           H        GLU 116 -11.899  18.800  -9.473
  878    HA   GLU 116           HA       GLU 116 -11.815  17.883 -12.226
  879    HB2  GLU 116           1HB      GLU 116 -11.928  15.737 -10.875
  880    HB3  GLU 116           2HB      GLU 116 -13.466  16.274 -10.214
  881    HG2  GLU 116           1HG      GLU 116 -13.931  14.775 -12.087
  882    HG3  GLU 116           2HG      GLU 116 -14.373  16.399 -12.589
  883    H    HIS 117           H        HIS 117 -12.598  19.916 -12.664
  884    HA   HIS 117           HA       HIS 117 -15.457  20.201 -12.616
  885    HB2  HIS 117           1HB      HIS 117 -14.920  20.916 -10.275
  886    HB3  HIS 117           2HB      HIS 117 -13.847  22.161 -10.907
  887    HD1  HIS 117           HD1      HIS 117 -15.048  24.018 -12.471
  888    HD2  HIS 117           HD2      HIS 117 -17.616  21.658 -10.186
  889    HE1  HIS 117           HE1      HIS 117 -17.308  25.159 -12.525
  890    HE2  HIS 117           HE2      HIS 117 -18.886  23.732 -11.139
  891    H    HIS 118           H        HIS 118 -15.291  20.507 -14.804
  892    HA   HIS 118           HA       HIS 118 -14.634  23.167 -15.728
  893    HB2  HIS 118           1HB      HIS 118 -12.889  22.459 -17.351
  894    HB3  HIS 118           2HB      HIS 118 -12.364  22.187 -15.690
  895    HD1  HIS 118           HD1      HIS 118 -14.498  19.562 -15.751
  896    HD2  HIS 118           HD2      HIS 118 -11.042  20.239 -17.982
  897    HE1  HIS 118           HE1      HIS 118 -13.702  17.294 -16.543
  898    HE2  HIS 118           HE2      HIS 118 -11.600  17.689 -17.908
  899    H    HIS 119           H        HIS 119 -14.924  23.281 -18.165
  900    HA   HIS 119           HA       HIS 119 -17.475  22.221 -18.847
  901    HB2  HIS 119           1HB      HIS 119 -15.341  23.456 -20.639
  902    HB3  HIS 119           2HB      HIS 119 -17.039  23.229 -21.069
  903    HD1  HIS 119           HD1      HIS 119 -18.793  24.508 -19.409
  904    HD2  HIS 119           HD2      HIS 119 -14.843  25.836 -19.302
  905    HE1  HIS 119           HE1      HIS 119 -18.831  26.779 -18.291
  906    HE2  HIS 119           HE2      HIS 119 -16.431  27.603 -18.217
  907    H    HIS 120           H        HIS 120 -17.815  20.105 -19.229
  908    HA   HIS 120           HA       HIS 120 -15.806  18.245 -20.038
  909    HB2  HIS 120           1HB      HIS 120 -18.843  17.985 -20.140
  910    HB3  HIS 120           2HB      HIS 120 -17.689  16.654 -20.242
  911    HD1  HIS 120           HD1      HIS 120 -16.027  16.474 -18.049
  912    HD2  HIS 120           HD2      HIS 120 -19.581  18.591 -17.542
  913    HE1  HIS 120           HE1      HIS 120 -16.406  16.649 -15.551
  914    HE2  HIS 120           HE2      HIS 120 -18.571  17.937 -15.225
  915    H    HIS 121           H        HIS 121 -15.359  17.362 -22.029
  916    HA   HIS 121           HA       HIS 121 -15.794  18.950 -24.361
  917    HB2  HIS 121           1HB      HIS 121 -14.824  16.076 -24.095
  918    HB3  HIS 121           2HB      HIS 121 -14.667  17.079 -25.541
  919    HD1  HIS 121           HD1      HIS 121 -13.115  16.401 -22.250
  920    HD2  HIS 121           HD2      HIS 121 -12.854  19.347 -25.189
  921    HE1  HIS 121           HE1      HIS 121 -11.027  17.740 -21.739
  922    HE2  HIS 121           HE2      HIS 121 -10.855  19.540 -23.521
  923    H    HIS 122           H        HIS 122 -17.282  15.982 -23.126
  924    HA   HIS 122           HA       HIS 122 -19.659  16.410 -24.791
  925    HB2  HIS 122           1HB      HIS 122 -18.005  13.854 -25.010
  926    HB3  HIS 122           2HB      HIS 122 -19.573  14.136 -25.769
  927    HD1  HIS 122           HD1      HIS 122 -15.955  15.137 -25.966
  928    HD2  HIS 122           HD2      HIS 122 -19.493  15.819 -28.064
  929    HE1  HIS 122           HE1      HIS 122 -15.297  16.294 -28.120
  930    HE2  HIS 122           HE2      HIS 122 -17.443  16.717 -29.411
  Start of MODEL    7
    1    H1   MET   1           1H       MET   1  13.740  11.760   3.242
    2    H2   MET   1           2H       MET   1  13.221  10.414   2.343
    3    H3   MET   1           3H       MET   1  14.433  10.237   3.521
    4    HA   MET   1           HA       MET   1  12.688   9.469   4.727
    5    HB2  MET   1           1HB      MET   1  12.469  12.502   4.972
    6    HB3  MET   1           2HB      MET   1  11.792  11.357   6.130
    7    HG2  MET   1           1HG      MET   1  14.064  10.466   6.583
    8    HG3  MET   1           2HG      MET   1  14.744  11.626   5.439
    9    HE1  MET   1           3HE      MET   1  15.785  12.842   9.027
   10    HE2  MET   1           1HE      MET   1  16.308  12.095   7.510
   11    HE3  MET   1           2HE      MET   1  15.362  11.169   8.672
   12    H    ASP   2           H        ASP   2  11.803   9.313   2.144
   13    HA   ASP   2           HA       ASP   2   9.407  10.724   1.561
   14    HB2  ASP   2           1HB      ASP   2  10.736   9.460  -0.125
   15    HB3  ASP   2           2HB      ASP   2  10.252   7.949   0.630
   16    H    LEU   3           H        LEU   3   7.231  10.040   1.713
   17    HA   LEU   3           HA       LEU   3   6.539   8.988   4.203
   18    HB2  LEU   3           1HB      LEU   3   4.972   9.642   1.719
   19    HB3  LEU   3           2HB      LEU   3   4.136   8.835   3.041
   20    HG   LEU   3           HG       LEU   3   4.775  10.660   4.598
   21   HD11  LEU   3          1HD1      LEU   3   6.167  11.828   2.146
   22   HD12  LEU   3          2HD1      LEU   3   6.876  11.438   3.717
   23   HD13  LEU   3          3HD1      LEU   3   5.763  12.787   3.571
   24   HD21  LEU   3          3HD2      LEU   3   2.645  10.823   3.332
   25   HD22  LEU   3          1HD2      LEU   3   3.481  11.678   2.031
   26   HD23  LEU   3          2HD2      LEU   3   3.331  12.418   3.624
   27    HA   PRO   4           HA       PRO   4   6.611   4.554   3.682
   28    HB2  PRO   4           1HB      PRO   4   3.842   4.454   4.923
   29    HB3  PRO   4           2HB      PRO   4   5.305   3.550   5.389
   30    HG2  PRO   4           1HG      PRO   4   4.534   5.610   6.857
   31    HG3  PRO   4           2HG      PRO   4   6.254   5.432   6.463
   32    HD2  PRO   4           1HD      PRO   4   4.210   7.277   5.156
   33    HD3  PRO   4           2HD      PRO   4   5.859   7.622   5.709
   34    H    ILE   5           H        ILE   5   3.757   6.298   2.661
   35    HA   ILE   5           HA       ILE   5   3.100   4.210   0.603
   36    HB   ILE   5           HB       ILE   5   1.297   6.360   1.808
   37   HG12  ILE   5          1HG1      ILE   5   1.237   3.311   2.175
   38   HG13  ILE   5          2HG1      ILE   5   1.917   4.418   3.360
   39   HG21  ILE   5          1HG2      ILE   5  -0.508   5.105   0.559
   40   HG22  ILE   5          2HG2      ILE   5   0.734   4.121  -0.201
   41   HG23  ILE   5          3HG2      ILE   5   0.652   5.849  -0.526
   42   HD11  ILE   5          3HD1      ILE   5  -0.960   4.575   2.421
   43   HD12  ILE   5          1HD1      ILE   5  -0.211   5.469   3.742
   44   HD13  ILE   5          2HD1      ILE   5  -0.436   3.723   3.847
   45    H    THR   6           H        THR   6   3.180   4.735  -1.474
   46    HA   THR   6           HA       THR   6   3.214   7.546  -2.375
   47    HB   THR   6           HB       THR   6   5.570   7.174  -2.048
   48    HG1  THR   6           HG1      THR   6   5.090   8.142  -3.984
   49   HG21  THR   6          3HG2      THR   6   6.771   5.255  -3.036
   50   HG22  THR   6          1HG2      THR   6   5.250   4.588  -3.614
   51   HG23  THR   6          2HG2      THR   6   5.564   4.697  -1.883
   52    H    LEU   7           H        LEU   7   2.353   7.814  -4.335
   53    HA   LEU   7           HA       LEU   7   1.870   5.505  -6.108
   54    HB2  LEU   7           1HB      LEU   7  -0.515   6.329  -6.405
   55    HB3  LEU   7           2HB      LEU   7  -0.179   5.557  -4.868
   56    HG   LEU   7           HG       LEU   7   0.285   8.542  -4.834
   57   HD11  LEU   7          1HD1      LEU   7  -2.089   9.148  -4.683
   58   HD12  LEU   7          2HD1      LEU   7  -2.556   7.495  -5.071
   59   HD13  LEU   7          3HD1      LEU   7  -1.724   8.482  -6.275
   60   HD21  LEU   7          3HD2      LEU   7   0.389   7.083  -2.798
   61   HD22  LEU   7          1HD2      LEU   7  -1.327   6.719  -2.994
   62   HD23  LEU   7          2HD2      LEU   7  -0.805   8.370  -2.647
   63    H    SER   8           H        SER   8   1.133   6.132  -8.240
   64    HA   SER   8           HA       SER   8   2.672   8.409  -9.241
   65    HB2  SER   8           1HB      SER   8   2.724   6.280 -10.456
   66    HB3  SER   8           2HB      SER   8   0.976   6.322 -10.660
   67    HG   SER   8           HG       SER   8   2.484   8.536 -11.473
   68    H    LYS   9           H        LYS   9   1.772  10.373  -9.212
   69    HA   LYS   9           HA       LYS   9  -0.968  10.801 -10.228
   70    HB2  LYS   9           1HB      LYS   9  -1.477  12.290  -8.293
   71    HB3  LYS   9           2HB      LYS   9  -1.343  10.597  -7.829
   72    HG2  LYS   9           1HG      LYS   9   0.983  10.976  -7.069
   73    HG3  LYS   9           2HG      LYS   9   0.864  12.673  -7.506
   74    HD2  LYS   9           1HD      LYS   9  -0.880  11.267  -5.432
   75    HD3  LYS   9           2HD      LYS   9   0.500  12.300  -5.071
   76    HE2  LYS   9           1HE      LYS   9  -1.285  13.833  -4.821
   77    HE3  LYS   9           2HE      LYS   9  -0.889  14.111  -6.512
   78    HZ1  LYS   9           3HZ      LYS   9  -2.817  13.244  -7.165
   79    HZ2  LYS   9           1HZ      LYS   9  -3.314  13.402  -5.550
   80    HZ3  LYS   9           2HZ      LYS   9  -2.702  11.918  -6.106
   81    H    GLU  10           H        GLU  10   1.220  11.298 -11.682
   82    HA   GLU  10           HA       GLU  10   2.475  13.792 -11.413
   83    HB2  GLU  10           1HB      GLU  10   1.667  12.315 -13.953
   84    HB3  GLU  10           2HB      GLU  10   2.856  13.619 -13.885
   85    HG2  GLU  10           1HG      GLU  10   3.094  10.965 -12.393
   86    HG3  GLU  10           2HG      GLU  10   3.921  11.352 -13.896
   87    H    THR  11           H        THR  11  -0.579  12.955 -13.021
   88    HA   THR  11           HA       THR  11  -1.336  15.856 -13.118
   89    HB   THR  11           HB       THR  11  -2.569  15.385 -15.144
   90    HG1  THR  11           HG1      THR  11  -3.168  13.405 -15.371
   91   HG21  THR  11          3HG2      THR  11   0.239  14.217 -15.345
   92   HG22  THR  11          1HG2      THR  11  -0.122  15.945 -15.327
   93   HG23  THR  11          2HG2      THR  11  -0.686  14.938 -16.660
   94    HA   PRO  12           HA       PRO  12  -4.253  13.605 -10.173
   95    HB2  PRO  12           1HB      PRO  12  -4.721  16.570  -9.646
   96    HB3  PRO  12           2HB      PRO  12  -4.703  15.219  -8.484
   97    HG2  PRO  12           1HG      PRO  12  -2.578  16.775  -8.645
   98    HG3  PRO  12           2HG      PRO  12  -2.336  15.011  -8.599
   99    HD2  PRO  12           1HD      PRO  12  -2.204  16.853 -11.015
  100    HD3  PRO  12           2HD      PRO  12  -1.149  15.476 -10.605
  101    H    PHE  13           H        PHE  13  -6.126  12.905 -11.044
  102    HA   PHE  13           HA       PHE  13  -8.201  14.685 -11.927
  103    HB2  PHE  13           1HB      PHE  13  -6.661  14.698 -13.930
  104    HB3  PHE  13           2HB      PHE  13  -6.874  12.959 -14.078
  105    HD1  PHE  13           HD2      PHE  13  -8.643  16.255 -14.170
  106    HD2  PHE  13           HD1      PHE  13  -8.966  12.039 -15.029
  107    HE1  PHE  13           HE2      PHE  13 -10.762  16.659 -15.382
  108    HE2  PHE  13           HE1      PHE  13 -11.088  12.456 -16.235
  109    HZ   PHE  13           HZ       PHE  13 -11.989  14.763 -16.414
  110    H    GLU  14           H        GLU  14 -10.029  13.686 -11.330
  111    HA   GLU  14           HA       GLU  14 -10.200  11.046 -10.383
  112    HB2  GLU  14           1HB      GLU  14 -12.423  12.823 -11.469
  113    HB3  GLU  14           2HB      GLU  14 -12.668  11.378 -10.477
  114    HG2  GLU  14           1HG      GLU  14 -11.367  12.426  -8.634
  115    HG3  GLU  14           2HG      GLU  14 -11.131  13.870  -9.619
  116    H    GLY  15           H        GLY  15 -10.995   9.126 -11.274
  117    HA2  GLY  15           1HA      GLY  15 -11.768   7.658 -12.929
  118    HA3  GLY  15           2HA      GLY  15 -11.759   8.963 -14.107
  119    H    GLU  16           H        GLU  16  -8.957   9.702 -13.290
  120    HA   GLU  16           HA       GLU  16  -7.560   8.117 -15.223
  121    HB2  GLU  16           1HB      GLU  16  -7.010  10.514 -14.644
  122    HB3  GLU  16           2HB      GLU  16  -6.348   9.960 -13.107
  123    HG2  GLU  16           1HG      GLU  16  -4.698   8.547 -14.324
  124    HG3  GLU  16           2HG      GLU  16  -5.364   9.092 -15.861
  125    H    GLU  17           H        GLU  17  -6.116   6.468 -14.961
  126    HA   GLU  17           HA       GLU  17  -6.355   4.871 -12.572
  127    HB2  GLU  17           1HB      GLU  17  -6.136   3.915 -14.889
  128    HB3  GLU  17           2HB      GLU  17  -4.466   4.478 -14.942
  129    HG2  GLU  17           1HG      GLU  17  -3.946   3.084 -12.940
  130    HG3  GLU  17           2HG      GLU  17  -5.616   2.525 -12.896
  131    H    ILE  18           H        ILE  18  -4.843   4.483 -11.022
  132    HA   ILE  18           HA       ILE  18  -2.286   6.029 -11.047
  133    HB   ILE  18           HB       ILE  18  -2.666   6.488  -8.592
  134   HG12  ILE  18          1HG1      ILE  18  -5.584   5.715  -9.180
  135   HG13  ILE  18          2HG1      ILE  18  -4.471   4.664  -8.317
  136   HG21  ILE  18          1HG2      ILE  18  -4.739   7.666 -10.500
  137   HG22  ILE  18          2HG2      ILE  18  -3.081   8.235 -10.301
  138   HG23  ILE  18          3HG2      ILE  18  -4.224   8.390  -8.976
  139   HD11  ILE  18          3HD1      ILE  18  -5.844   5.961  -6.743
  140   HD12  ILE  18          1HD1      ILE  18  -5.234   7.462  -7.428
  141   HD13  ILE  18          2HD1      ILE  18  -4.141   6.368  -6.586
  142    H    THR  19           H        THR  19  -0.594   5.107  -9.977
  143    HA   THR  19           HA       THR  19  -0.769   2.190  -9.630
  144    HB   THR  19           HB       THR  19   1.668   4.018  -9.452
  145    HG1  THR  19           HG1      THR  19   1.861   2.852 -11.633
  146   HG21  THR  19          3HG2      THR  19   2.900   1.911  -9.940
  147   HG22  THR  19          1HG2      THR  19   1.392   1.006  -9.865
  148   HG23  THR  19          2HG2      THR  19   2.024   1.791  -8.417
  149    H    VAL  20           H        VAL  20  -1.422   1.497  -7.680
  150    HA   VAL  20           HA       VAL  20  -0.834   3.075  -5.229
  151    HB   VAL  20           HB       VAL  20  -2.493   0.513  -5.508
  152   HG11  VAL  20          1HG1      VAL  20  -1.759   0.973  -3.191
  153   HG12  VAL  20          2HG1      VAL  20  -3.476   1.316  -3.351
  154   HG13  VAL  20          3HG1      VAL  20  -2.320   2.642  -3.318
  155   HG21  VAL  20          3HG2      VAL  20  -3.441   2.320  -6.915
  156   HG22  VAL  20          1HG2      VAL  20  -3.365   3.444  -5.555
  157   HG23  VAL  20          2HG2      VAL  20  -4.452   2.053  -5.503
  158    H    SER  21           H        SER  21   0.982   2.646  -4.160
  159    HA   SER  21           HA       SER  21   2.043  -0.140  -4.004
  160    HB2  SER  21           1HB      SER  21   3.671   2.394  -4.364
  161    HB3  SER  21           2HB      SER  21   4.307   0.762  -4.169
  162    HG   SER  21           HG       SER  21   4.211   1.053  -6.320
  163    H    ALA  22           H        ALA  22   2.525  -0.810  -2.032
  164    HA   ALA  22           HA       ALA  22   2.552   1.133   0.244
  165    HB1  ALA  22           3HB      ALA  22   0.547  -0.307   0.213
  166    HB2  ALA  22           1HB      ALA  22   1.581  -0.667   1.599
  167    HB3  ALA  22           2HB      ALA  22   1.571  -1.740   0.194
  168    H    ARG  23           H        ARG  23   4.370   1.187   1.374
  169    HA   ARG  23           HA       ARG  23   6.535  -0.722   0.787
  170    HB2  ARG  23           1HB      ARG  23   6.457   1.710   2.614
  171    HB3  ARG  23           2HB      ARG  23   7.898   0.758   2.247
  172    HG2  ARG  23           1HG      ARG  23   7.630   1.292  -0.166
  173    HG3  ARG  23           2HG      ARG  23   6.208   2.259   0.195
  174    HD2  ARG  23           1HD      ARG  23   7.595   3.751   1.601
  175    HD3  ARG  23           2HD      ARG  23   9.017   2.772   1.244
  176    HE   ARG  23           HE       ARG  23   7.804   3.641  -1.178
  177   HH11  ARG  23          1HH2      ARG  23   9.622   4.793   1.543
  178   HH12  ARG  23          2HH2      ARG  23  10.361   6.093   0.674
  179   HH21  ARG  23          1HH1      ARG  23   8.765   5.365  -2.315
  180   HH22  ARG  23          2HH1      ARG  23   9.864   6.427  -1.503
  181    H    VAL  24           H        VAL  24   6.740  -2.539   1.901
  182    HA   VAL  24           HA       VAL  24   5.570  -2.787   4.638
  183    HB   VAL  24           HB       VAL  24   5.795  -5.273   4.198
  184   HG11  VAL  24          1HG1      VAL  24   3.863  -5.379   2.633
  185   HG12  VAL  24          2HG1      VAL  24   4.141  -3.695   2.177
  186   HG13  VAL  24          3HG1      VAL  24   3.649  -4.095   3.824
  187   HG21  VAL  24          3HG2      VAL  24   6.130  -6.003   1.837
  188   HG22  VAL  24          1HG2      VAL  24   7.560  -5.223   2.479
  189   HG23  VAL  24          2HG2      VAL  24   6.508  -4.348   1.378
  190    H    THR  25           H        THR  25   6.874  -2.853   6.327
  191    HA   THR  25           HA       THR  25   9.785  -2.921   5.963
  192    HB   THR  25           HB       THR  25   8.141  -2.517   8.497
  193    HG1  THR  25           HG1      THR  25   8.129  -0.987   6.538
  194   HG21  THR  25          3HG2      THR  25  10.465  -3.189   9.001
  195   HG22  THR  25          1HG2      THR  25  10.262  -1.472   9.330
  196   HG23  THR  25          2HG2      THR  25  11.082  -1.992   7.862
  197    H    ASN  26           H        ASN  26  10.959  -4.704   6.213
  198    HA   ASN  26           HA       ASN  26   9.733  -7.193   7.118
  199    HB2  ASN  26           1HB      ASN  26  11.252  -7.102   5.177
  200    HB3  ASN  26           2HB      ASN  26  12.582  -6.620   6.210
  201   HD21  ASN  26          2HD2      ASN  26  13.844  -8.554   5.993
  202   HD22  ASN  26          1HD2      ASN  26  13.308 -10.063   6.552
  203    H    ARG  27           H        ARG  27   9.623  -7.629   9.215
  204    HA   ARG  27           HA       ARG  27  11.711  -6.654  11.109
  205    HB2  ARG  27           1HB      ARG  27   8.832  -7.545  11.523
  206    HB3  ARG  27           2HB      ARG  27   9.919  -7.046  12.817
  207    HG2  ARG  27           1HG      ARG  27   9.718  -5.039  10.568
  208    HG3  ARG  27           2HG      ARG  27   8.198  -5.305  11.410
  209    HD2  ARG  27           1HD      ARG  27   9.531  -3.435  12.409
  210    HD3  ARG  27           2HD      ARG  27   9.220  -4.732  13.564
  211    HE   ARG  27           HE       ARG  27  11.707  -5.183  12.267
  212   HH11  ARG  27          1HH2      ARG  27  10.194  -3.077  14.576
  213   HH12  ARG  27          2HH2      ARG  27  11.657  -2.766  15.448
  214   HH21  ARG  27          1HH1      ARG  27  13.615  -4.777  13.416
  215   HH22  ARG  27          2HH1      ARG  27  13.589  -3.726  14.793
  216    H    GLY  28           H        GLY  28  13.225  -8.223  11.191
  217    HA2  GLY  28           1HA      GLY  28  12.679 -10.672  12.541
  218    HA3  GLY  28           2HA      GLY  28  12.911 -10.962  10.814
  219    H    ALA  29           H        ALA  29  14.549 -11.616  13.264
  220    HA   ALA  29           HA       ALA  29  17.015 -10.092  13.002
  221    HB1  ALA  29           3HB      ALA  29  16.421 -12.682  14.483
  222    HB2  ALA  29           1HB      ALA  29  16.308 -11.060  15.166
  223    HB3  ALA  29           2HB      ALA  29  17.877 -11.696  14.666
  224    H    ALA  30           H        ALA  30  15.639 -12.074  10.892
  225    HA   ALA  30           HA       ALA  30  18.196 -12.971   9.739
  226    HB1  ALA  30           3HB      ALA  30  17.403 -15.295   9.469
  227    HB2  ALA  30           1HB      ALA  30  15.928 -14.905  10.360
  228    HB3  ALA  30           2HB      ALA  30  17.487 -14.863  11.179
  229    H    GLU  31           H        GLU  31  17.875 -13.866   7.553
  230    HA   GLU  31           HA       GLU  31  16.443 -12.101   5.905
  231    HB2  GLU  31           1HB      GLU  31  17.403 -14.922   5.292
  232    HB3  GLU  31           2HB      GLU  31  16.903 -13.741   4.076
  233    HG2  GLU  31           1HG      GLU  31  18.702 -12.200   4.826
  234    HG3  GLU  31           2HG      GLU  31  19.205 -13.375   6.042
  235    H    ALA  32           H        ALA  32  14.313 -11.904   5.584
  236    HA   ALA  32           HA       ALA  32  12.476 -14.138   6.247
  237    HB1  ALA  32           3HB      ALA  32  11.882 -11.229   5.597
  238    HB2  ALA  32           1HB      ALA  32  12.075 -11.879   7.223
  239    HB3  ALA  32           2HB      ALA  32  10.734 -12.418   6.210
  240    H    HIS  33           H        HIS  33  10.869 -14.788   4.795
  241    HA   HIS  33           HA       HIS  33  10.996 -13.868   2.006
  242    HB2  HIS  33           1HB      HIS  33  12.650 -15.820   2.368
  243    HB3  HIS  33           2HB      HIS  33  11.248 -16.847   2.642
  244    HD1  HIS  33           HD1      HIS  33   9.927 -17.584   0.588
  245    HD2  HIS  33           HD2      HIS  33  12.773 -14.658  -0.318
  246    HE1  HIS  33           HE1      HIS  33   9.965 -17.375  -1.936
  247    HE2  HIS  33           HE2      HIS  33  11.695 -15.604  -2.500
  248    H    ASN  34           H        ASN  34   9.322 -15.127   0.709
  249    HA   ASN  34           HA       ASN  34   7.034 -15.292   0.350
  250    HB2  ASN  34           1HB      ASN  34   7.270 -16.925   2.901
  251    HB3  ASN  34           2HB      ASN  34   5.922 -16.997   1.765
  252   HD21  ASN  34          2HD2      ASN  34   7.029 -17.174  -0.706
  253   HD22  ASN  34          1HD2      ASN  34   8.098 -18.487  -0.821
  254    H    VAL  35           H        VAL  35   7.321 -12.862   1.140
  255    HA   VAL  35           HA       VAL  35   5.499 -12.332   3.451
  256    HB   VAL  35           HB       VAL  35   7.498 -10.438   2.203
  257   HG11  VAL  35          1HG1      VAL  35   5.617  -9.298   3.338
  258   HG12  VAL  35          2HG1      VAL  35   7.090  -9.122   4.279
  259   HG13  VAL  35          3HG1      VAL  35   5.868 -10.290   4.774
  260   HG21  VAL  35          3HG2      VAL  35   8.682 -12.311   3.266
  261   HG22  VAL  35          1HG2      VAL  35   7.680 -12.169   4.712
  262   HG23  VAL  35          2HG2      VAL  35   8.823 -10.892   4.301
  263    HA   PRO  36           HA       PRO  36   3.184 -10.952  -0.322
  264    HB2  PRO  36           1HB      PRO  36   0.698 -11.884   0.272
  265    HB3  PRO  36           2HB      PRO  36   1.974 -12.969  -0.333
  266    HG2  PRO  36           1HG      PRO  36   1.070 -12.540   2.502
  267    HG3  PRO  36           2HG      PRO  36   1.394 -14.067   1.663
  268    HD2  PRO  36           1HD      PRO  36   3.244 -12.861   3.337
  269    HD3  PRO  36           2HD      PRO  36   3.732 -13.879   1.962
  270    H    VAL  37           H        VAL  37   1.176  -9.556  -0.460
  271    HA   VAL  37           HA       VAL  37   0.604  -7.938   1.933
  272    HB   VAL  37           HB       VAL  37   2.666  -6.940   0.971
  273   HG11  VAL  37          1HG1      VAL  37   2.310  -7.591  -1.405
  274   HG12  VAL  37          2HG1      VAL  37   2.640  -5.874  -1.230
  275   HG13  VAL  37          3HG1      VAL  37   1.003  -6.413  -1.530
  276   HG21  VAL  37          3HG2      VAL  37   0.208  -5.180   0.544
  277   HG22  VAL  37          1HG2      VAL  37   1.850  -4.617   0.852
  278   HG23  VAL  37          2HG2      VAL  37   0.972  -5.492   2.101
  279    H    ALA  38           H        ALA  38  -1.313  -6.892   1.831
  280    HA   ALA  38           HA       ALA  38  -2.934  -7.086  -0.668
  281    HB1  ALA  38           3HB      ALA  38  -4.869  -7.710   0.724
  282    HB2  ALA  38           1HB      ALA  38  -3.853  -7.693   2.177
  283    HB3  ALA  38           2HB      ALA  38  -3.570  -8.894   0.910
  284    H    VAL  39           H        VAL  39  -3.912  -5.247  -1.181
  285    HA   VAL  39           HA       VAL  39  -4.053  -3.027   0.813
  286    HB   VAL  39           HB       VAL  39  -3.802  -2.772  -2.226
  287   HG11  VAL  39          1HG1      VAL  39  -3.251  -0.420  -1.673
  288   HG12  VAL  39          2HG1      VAL  39  -3.480  -0.747   0.032
  289   HG13  VAL  39          3HG1      VAL  39  -4.850  -0.832  -1.070
  290   HG21  VAL  39          3HG2      VAL  39  -1.433  -2.123  -1.765
  291   HG22  VAL  39          1HG2      VAL  39  -1.745  -3.794  -1.312
  292   HG23  VAL  39          2HG2      VAL  39  -1.650  -2.549  -0.065
  293    H    TYR  40           H        TYR  40  -5.897  -1.839   0.895
  294    HA   TYR  40           HA       TYR  40  -8.137  -2.365  -0.912
  295    HB2  TYR  40           1HB      TYR  40  -9.663  -3.058   0.968
  296    HB3  TYR  40           2HB      TYR  40  -8.403  -4.242   0.626
  297    HD1  TYR  40           HD2      TYR  40  -9.538  -1.642   3.036
  298    HD2  TYR  40           HD1      TYR  40  -6.521  -4.615   2.202
  299    HE1  TYR  40           HE2      TYR  40  -8.683  -1.446   5.345
  300    HE2  TYR  40           HE1      TYR  40  -5.690  -4.406   4.521
  301    HH   TYR  40           HH       TYR  40  -7.008  -3.527   6.879
  302    H    LEU  41           H        LEU  41  -9.573  -0.707  -0.956
  303    HA   LEU  41           HA       LEU  41  -8.845   1.714   0.605
  304    HB2  LEU  41           1HB      LEU  41  -9.211   1.515  -2.050
  305    HB3  LEU  41           2HB      LEU  41 -10.901   1.760  -1.641
  306    HG   LEU  41           HG       LEU  41  -8.576   3.618  -0.916
  307   HD11  LEU  41          1HD1      LEU  41  -9.211   3.708  -3.299
  308   HD12  LEU  41          2HD1      LEU  41  -9.641   5.200  -2.467
  309   HD13  LEU  41          3HD1      LEU  41 -10.892   4.016  -2.848
  310   HD21  LEU  41          3HD2      LEU  41 -10.598   5.174  -0.251
  311   HD22  LEU  41          1HD2      LEU  41 -10.042   3.955   0.873
  312   HD23  LEU  41          2HD2      LEU  41 -11.496   3.672  -0.082
  313    H    GLY  42           H        GLY  42 -10.081   2.490   2.178
  314    HA2  GLY  42           1HA      GLY  42 -12.331   3.054   2.997
  315    HA3  GLY  42           2HA      GLY  42 -12.844   1.410   2.620
  316    H    ASN  43           H        ASN  43 -13.454   1.026   4.746
  317    HA   ASN  43           HA       ASN  43 -11.225   0.692   6.690
  318    HB2  ASN  43           1HB      ASN  43 -14.045   1.559   7.274
  319    HB3  ASN  43           2HB      ASN  43 -12.807   1.263   8.494
  320   HD21  ASN  43          2HD2      ASN  43 -13.886   3.531   6.010
  321   HD22  ASN  43          1HD2      ASN  43 -12.747   4.738   6.367
  322    HA   PRO  44           HA       PRO  44 -12.392  -3.655   6.756
  323    HB2  PRO  44           1HB      PRO  44 -11.846  -3.454   9.741
  324    HB3  PRO  44           2HB      PRO  44 -11.279  -4.681   8.582
  325    HG2  PRO  44           1HG      PRO  44  -9.624  -2.777   9.419
  326    HG3  PRO  44           2HG      PRO  44  -9.624  -3.263   7.707
  327    HD2  PRO  44           1HD      PRO  44 -10.825  -0.761   8.945
  328    HD3  PRO  44           2HD      PRO  44  -9.999  -0.985   7.383
  329    H    ALA  45           H        ALA  45 -13.660  -1.491   9.270
  330    HA   ALA  45           HA       ALA  45 -15.797  -3.081  10.213
  331    HB1  ALA  45           3HB      ALA  45 -15.006  -1.028  11.350
  332    HB2  ALA  45           1HB      ALA  45 -16.743  -0.954  11.044
  333    HB3  ALA  45           2HB      ALA  45 -15.621  -0.051  10.018
  334    H    GLN  46           H        GLN  46 -15.703  -0.640   7.622
  335    HA   GLN  46           HA       GLN  46 -18.456  -0.852   6.885
  336    HB2  GLN  46           1HB      GLN  46 -16.032   0.041   5.269
  337    HB3  GLN  46           2HB      GLN  46 -17.710   0.307   4.788
  338    HG2  GLN  46           1HG      GLN  46 -16.483   1.366   7.377
  339    HG3  GLN  46           2HG      GLN  46 -16.659   2.312   5.907
  340   HE21  GLN  46          2HE2      GLN  46 -19.190   1.857   5.024
  341   HE22  GLN  46          1HE2      GLN  46 -20.341   2.214   6.220
  342    H    GLY  47           H        GLY  47 -15.738  -1.809   4.794
  343    HA2  GLY  47           1HA      GLY  47 -16.269  -4.523   4.520
  344    HA3  GLY  47           2HA      GLY  47 -17.299  -3.717   3.339
  345    H    GLY  48           H        GLY  48 -13.909  -3.699   4.476
  346    HA2  GLY  48           1HA      GLY  48 -12.803  -2.560   2.129
  347    HA3  GLY  48           2HA      GLY  48 -11.928  -3.482   3.343
  348    H    VAL  49           H        VAL  49 -11.651  -3.573   0.422
  349    HA   VAL  49           HA       VAL  49 -11.958  -6.510   0.044
  350    HB   VAL  49           HB       VAL  49 -13.904  -5.424  -1.042
  351   HG11  VAL  49          1HG1      VAL  49 -13.648  -3.871  -2.909
  352   HG12  VAL  49          2HG1      VAL  49 -11.895  -3.947  -2.801
  353   HG13  VAL  49          3HG1      VAL  49 -12.826  -3.205  -1.502
  354   HG21  VAL  49          3HG2      VAL  49 -12.856  -7.473  -2.058
  355   HG22  VAL  49          1HG2      VAL  49 -11.892  -6.437  -3.113
  356   HG23  VAL  49          2HG2      VAL  49 -13.645  -6.455  -3.257
  357    H    GLU  50           H        GLU  50 -10.282  -7.443  -0.943
  358    HA   GLU  50           HA       GLU  50  -7.840  -5.999  -1.244
  359    HB2  GLU  50           1HB      GLU  50  -7.961  -8.403  -0.613
  360    HB3  GLU  50           2HB      GLU  50  -8.531  -8.800  -2.232
  361    HG2  GLU  50           1HG      GLU  50  -6.423  -7.951  -3.210
  362    HG3  GLU  50           2HG      GLU  50  -5.855  -7.459  -1.614
  363    H    ILE  51           H        ILE  51  -6.902  -5.139  -3.014
  364    HA   ILE  51           HA       ILE  51  -8.453  -5.063  -5.564
  365    HB   ILE  51           HB       ILE  51  -6.167  -3.266  -4.634
  366   HG12  ILE  51          1HG1      ILE  51  -9.176  -2.678  -4.709
  367   HG13  ILE  51          2HG1      ILE  51  -8.305  -3.093  -3.244
  368   HG21  ILE  51          1HG2      ILE  51  -6.408  -3.369  -7.108
  369   HG22  ILE  51          2HG2      ILE  51  -6.938  -1.816  -6.514
  370   HG23  ILE  51          3HG2      ILE  51  -8.129  -3.026  -6.966
  371   HD11  ILE  51          3HD1      ILE  51  -7.751  -0.673  -4.981
  372   HD12  ILE  51          1HD1      ILE  51  -6.834  -1.119  -3.543
  373   HD13  ILE  51          2HD1      ILE  51  -8.532  -0.668  -3.405
  374    H    GLY  52           H        GLY  52  -5.262  -5.750  -4.204
  375    HA2  GLY  52           1HA      GLY  52  -4.618  -7.700  -6.159
  376    HA3  GLY  52           2HA      GLY  52  -3.823  -6.183  -6.567
  377    H    ARG  53           H        ARG  53  -2.367  -8.439  -5.969
  378    HA   ARG  53           HA       ARG  53  -0.857  -7.557  -3.607
  379    HB2  ARG  53           1HB      ARG  53  -0.806  -9.909  -2.702
  380    HB3  ARG  53           2HB      ARG  53  -2.405  -9.163  -2.615
  381    HG2  ARG  53           1HG      ARG  53  -3.084 -10.350  -4.688
  382    HG3  ARG  53           2HG      ARG  53  -1.492 -11.100  -4.785
  383    HD2  ARG  53           1HD      ARG  53  -3.447 -11.452  -2.482
  384    HD3  ARG  53           2HD      ARG  53  -3.177 -12.625  -3.767
  385    HE   ARG  53           HE       ARG  53  -1.503 -12.173  -1.467
  386   HH11  ARG  53          1HH2      ARG  53  -1.472 -13.121  -4.816
  387   HH12  ARG  53          2HH2      ARG  53  -0.013 -14.043  -4.674
  388   HH21  ARG  53          1HH1      ARG  53   0.391 -13.385  -1.296
  389   HH22  ARG  53          2HH1      ARG  53   1.042 -14.190  -2.683
  390    H    ASP  54           H        ASP  54   1.210  -8.620  -3.453
  391    HA   ASP  54           HA       ASP  54   2.232 -10.070  -5.791
  392    HB2  ASP  54           1HB      ASP  54   3.265  -7.292  -5.085
  393    HB3  ASP  54           2HB      ASP  54   3.991  -8.376  -6.266
  394    H    THR  55           H        THR  55   3.448 -11.620  -4.912
  395    HA   THR  55           HA       THR  55   4.568 -11.370  -2.247
  396    HB   THR  55           HB       THR  55   4.982 -13.615  -4.267
  397    HG1  THR  55           HG1      THR  55   3.201 -13.823  -2.157
  398   HG21  THR  55          3HG2      THR  55   6.572 -13.652  -2.352
  399   HG22  THR  55          1HG2      THR  55   5.405 -14.966  -2.227
  400   HG23  THR  55          2HG2      THR  55   5.220 -13.530  -1.227
  401    H    ILE  56           H        ILE  56   6.592 -10.858  -1.711
  402    HA   ILE  56           HA       ILE  56   8.562 -10.267  -3.879
  403    HB   ILE  56           HB       ILE  56   8.486  -9.192  -1.019
  404   HG12  ILE  56          1HG1      ILE  56   7.642  -7.793  -3.617
  405   HG13  ILE  56          2HG1      ILE  56   6.514  -8.420  -2.419
  406   HG21  ILE  56          1HG2      ILE  56  10.162  -7.563  -1.906
  407   HG22  ILE  56          2HG2      ILE  56  10.098  -8.345  -3.479
  408   HG23  ILE  56          3HG2      ILE  56  10.751  -9.202  -2.094
  409   HD11  ILE  56          3HD1      ILE  56   8.559  -6.225  -1.944
  410   HD12  ILE  56          1HD1      ILE  56   7.515  -6.916  -0.701
  411   HD13  ILE  56          2HD1      ILE  56   6.814  -6.033  -2.053
  412    H    SER  57           H        SER  57  10.618 -11.049  -3.720
  413    HA   SER  57           HA       SER  57  11.100 -13.219  -1.713
  414    HB2  SER  57           1HB      SER  57  11.089 -14.001  -4.040
  415    HB3  SER  57           2HB      SER  57  12.292 -12.790  -4.465
  416    HG   SER  57           HG       SER  57  13.452 -13.892  -2.553
  417    H    ARG  58           H        ARG  58  12.887 -10.814  -3.631
  418    HA   ARG  58           HA       ARG  58  15.200 -10.894  -1.984
  419    HB2  ARG  58           1HB      ARG  58  14.986 -10.034  -4.403
  420    HB3  ARG  58           2HB      ARG  58  14.317  -8.556  -3.743
  421    HG2  ARG  58           1HG      ARG  58  16.582  -7.907  -3.816
  422    HG3  ARG  58           2HG      ARG  58  16.583  -8.621  -2.216
  423    HD2  ARG  58           1HD      ARG  58  17.280 -10.838  -3.315
  424    HD3  ARG  58           2HD      ARG  58  17.516  -9.920  -4.799
  425    HE   ARG  58           HE       ARG  58  19.460  -9.020  -3.890
  426   HH11  ARG  58          1HH2      ARG  58  17.511 -10.419  -1.369
  427   HH12  ARG  58          2HH2      ARG  58  18.729 -10.245  -0.150
  428   HH21  ARG  58          1HH1      ARG  58  21.047  -8.803  -2.286
  429   HH22  ARG  58          2HH1      ARG  58  20.725  -9.333  -0.669
  430    H    ILE  59           H        ILE  59  14.239 -10.775   0.127
  431    HA   ILE  59           HA       ILE  59  13.653  -7.977   1.006
  432    HB   ILE  59           HB       ILE  59  12.521 -10.462   2.292
  433   HG12  ILE  59          1HG1      ILE  59  11.249  -8.503   0.312
  434   HG13  ILE  59          2HG1      ILE  59  11.638 -10.180  -0.019
  435   HG21  ILE  59          1HG2      ILE  59  11.845  -7.494   2.595
  436   HG22  ILE  59          2HG2      ILE  59  12.754  -8.450   3.761
  437   HG23  ILE  59          3HG2      ILE  59  11.073  -8.827   3.455
  438   HD11  ILE  59          3HD1      ILE  59   9.566 -10.649   0.610
  439   HD12  ILE  59          1HD1      ILE  59   9.330  -9.061   1.301
  440   HD13  ILE  59          2HD1      ILE  59  10.044 -10.351   2.262
  441    HA   PRO  60           HA       PRO  60  17.362  -9.502   3.358
  442    HB2  PRO  60           1HB      PRO  60  18.888  -7.241   3.282
  443    HB3  PRO  60           2HB      PRO  60  18.767  -8.321   1.875
  444    HG2  PRO  60           1HG      PRO  60  17.271  -5.754   2.411
  445    HG3  PRO  60           2HG      PRO  60  18.097  -6.272   0.921
  446    HD2  PRO  60           1HD      PRO  60  15.378  -6.545   1.265
  447    HD3  PRO  60           2HD      PRO  60  16.306  -7.693   0.269
  448    H    VAL  61           H        VAL  61  18.236  -8.816   5.448
  449    HA   VAL  61           HA       VAL  61  16.175  -7.976   7.242
  450    HB   VAL  61           HB       VAL  61  17.974  -8.196   8.958
  451   HG11  VAL  61          1HG1      VAL  61  16.727 -10.195   8.174
  452   HG12  VAL  61          2HG1      VAL  61  18.383 -10.609   8.616
  453   HG13  VAL  61          3HG1      VAL  61  17.940 -10.446   6.916
  454   HG21  VAL  61          3HG2      VAL  61  20.240  -8.961   8.242
  455   HG22  VAL  61          1HG2      VAL  61  19.901  -7.338   7.659
  456   HG23  VAL  61          2HG2      VAL  61  19.785  -8.709   6.560
  457    H    GLY  62           H        GLY  62  15.927  -6.061   8.360
  458    HA2  GLY  62           1HA      GLY  62  16.128  -3.838   8.873
  459    HA3  GLY  62           2HA      GLY  62  17.807  -3.907   8.343
  460    H    GLY  63           H        GLY  63  15.565  -5.068   6.047
  461    HA2  GLY  63           1HA      GLY  63  15.764  -2.582   4.414
  462    HA3  GLY  63           2HA      GLY  63  15.657  -4.226   3.798
  463    H    THR  64           H        THR  64  13.896  -3.110   2.570
  464    HA   THR  64           HA       THR  64  11.303  -3.641   3.888
  465    HB   THR  64           HB       THR  64  10.344  -1.518   3.201
  466    HG1  THR  64           HG1      THR  64  11.258  -0.734   1.488
  467   HG21  THR  64          3HG2      THR  64  13.031  -0.830   4.459
  468   HG22  THR  64          1HG2      THR  64  11.716  -1.555   5.378
  469   HG23  THR  64          2HG2      THR  64  11.513   0.034   4.654
  470    H    GLY  65           H        GLY  65   9.651  -4.116   2.453
  471    HA2  GLY  65           1HA      GLY  65  10.522  -4.967  -0.252
  472    HA3  GLY  65           2HA      GLY  65   9.087  -5.493   0.606
  473    H    LEU  66           H        LEU  66   9.331  -4.398  -2.089
  474    HA   LEU  66           HA       LEU  66   7.358  -2.183  -1.794
  475    HB2  LEU  66           1HB      LEU  66   9.941  -1.652  -2.568
  476    HB3  LEU  66           2HB      LEU  66   9.263  -1.992  -4.151
  477    HG   LEU  66           HG       LEU  66   8.210   0.066  -2.156
  478   HD11  LEU  66          1HD1      LEU  66   9.619   0.442  -4.806
  479   HD12  LEU  66          2HD1      LEU  66  10.314   0.736  -3.208
  480   HD13  LEU  66          3HD1      LEU  66   8.974   1.725  -3.781
  481   HD21  LEU  66          3HD2      LEU  66   7.200  -0.730  -4.915
  482   HD22  LEU  66          1HD2      LEU  66   6.750   0.768  -4.109
  483   HD23  LEU  66          2HD2      LEU  66   6.312  -0.765  -3.391
  484    H    ALA  67           H        ALA  67   5.537  -2.797  -2.624
  485    HA   ALA  67           HA       ALA  67   5.435  -4.730  -4.890
  486    HB1  ALA  67           3HB      ALA  67   3.058  -5.040  -4.092
  487    HB2  ALA  67           1HB      ALA  67   3.438  -3.970  -2.738
  488    HB3  ALA  67           2HB      ALA  67   4.289  -5.503  -2.914
  489    H    ARG  68           H        ARG  68   3.932  -4.359  -6.542
  490    HA   ARG  68           HA       ARG  68   3.115  -1.499  -6.940
  491    HB2  ARG  68           1HB      ARG  68   5.103  -2.126  -8.325
  492    HB3  ARG  68           2HB      ARG  68   4.143  -3.382  -9.103
  493    HG2  ARG  68           1HG      ARG  68   2.542  -1.651  -9.916
  494    HG3  ARG  68           2HG      ARG  68   3.494  -0.396  -9.121
  495    HD2  ARG  68           1HD      ARG  68   4.053  -0.487 -11.506
  496    HD3  ARG  68           2HD      ARG  68   5.445  -1.019 -10.557
  497    HE   ARG  68           HE       ARG  68   3.852  -3.265 -11.237
  498   HH11  ARG  68          1HH2      ARG  68   5.955  -0.907 -12.691
  499   HH12  ARG  68          2HH2      ARG  68   6.463  -1.961 -13.968
  500   HH21  ARG  68          1HH1      ARG  68   4.522  -4.629 -12.904
  501   HH22  ARG  68          2HH1      ARG  68   5.653  -4.062 -14.088
  502    H    VAL  69           H        VAL  69   1.038  -1.266  -7.187
  503    HA   VAL  69           HA       VAL  69  -0.601  -3.360  -8.516
  504    HB   VAL  69           HB       VAL  69  -1.400  -1.992  -5.897
  505   HG11  VAL  69          1HG1      VAL  69  -2.703  -4.219  -7.530
  506   HG12  VAL  69          2HG1      VAL  69  -3.325  -2.582  -7.337
  507   HG13  VAL  69          3HG1      VAL  69  -3.260  -3.663  -5.953
  508   HG21  VAL  69          3HG2      VAL  69   0.404  -3.596  -5.443
  509   HG22  VAL  69          1HG2      VAL  69  -0.394  -4.835  -6.414
  510   HG23  VAL  69          2HG2      VAL  69  -1.118  -4.287  -4.899
  511    H    GLN  70           H        GLN  70  -2.187  -2.588  -9.763
  512    HA   GLN  70           HA       GLN  70  -2.387   0.374 -10.113
  513    HB2  GLN  70           1HB      GLN  70  -3.029  -1.913 -12.011
  514    HB3  GLN  70           2HB      GLN  70  -3.247  -0.197 -12.380
  515    HG2  GLN  70           1HG      GLN  70  -0.807   0.180 -12.026
  516    HG3  GLN  70           2HG      GLN  70  -0.594  -1.539 -11.688
  517   HE21  GLN  70          2HE2      GLN  70   0.958  -1.070 -13.678
  518   HE22  GLN  70          1HE2      GLN  70   0.283  -1.350 -15.210
  519    H    TRP  71           H        TRP  71  -4.309   1.380  -9.968
  520    HA   TRP  71           HA       TRP  71  -6.803  -0.182  -9.651
  521    HB2  TRP  71           1HB      TRP  71  -5.927   0.226  -7.350
  522    HB3  TRP  71           2HB      TRP  71  -5.886   1.950  -7.668
  523    HD1  TRP  71           HD1      TRP  71  -8.585  -0.831  -8.092
  524    HE1  TRP  71           HE1      TRP  71 -10.836   0.114  -7.282
  525    HE3  TRP  71           HE3      TRP  71  -7.117   3.843  -6.645
  526    HZ2  TRP  71           HZ2      TRP  71 -11.886   2.533  -6.175
  527    HZ3  TRP  71           HZ3      TRP  71  -8.761   5.449  -5.714
  528    HH2  TRP  71           HH2      TRP  71 -11.143   4.802  -5.472
  529    H    LYS  72           H        LYS  72  -8.472   0.721 -10.615
  530    HA   LYS  72           HA       LYS  72  -8.148   3.380 -11.893
  531    HB2  LYS  72           1HB      LYS  72  -8.610   1.390 -13.324
  532    HB3  LYS  72           2HB      LYS  72 -10.172   1.204 -12.545
  533    HG2  LYS  72           1HG      LYS  72 -10.804   3.508 -13.273
  534    HG3  LYS  72           2HG      LYS  72  -9.245   3.677 -14.080
  535    HD2  LYS  72           1HD      LYS  72 -11.371   1.591 -14.759
  536    HD3  LYS  72           2HD      LYS  72 -11.063   3.071 -15.664
  537    HE2  LYS  72           1HE      LYS  72  -9.805   1.520 -16.929
  538    HE3  LYS  72           2HE      LYS  72  -8.556   2.054 -15.813
  539    HZ1  LYS  72           3HZ      LYS  72  -9.512  -0.507 -16.167
  540    HZ2  LYS  72           1HZ      LYS  72 -10.101  -0.014 -14.656
  541    HZ3  LYS  72           2HZ      LYS  72  -8.432   0.030 -14.969
  542    H    ALA  73           H        ALA  73  -9.284   5.056 -11.176
  543    HA   ALA  73           HA       ALA  73 -11.037   4.843  -8.916
  544    HB1  ALA  73           3HB      ALA  73 -11.400   7.274  -9.280
  545    HB2  ALA  73           1HB      ALA  73 -10.567   7.159 -10.834
  546    HB3  ALA  73           2HB      ALA  73  -9.685   6.859  -9.342
  547    H    THR  74           H        THR  74 -13.247   4.906  -8.828
  548    HA   THR  74           HA       THR  74 -14.773   4.704 -11.403
  549    HB   THR  74           HB       THR  74 -16.299   3.183 -10.267
  550    HG1  THR  74           HG1      THR  74 -15.886   2.557  -8.149
  551   HG21  THR  74          3HG2      THR  74 -14.239   2.227 -11.318
  552   HG22  THR  74          1HG2      THR  74 -14.792   1.266  -9.943
  553   HG23  THR  74          2HG2      THR  74 -13.418   2.354  -9.760
  554    H    ARG  75           H        ARG  75 -16.536   5.944 -11.636
  555    HA   ARG  75           HA       ARG  75 -17.952   7.172  -9.458
  556    HB2  ARG  75           1HB      ARG  75 -15.726   8.548  -9.677
  557    HB3  ARG  75           2HB      ARG  75 -16.376   9.151 -11.198
  558    HG2  ARG  75           1HG      ARG  75 -18.405   9.978  -9.936
  559    HG3  ARG  75           2HG      ARG  75 -17.670   9.423  -8.442
  560    HD2  ARG  75           1HD      ARG  75 -15.736  10.942  -8.842
  561    HD3  ARG  75           2HD      ARG  75 -16.520  11.516 -10.315
  562    HE   ARG  75           HE       ARG  75 -17.950  12.802  -9.019
  563   HH11  ARG  75          1HH2      ARG  75 -16.448  10.356  -7.055
  564   HH12  ARG  75          2HH2      ARG  75 -17.098  10.959  -5.567
  565   HH21  ARG  75          1HH1      ARG  75 -18.804  13.581  -7.063
  566   HH22  ARG  75          2HH1      ARG  75 -18.430  12.780  -5.574
  567    H    LYS  76           H        LYS  76 -18.750   5.581 -11.599
  568    HA   LYS  76           HA       LYS  76 -19.791   7.200 -13.766
  569    HB2  LYS  76           1HB      LYS  76 -20.009   4.294 -12.915
  570    HB3  LYS  76           2HB      LYS  76 -21.196   4.908 -14.056
  571    HG2  LYS  76           1HG      LYS  76 -19.329   3.892 -15.268
  572    HG3  LYS  76           2HG      LYS  76 -19.374   5.626 -15.591
  573    HD2  LYS  76           1HD      LYS  76 -17.560   6.006 -13.956
  574    HD3  LYS  76           2HD      LYS  76 -17.555   4.292 -13.535
  575    HE2  LYS  76           1HE      LYS  76 -15.730   4.827 -15.123
  576    HE3  LYS  76           2HE      LYS  76 -16.898   3.733 -15.867
  577    HZ1  LYS  76           3HZ      LYS  76 -17.251   6.633 -16.150
  578    HZ2  LYS  76           1HZ      LYS  76 -17.750   5.385 -17.181
  579    HZ3  LYS  76           2HZ      LYS  76 -16.112   5.841 -17.130
  580    H    LEU  77           H        LEU  77 -21.767   8.053 -13.997
  581    HA   LEU  77           HA       LEU  77 -23.669   9.112 -13.296
  582    HB2  LEU  77           1HB      LEU  77 -24.066   6.196 -12.580
  583    HB3  LEU  77           2HB      LEU  77 -25.331   7.338 -12.170
  584    HG   LEU  77           HG       LEU  77 -25.717   6.223 -14.381
  585   HD11  LEU  77          1HD1      LEU  77 -25.274   9.113 -15.156
  586   HD12  LEU  77          2HD1      LEU  77 -26.371   8.785 -13.820
  587   HD13  LEU  77          3HD1      LEU  77 -26.667   8.067 -15.389
  588   HD21  LEU  77          3HD2      LEU  77 -23.245   6.073 -14.985
  589   HD22  LEU  77          1HD2      LEU  77 -23.299   7.787 -15.399
  590   HD23  LEU  77          2HD2      LEU  77 -24.282   6.633 -16.286
  591    H    ALA  78           H        ALA  78 -22.491  10.468 -11.813
  592    HA   ALA  78           HA       ALA  78 -22.225   9.805  -9.032
  593    HB1  ALA  78           3HB      ALA  78 -21.620  12.196  -8.784
  594    HB2  ALA  78           1HB      ALA  78 -22.177  12.513 -10.431
  595    HB3  ALA  78           2HB      ALA  78 -20.781  11.476 -10.156
  596    H    GLY  79           H        GLY  79 -23.479  10.477  -7.298
  597    HA2  GLY  79           1HA      GLY  79 -26.317  10.789  -7.768
  598    HA3  GLY  79           2HA      GLY  79 -25.497  10.742  -6.212
  599    H    ARG  80           H        ARG  80 -24.498  12.976  -8.712
  600    HA   ARG  80           HA       ARG  80 -24.334  15.265  -8.726
  601    HB2  ARG  80           1HB      ARG  80 -27.129  15.037  -7.535
  602    HB3  ARG  80           2HB      ARG  80 -26.452  16.486  -8.288
  603    HG2  ARG  80           1HG      ARG  80 -26.198  15.252 -10.434
  604    HG3  ARG  80           2HG      ARG  80 -26.889  13.808  -9.686
  605    HD2  ARG  80           1HD      ARG  80 -28.319  16.481  -9.964
  606    HD3  ARG  80           2HD      ARG  80 -28.591  15.076 -10.992
  607    HE   ARG  80           HE       ARG  80 -29.610  15.483  -8.322
  608   HH11  ARG  80          1HH2      ARG  80 -28.591  13.069 -10.613
  609   HH12  ARG  80          2HH2      ARG  80 -29.523  11.803  -9.888
  610   HH21  ARG  80          1HH1      ARG  80 -30.820  13.821  -7.385
  611   HH22  ARG  80          2HH1      ARG  80 -30.783  12.229  -8.065
  612    H    ALA  81           H        ALA  81 -23.760  13.652  -6.168
  613    HA   ALA  81           HA       ALA  81 -24.128  15.583  -4.005
  614    HB1  ALA  81           3HB      ALA  81 -24.245  13.141  -3.597
  615    HB2  ALA  81           1HB      ALA  81 -22.948  13.884  -2.660
  616    HB3  ALA  81           2HB      ALA  81 -22.572  12.965  -4.122
  617    H    ALA  82           H        ALA  82 -21.834  15.495  -2.632
  618    HA   ALA  82           HA       ALA  82 -19.477  16.034  -4.204
  619    HB1  ALA  82           3HB      ALA  82 -20.909  18.408  -2.938
  620    HB2  ALA  82           1HB      ALA  82 -20.759  18.102  -4.667
  621    HB3  ALA  82           2HB      ALA  82 -19.319  18.450  -3.709
  622    H    ASN  83           H        ASN  83 -18.717  14.487  -2.717
  623    HA   ASN  83           HA       ASN  83 -17.712  15.637  -0.206
  624    HB2  ASN  83           1HB      ASN  83 -19.402  13.119  -0.287
  625    HB3  ASN  83           2HB      ASN  83 -18.524  13.715   1.121
  626   HD21  ASN  83          2HD2      ASN  83 -19.082  16.305   1.402
  627   HD22  ASN  83          1HD2      ASN  83 -20.750  16.625   1.406
  628    HA   PRO  84           HA       PRO  84 -14.708  13.019  -2.710
  629    HB2  PRO  84           1HB      PRO  84 -12.944  15.098  -1.349
  630    HB3  PRO  84           2HB      PRO  84 -12.800  14.423  -2.992
  631    HG2  PRO  84           1HG      PRO  84 -13.817  16.844  -2.695
  632    HG3  PRO  84           2HG      PRO  84 -14.637  15.701  -3.790
  633    HD2  PRO  84           1HD      PRO  84 -15.424  16.450  -0.946
  634    HD3  PRO  84           2HD      PRO  84 -16.467  16.261  -2.382
  635    H    GLY  85           H        GLY  85 -12.135  13.085  -1.221
  636    HA2  GLY  85           1HA      GLY  85 -11.159  12.282   0.763
  637    HA3  GLY  85           2HA      GLY  85 -12.744  11.918   1.429
  638    H    VAL  86           H        VAL  86 -10.265  10.886  -0.842
  639    HA   VAL  86           HA       VAL  86 -11.294   8.069  -0.780
  640    HB   VAL  86           HB       VAL  86 -10.069   7.863  -3.008
  641   HG11  VAL  86          1HG1      VAL  86 -11.935   8.870  -4.309
  642   HG12  VAL  86          2HG1      VAL  86 -12.444   9.766  -2.876
  643   HG13  VAL  86          3HG1      VAL  86 -12.531   8.004  -2.893
  644   HG21  VAL  86          3HG2      VAL  86 -10.178  10.922  -2.919
  645   HG22  VAL  86          1HG2      VAL  86  -9.638   9.935  -4.274
  646   HG23  VAL  86          2HG2      VAL  86  -8.708   9.971  -2.788
  647    HA   PRO  87           HA       PRO  87  -7.028   8.454   1.214
  648    HB2  PRO  87           1HB      PRO  87  -7.621   7.095   3.548
  649    HB3  PRO  87           2HB      PRO  87  -7.940   8.840   3.362
  650    HG2  PRO  87           1HG      PRO  87  -9.855   6.544   2.870
  651    HG3  PRO  87           2HG      PRO  87 -10.084   7.964   3.936
  652    HD2  PRO  87           1HD      PRO  87 -11.132   8.021   1.504
  653    HD3  PRO  87           2HD      PRO  87 -10.258   9.463   2.059
  654    H    VAL  88           H        VAL  88  -5.838   6.449   2.205
  655    HA   VAL  88           HA       VAL  88  -6.639   3.900   0.888
  656    HB   VAL  88           HB       VAL  88  -4.292   3.623   0.051
  657   HG11  VAL  88          1HG1      VAL  88  -4.506   5.131  -1.883
  658   HG12  VAL  88          2HG1      VAL  88  -5.667   6.131  -1.018
  659   HG13  VAL  88          3HG1      VAL  88  -6.086   4.477  -1.461
  660   HG21  VAL  88          3HG2      VAL  88  -4.007   6.556   0.862
  661   HG22  VAL  88          1HG2      VAL  88  -2.829   5.631  -0.061
  662   HG23  VAL  88          2HG2      VAL  88  -3.168   5.200   1.606
  663    H    TYR  89           H        TYR  89  -5.582   2.061   1.724
  664    HA   TYR  89           HA       TYR  89  -4.091   2.315   4.268
  665    HB2  TYR  89           1HB      TYR  89  -6.705   0.750   4.017
  666    HB3  TYR  89           2HB      TYR  89  -5.652   0.784   5.433
  667    HD1  TYR  89           HD2      TYR  89  -5.294   2.945   6.707
  668    HD2  TYR  89           HD1      TYR  89  -8.231   2.638   3.559
  669    HE1  TYR  89           HE2      TYR  89  -6.378   5.030   7.497
  670    HE2  TYR  89           HE1      TYR  89  -9.293   4.717   4.370
  671    HH   TYR  89           HH       TYR  89  -9.430   5.993   6.562
  672    H    ALA  90           H        ALA  90  -2.833   0.579   4.714
  673    HA   ALA  90           HA       ALA  90  -2.920  -1.813   2.953
  674    HB1  ALA  90           3HB      ALA  90  -0.495  -1.630   2.531
  675    HB2  ALA  90           1HB      ALA  90  -0.446  -0.099   3.416
  676    HB3  ALA  90           2HB      ALA  90  -1.345  -0.215   1.906
  677    H    VAL  91           H        VAL  91  -2.239  -3.651   3.914
  678    HA   VAL  91           HA       VAL  91  -1.139  -3.526   6.684
  679    HB   VAL  91           HB       VAL  91  -3.378  -5.389   5.740
  680   HG11  VAL  91          1HG1      VAL  91  -1.943  -6.404   7.494
  681   HG12  VAL  91          2HG1      VAL  91  -3.504  -5.972   8.174
  682   HG13  VAL  91          3HG1      VAL  91  -2.098  -4.954   8.487
  683   HG21  VAL  91          3HG2      VAL  91  -4.190  -3.061   5.977
  684   HG22  VAL  91          1HG2      VAL  91  -3.450  -2.937   7.576
  685   HG23  VAL  91          2HG2      VAL  91  -4.796  -4.044   7.303
  686    H    VAL  92           H        VAL  92   0.442  -4.912   7.089
  687    HA   VAL  92           HA       VAL  92   1.457  -6.605   4.898
  688    HB   VAL  92           HB       VAL  92   2.979  -5.045   6.090
  689   HG11  VAL  92          1HG1      VAL  92   2.624  -6.824   8.549
  690   HG12  VAL  92          2HG1      VAL  92   1.889  -5.232   8.363
  691   HG13  VAL  92          3HG1      VAL  92   3.642  -5.392   8.406
  692   HG21  VAL  92          3HG2      VAL  92   3.875  -7.126   5.047
  693   HG22  VAL  92          1HG2      VAL  92   3.671  -7.981   6.577
  694   HG23  VAL  92          2HG2      VAL  92   4.818  -6.652   6.455
  695    H    ASP  93           H        ASP  93   1.506  -8.800   4.970
  696    HA   ASP  93           HA       ASP  93  -0.311 -10.247   6.374
  697    HB2  ASP  93           1HB      ASP  93   0.835 -11.127   4.439
  698    HB3  ASP  93           2HB      ASP  93   2.353 -11.179   5.315
  699    HA   PRO  94           HA       PRO  94   1.587 -10.306  10.497
  700    HB2  PRO  94           1HB      PRO  94  -0.022 -12.057  11.818
  701    HB3  PRO  94           2HB      PRO  94  -0.650 -10.498  11.229
  702    HG2  PRO  94           1HG      PRO  94  -0.828 -13.185   9.867
  703    HG3  PRO  94           2HG      PRO  94  -2.152 -12.051  10.255
  704    HD2  PRO  94           1HD      PRO  94  -1.012 -12.050   7.781
  705    HD3  PRO  94           2HD      PRO  94  -1.499 -10.504   8.540
  706    H    ASP  95           H        ASP  95   3.088 -11.523  11.655
  707    HA   ASP  95           HA       ASP  95   4.410 -13.664  10.242
  708    HB2  ASP  95           1HB      ASP  95   5.918 -13.672  12.237
  709    HB3  ASP  95           2HB      ASP  95   5.696 -12.058  11.569
  710    H    ASN  96           H        ASN  96   2.414 -13.459  13.176
  711    HA   ASN  96           HA       ASN  96   1.411 -16.118  12.862
  712    HB2  ASN  96           1HB      ASN  96   3.722 -16.632  13.729
  713    HB3  ASN  96           2HB      ASN  96   3.353 -15.711  15.179
  714   HD21  ASN  96          2HD2      ASN  96   1.910 -18.399  13.236
  715   HD22  ASN  96          1HD2      ASN  96   1.395 -19.288  14.588
  716    H    ARG  97           H        ARG  97   0.117 -13.752  13.074
  717    HA   ARG  97           HA       ARG  97  -1.497 -12.605  14.240
  718    HB2  ARG  97           1HB      ARG  97  -1.798 -15.318  15.574
  719    HB3  ARG  97           2HB      ARG  97  -3.013 -14.034  15.590
  720    HG2  ARG  97           1HG      ARG  97  -3.170 -14.144  13.113
  721    HG3  ARG  97           2HG      ARG  97  -1.952 -15.423  13.086
  722    HD2  ARG  97           1HD      ARG  97  -4.647 -15.610  14.496
  723    HD3  ARG  97           2HD      ARG  97  -4.256 -16.350  12.942
  724    HE   ARG  97           HE       ARG  97  -2.325 -17.196  14.801
  725   HH11  ARG  97          1HH2      ARG  97  -5.734 -17.524  14.193
  726   HH12  ARG  97          2HH2      ARG  97  -5.845 -19.085  14.933
  727   HH21  ARG  97          1HH1      ARG  97  -2.485 -19.230  15.768
  728   HH22  ARG  97          2HH1      ARG  97  -4.011 -20.048  15.822
  729    H    VAL  98           H        VAL  98   0.410 -11.436  15.218
  730    HA   VAL  98           HA       VAL  98   1.317 -12.027  17.856
  731    HB   VAL  98           HB       VAL  98   1.274  -9.336  16.400
  732   HG11  VAL  98          1HG1      VAL  98   3.246  -8.850  17.903
  733   HG12  VAL  98          2HG1      VAL  98   2.927 -10.351  18.765
  734   HG13  VAL  98          3HG1      VAL  98   1.743  -9.043  18.800
  735   HG21  VAL  98          3HG2      VAL  98   2.410 -11.097  15.073
  736   HG22  VAL  98          1HG2      VAL  98   3.404 -11.524  16.469
  737   HG23  VAL  98          2HG2      VAL  98   3.583  -9.945  15.703
  738    H    ALA  99           H        ALA  99  -0.464  -9.054  17.061
  739    HA   ALA  99           HA       ALA  99  -2.706  -9.562  18.780
  740    HB1  ALA  99           3HB      ALA  99  -2.141  -7.961  20.586
  741    HB2  ALA  99           1HB      ALA  99  -0.543  -7.726  19.877
  742    HB3  ALA  99           2HB      ALA  99  -0.987  -9.289  20.543
  743    H    GLU 100           H        GLU 100  -4.099  -7.682  18.991
  744    HA   GLU 100           HA       GLU 100  -4.335  -6.232  16.555
  745    HB2  GLU 100           1HB      GLU 100  -5.598  -5.690  19.270
  746    HB3  GLU 100           2HB      GLU 100  -6.119  -4.953  17.750
  747    HG2  GLU 100           1HG      GLU 100  -6.632  -7.206  16.831
  748    HG3  GLU 100           2HG      GLU 100  -6.112  -7.945  18.346
  749    H    SER 101           H        SER 101  -3.793  -4.854  19.804
  750    HA   SER 101           HA       SER 101  -3.064  -2.287  19.116
  751    HB2  SER 101           1HB      SER 101  -1.838  -2.189  21.244
  752    HB3  SER 101           2HB      SER 101  -3.318  -3.124  21.451
  753    HG   SER 101           HG       SER 101  -0.672  -3.902  21.554
  754    H    ASP 102           H        ASP 102  -0.972  -5.162  19.140
  755    HA   ASP 102           HA       ASP 102   1.492  -3.871  18.567
  756    HB2  ASP 102           1HB      ASP 102   1.349  -6.227  19.305
  757    HB3  ASP 102           2HB      ASP 102   0.566  -6.668  17.794
  758    H    LYS 103           H        LYS 103  -0.350  -5.850  16.205
  759    HA   LYS 103           HA       LYS 103   0.842  -4.978  13.869
  760    HB2  LYS 103           1HB      LYS 103  -2.100  -5.593  14.306
  761    HB3  LYS 103           2HB      LYS 103  -1.307  -5.560  12.727
  762    HG2  LYS 103           1HG      LYS 103   0.206  -7.382  13.415
  763    HG3  LYS 103           2HG      LYS 103  -0.518  -7.412  15.013
  764    HD2  LYS 103           1HD      LYS 103  -2.761  -7.943  13.907
  765    HD3  LYS 103           2HD      LYS 103  -1.891  -8.096  12.380
  766    HE2  LYS 103           1HE      LYS 103  -0.430  -9.869  13.511
  767    HE3  LYS 103           2HE      LYS 103  -1.534  -9.796  14.879
  768    HZ1  LYS 103           3HZ      LYS 103  -2.952 -10.008  12.421
  769    HZ2  LYS 103           1HZ      LYS 103  -3.033 -10.992  13.801
  770    HZ3  LYS 103           2HZ      LYS 103  -1.858 -11.295  12.612
  771    H    ALA 104           H        ALA 104  -1.815  -3.399  15.624
  772    HA   ALA 104           HA       ALA 104  -2.411  -1.326  13.845
  773    HB1  ALA 104           3HB      ALA 104  -3.720  -1.820  15.890
  774    HB2  ALA 104           1HB      ALA 104  -3.288  -0.113  15.789
  775    HB3  ALA 104           2HB      ALA 104  -2.409  -1.185  16.875
  776    H    ASN 105           H        ASN 105   0.591  -1.952  14.933
  777    HA   ASN 105           HA       ASN 105   1.528   0.815  15.406
  778    HB2  ASN 105           1HB      ASN 105   3.052  -1.822  15.297
  779    HB3  ASN 105           2HB      ASN 105   3.771  -0.259  15.655
  780   HD21  ASN 105          2HD2      ASN 105   3.693  -2.535  17.513
  781   HD22  ASN 105          1HD2      ASN 105   2.796  -2.028  18.863
  782    H    ASN 106           H        ASN 106   1.615  -1.684  12.879
  783    HA   ASN 106           HA       ASN 106   3.272  -0.001  11.102
  784    HB2  ASN 106           1HB      ASN 106   3.238  -2.005   9.634
  785    HB3  ASN 106           2HB      ASN 106   3.791  -2.408  11.258
  786   HD21  ASN 106          2HD2      ASN 106   1.041  -2.718   9.019
  787   HD22  ASN 106          1HD2      ASN 106   0.263  -3.951   9.887
  788    H    VAL 107           H        VAL 107   0.895   1.229  11.656
  789    HA   VAL 107           HA       VAL 107  -0.920   0.735   9.338
  790    HB   VAL 107           HB       VAL 107  -1.292   2.519  11.793
  791   HG11  VAL 107          1HG1      VAL 107  -3.203   1.744   9.526
  792   HG12  VAL 107          2HG1      VAL 107  -2.608   3.367   9.875
  793   HG13  VAL 107          3HG1      VAL 107  -3.694   2.574  11.003
  794   HG21  VAL 107          3HG2      VAL 107  -2.849   0.757  12.543
  795   HG22  VAL 107          1HG2      VAL 107  -1.255   0.065  12.266
  796   HG23  VAL 107          2HG2      VAL 107  -2.525  -0.186  11.083
  797    H    PHE 108           H        PHE 108  -1.071   2.116   7.712
  798    HA   PHE 108           HA       PHE 108   0.103   4.821   7.871
  799    HB2  PHE 108           1HB      PHE 108   0.843   2.820   5.693
  800    HB3  PHE 108           2HB      PHE 108   1.434   4.472   5.842
  801    HD1  PHE 108           HD1      PHE 108   2.476   5.058   8.282
  802    HD2  PHE 108           HD2      PHE 108   2.316   1.098   6.554
  803    HE1  PHE 108           HE1      PHE 108   4.292   4.317   9.782
  804    HE2  PHE 108           HE2      PHE 108   4.131   0.378   8.074
  805    HZ   PHE 108           HZ       PHE 108   5.126   1.984   9.685
  806    H    SER 109           H        SER 109  -0.791   6.269   6.485
  807    HA   SER 109           HA       SER 109  -2.604   5.512   4.355
  808    HB2  SER 109           1HB      SER 109  -4.056   5.141   6.325
  809    HB3  SER 109           2HB      SER 109  -3.742   6.781   6.879
  810    HG   SER 109           HG       SER 109  -4.840   7.573   5.162
  811    H    ARG 110           H        ARG 110  -3.180   7.265   3.073
  812    HA   ARG 110           HA       ARG 110  -2.232   9.971   3.828
  813    HB2  ARG 110           1HB      ARG 110  -0.321   8.816   2.697
  814    HB3  ARG 110           2HB      ARG 110  -1.329   8.560   1.274
  815    HG2  ARG 110           1HG      ARG 110  -1.614  11.039   1.050
  816    HG3  ARG 110           2HG      ARG 110  -0.591  11.270   2.465
  817    HD2  ARG 110           1HD      ARG 110   1.277  10.134   1.263
  818    HD3  ARG 110           2HD      ARG 110   0.246   9.987  -0.166
  819    HE   ARG 110           HE       ARG 110   1.625  12.357   0.741
  820   HH11  ARG 110          1HH2      ARG 110  -1.217  11.213  -0.907
  821   HH12  ARG 110          2HH2      ARG 110  -1.470  12.689  -1.775
  822   HH21  ARG 110          1HH1      ARG 110   1.281  14.287  -0.403
  823   HH22  ARG 110          2HH1      ARG 110  -0.060  14.423  -1.491
  824    H    ILE 111           H        ILE 111  -3.570  11.493   3.144
  825    HA   ILE 111           HA       ILE 111  -5.942  10.754   1.605
  826    HB   ILE 111           HB       ILE 111  -5.064  13.385   2.896
  827   HG12  ILE 111          1HG1      ILE 111  -6.945  12.850   4.499
  828   HG13  ILE 111          2HG1      ILE 111  -7.178  11.309   3.689
  829   HG21  ILE 111          1HG2      ILE 111  -6.540  13.991   1.045
  830   HG22  ILE 111          2HG2      ILE 111  -7.517  14.061   2.502
  831   HG23  ILE 111          3HG2      ILE 111  -7.651  12.673   1.419
  832   HD11  ILE 111          3HD1      ILE 111  -4.438  11.962   4.807
  833   HD12  ILE 111          1HD1      ILE 111  -5.239  10.400   4.601
  834   HD13  ILE 111          2HD1      ILE 111  -5.733  11.478   5.893
  835    H    VAL 112           H        VAL 112  -5.929  10.793  -0.538
  836    HA   VAL 112           HA       VAL 112  -3.953  12.428  -2.030
  837    HB   VAL 112           HB       VAL 112  -5.896  10.335  -3.138
  838   HG11  VAL 112          1HG1      VAL 112  -4.880  11.914  -4.792
  839   HG12  VAL 112          2HG1      VAL 112  -4.290  10.275  -5.016
  840   HG13  VAL 112          3HG1      VAL 112  -3.275  11.474  -4.217
  841   HG21  VAL 112          3HG2      VAL 112  -3.955   8.766  -3.028
  842   HG22  VAL 112          1HG2      VAL 112  -4.460   9.281  -1.421
  843   HG23  VAL 112          2HG2      VAL 112  -3.020   9.986  -2.160
  844    H    LYS 113           H        LYS 113  -4.668  14.466  -2.306
  845    HA   LYS 113           HA       LYS 113  -7.508  15.083  -2.722
  846    HB2  LYS 113           1HB      LYS 113  -5.024  16.847  -2.672
  847    HB3  LYS 113           2HB      LYS 113  -6.683  17.444  -2.790
  848    HG2  LYS 113           1HG      LYS 113  -7.227  16.366  -0.610
  849    HG3  LYS 113           2HG      LYS 113  -5.561  15.788  -0.486
  850    HD2  LYS 113           1HD      LYS 113  -4.744  18.143  -0.502
  851    HD3  LYS 113           2HD      LYS 113  -6.413  18.715  -0.605
  852    HE2  LYS 113           1HE      LYS 113  -5.246  17.065   1.678
  853    HE3  LYS 113           2HE      LYS 113  -5.609  18.792   1.735
  854    HZ1  LYS 113           3HZ      LYS 113  -7.487  16.520   1.532
  855    HZ2  LYS 113           1HZ      LYS 113  -7.953  18.081   1.065
  856    HZ3  LYS 113           2HZ      LYS 113  -7.466  17.785   2.665
  857    H    VAL 114           H        VAL 114  -8.404  15.066  -4.673
  858    HA   VAL 114           HA       VAL 114  -6.754  15.658  -7.097
  859    HB   VAL 114           HB       VAL 114  -8.955  13.549  -6.936
  860   HG11  VAL 114          1HG1      VAL 114  -8.692  14.552  -9.177
  861   HG12  VAL 114          2HG1      VAL 114  -8.092  12.900  -9.172
  862   HG13  VAL 114          3HG1      VAL 114  -6.963  14.244  -9.105
  863   HG21  VAL 114          3HG2      VAL 114  -5.925  13.211  -6.971
  864   HG22  VAL 114          1HG2      VAL 114  -7.097  11.899  -7.122
  865   HG23  VAL 114          2HG2      VAL 114  -7.002  12.820  -5.626
  866    H    LEU 115           H        LEU 115  -7.591  17.068  -8.460
  867    HA   LEU 115           HA       LEU 115 -10.458  17.736  -8.462
  868    HB2  LEU 115           1HB      LEU 115  -9.913  20.191  -8.250
  869    HB3  LEU 115           2HB      LEU 115  -9.665  19.284  -6.770
  870    HG   LEU 115           HG       LEU 115  -7.199  19.439  -8.518
  871   HD11  LEU 115          1HD1      LEU 115  -8.240  21.946  -7.161
  872   HD12  LEU 115          2HD1      LEU 115  -8.058  21.703  -8.900
  873   HD13  LEU 115          3HD1      LEU 115  -6.632  21.751  -7.866
  874   HD21  LEU 115          3HD2      LEU 115  -7.622  20.058  -5.562
  875   HD22  LEU 115          1HD2      LEU 115  -6.079  19.790  -6.374
  876   HD23  LEU 115          2HD2      LEU 115  -7.227  18.466  -6.202
  877    H    GLU 116           H        GLU 116 -10.709  19.648 -10.081
  878    HA   GLU 116           HA       GLU 116  -8.931  19.339 -12.433
  879    HB2  GLU 116           1HB      GLU 116 -10.931  19.026 -13.895
  880    HB3  GLU 116           2HB      GLU 116 -10.691  17.678 -12.778
  881    HG2  GLU 116           1HG      GLU 116 -12.401  18.632 -11.249
  882    HG3  GLU 116           2HG      GLU 116 -12.658  19.971 -12.363
  883    H    HIS 117           H        HIS 117  -8.905  21.078 -13.804
  884    HA   HIS 117           HA       HIS 117  -9.605  23.617 -12.627
  885    HB2  HIS 117           1HB      HIS 117  -7.564  23.186 -14.075
  886    HB3  HIS 117           2HB      HIS 117  -8.624  23.098 -15.476
  887    HD1  HIS 117           HD1      HIS 117  -8.534  25.510 -12.518
  888    HD2  HIS 117           HD2      HIS 117  -8.449  25.600 -16.684
  889    HE1  HIS 117           HE1      HIS 117  -8.509  27.951 -13.177
  890    HE2  HIS 117           HE2      HIS 117  -8.458  28.026 -15.714
  891    H    HIS 118           H        HIS 118 -11.852  23.638 -12.433
  892    HA   HIS 118           HA       HIS 118 -13.705  22.990 -14.469
  893    HB2  HIS 118           1HB      HIS 118 -14.314  23.250 -12.067
  894    HB3  HIS 118           2HB      HIS 118 -14.031  24.985 -12.183
  895    HD1  HIS 118           HD1      HIS 118 -15.843  26.410 -13.307
  896    HD2  HIS 118           HD2      HIS 118 -16.630  22.323 -13.549
  897    HE1  HIS 118           HE1      HIS 118 -18.193  26.186 -14.228
  898    HE2  HIS 118           HE2      HIS 118 -18.686  23.700 -14.382
  899    H    HIS 119           H        HIS 119 -12.333  26.145 -13.505
  900    HA   HIS 119           HA       HIS 119 -13.658  27.689 -15.496
  901    HB2  HIS 119           1HB      HIS 119 -11.009  28.243 -14.088
  902    HB3  HIS 119           2HB      HIS 119 -12.005  29.431 -14.932
  903    HD1  HIS 119           HD1      HIS 119 -11.395  28.160 -11.644
  904    HD2  HIS 119           HD2      HIS 119 -14.796  29.452 -13.675
  905    HE1  HIS 119           HE1      HIS 119 -13.129  28.679  -9.874
  906    HE2  HIS 119           HE2      HIS 119 -15.211  29.469 -11.097
  907    H    HIS 120           H        HIS 120 -13.405  26.295 -17.357
  908    HA   HIS 120           HA       HIS 120 -10.930  25.599 -18.536
  909    HB2  HIS 120           1HB      HIS 120 -13.630  26.134 -19.845
  910    HB3  HIS 120           2HB      HIS 120 -12.269  25.332 -20.632
  911    HD1  HIS 120           HD1      HIS 120 -15.280  24.481 -18.990
  912    HD2  HIS 120           HD2      HIS 120 -11.390  22.997 -18.763
  913    HE1  HIS 120           HE1      HIS 120 -15.454  22.162 -17.985
  914    HE2  HIS 120           HE2      HIS 120 -13.091  21.245 -17.841
  915    H    HIS 121           H        HIS 121 -12.965  28.484 -18.863
  916    HA   HIS 121           HA       HIS 121 -11.437  29.719 -20.929
  917    HB2  HIS 121           1HB      HIS 121 -13.777  30.364 -20.345
  918    HB3  HIS 121           2HB      HIS 121 -13.208  31.035 -18.818
  919    HD1  HIS 121           HD1      HIS 121 -12.462  31.438 -22.546
  920    HD2  HIS 121           HD2      HIS 121 -12.489  33.706 -19.048
  921    HE1  HIS 121           HE1      HIS 121 -11.861  33.802 -23.223
  922    HE2  HIS 121           HE2      HIS 121 -11.872  35.198 -21.103
  923    H    HIS 122           H        HIS 122  -9.411  30.460 -20.762
  924    HA   HIS 122           HA       HIS 122  -7.970  30.700 -18.305
  925    HB2  HIS 122           1HB      HIS 122  -7.310  31.830 -21.059
  926    HB3  HIS 122           2HB      HIS 122  -6.173  31.639 -19.721
  927    HD1  HIS 122           HD1      HIS 122  -7.989  29.727 -22.365
  928    HD2  HIS 122           HD2      HIS 122  -5.466  28.910 -19.148
  929    HE1  HIS 122           HE1      HIS 122  -7.262  27.314 -22.620
  930    HE2  HIS 122           HE2      HIS 122  -5.722  26.800 -20.667
  Start of MODEL    8
    1    H1   MET   1           1H       MET   1  14.848   7.344   4.037
    2    H2   MET   1           2H       MET   1  14.576   9.012   4.221
    3    H3   MET   1           3H       MET   1  14.013   8.203   2.837
    4    HA   MET   1           HA       MET   1  12.813   6.778   4.749
    5    HB2  MET   1           1HB      MET   1  12.882   9.692   5.654
    6    HB3  MET   1           2HB      MET   1  11.873   8.431   6.362
    7    HG2  MET   1           1HG      MET   1  14.914   8.347   6.312
    8    HG3  MET   1           2HG      MET   1  13.966   8.899   7.689
    9    HE1  MET   1           3HE      MET   1  13.405   7.233   9.638
   10    HE2  MET   1           1HE      MET   1  12.396   5.841   9.222
   11    HE3  MET   1           2HE      MET   1  11.967   7.450   8.646
   12    H    ASP   2           H        ASP   2  12.215  10.181   3.871
   13    HA   ASP   2           HA       ASP   2  10.542  11.185   2.669
   14    HB2  ASP   2           1HB      ASP   2  10.789   8.660   0.989
   15    HB3  ASP   2           2HB      ASP   2  10.024  10.161   0.474
   16    H    LEU   3           H        LEU   3   8.253  10.583   1.528
   17    HA   LEU   3           HA       LEU   3   6.565   9.849   3.652
   18    HB2  LEU   3           1HB      LEU   3   5.902   9.996   0.689
   19    HB3  LEU   3           2HB      LEU   3   4.733   9.997   2.005
   20    HG   LEU   3           HG       LEU   3   6.519  12.135   2.708
   21   HD11  LEU   3          1HD1      LEU   3   7.505  12.030   0.424
   22   HD12  LEU   3          2HD1      LEU   3   6.682  13.558   0.730
   23   HD13  LEU   3          3HD1      LEU   3   5.908  12.327  -0.268
   24   HD21  LEU   3          3HD2      LEU   3   4.613  13.628   2.136
   25   HD22  LEU   3          1HD2      LEU   3   4.071  12.185   2.998
   26   HD23  LEU   3          2HD2      LEU   3   3.860  12.300   1.257
   27    HA   PRO   4           HA       PRO   4   6.606   5.398   3.102
   28    HB2  PRO   4           1HB      PRO   4   4.341   4.605   4.433
   29    HB3  PRO   4           2HB      PRO   4   5.712   5.334   5.304
   30    HG2  PRO   4           1HG      PRO   4   3.223   6.710   4.296
   31    HG3  PRO   4           2HG      PRO   4   3.922   6.760   5.922
   32    HD2  PRO   4           1HD      PRO   4   4.426   8.750   4.141
   33    HD3  PRO   4           2HD      PRO   4   5.689   8.175   5.245
   34    H    ILE   5           H        ILE   5   3.603   7.047   2.316
   35    HA   ILE   5           HA       ILE   5   2.956   4.982   0.271
   36    HB   ILE   5           HB       ILE   5   1.264   7.271   1.356
   37   HG12  ILE   5          1HG1      ILE   5   1.796   5.338   3.006
   38   HG13  ILE   5          2HG1      ILE   5   0.113   5.688   2.748
   39   HG21  ILE   5          1HG2      ILE   5   0.510   6.705  -0.891
   40   HG22  ILE   5          2HG2      ILE   5  -0.620   5.975   0.235
   41   HG23  ILE   5          3HG2      ILE   5   0.597   4.975  -0.555
   42   HD11  ILE   5          3HD1      ILE   5   1.491   3.491   1.189
   43   HD12  ILE   5          1HD1      ILE   5  -0.224   3.725   1.491
   44   HD13  ILE   5          2HD1      ILE   5   0.847   3.224   2.793
   45    H    THR   6           H        THR   6   3.113   5.379  -1.825
   46    HA   THR   6           HA       THR   6   3.416   8.182  -2.808
   47    HB   THR   6           HB       THR   6   5.289   7.560  -4.224
   48    HG1  THR   6           HG1      THR   6   4.415   5.219  -4.121
   49   HG21  THR   6          3HG2      THR   6   5.779   8.236  -1.846
   50   HG22  THR   6          1HG2      THR   6   7.010   7.172  -2.529
   51   HG23  THR   6          2HG2      THR   6   5.809   6.525  -1.413
   52    H    LEU   7           H        LEU   7   2.007   8.553  -4.359
   53    HA   LEU   7           HA       LEU   7   0.921   6.317  -6.011
   54    HB2  LEU   7           1HB      LEU   7  -0.350   9.021  -5.403
   55    HB3  LEU   7           2HB      LEU   7  -1.104   7.650  -6.225
   56    HG   LEU   7           HG       LEU   7  -0.213   7.728  -3.302
   57   HD11  LEU   7          1HD1      LEU   7  -2.268   9.037  -3.800
   58   HD12  LEU   7          2HD1      LEU   7  -2.621   7.634  -2.799
   59   HD13  LEU   7          3HD1      LEU   7  -3.000   7.607  -4.520
   60   HD21  LEU   7          3HD2      LEU   7  -1.527   5.487  -3.217
   61   HD22  LEU   7          1HD2      LEU   7   0.058   5.446  -3.974
   62   HD23  LEU   7          2HD2      LEU   7  -1.397   5.476  -4.975
   63    H    SER   8           H        SER   8   0.628   6.634  -8.206
   64    HA   SER   8           HA       SER   8   2.604   8.366  -9.484
   65    HB2  SER   8           1HB      SER   8   1.867   7.253 -11.561
   66    HB3  SER   8           2HB      SER   8   2.212   6.072 -10.308
   67    HG   SER   8           HG       SER   8   0.229   5.646 -11.348
   68    H    LYS   9           H        LYS   9   0.288   9.585  -8.061
   69    HA   LYS   9           HA       LYS   9  -1.490  10.646 -10.071
   70    HB2  LYS   9           1HB      LYS   9  -1.999  10.358  -7.567
   71    HB3  LYS   9           2HB      LYS   9  -1.015  11.789  -7.277
   72    HG2  LYS   9           1HG      LYS   9  -2.512  13.120  -8.766
   73    HG3  LYS   9           2HG      LYS   9  -3.475  11.681  -9.081
   74    HD2  LYS   9           1HD      LYS   9  -4.073  11.537  -6.687
   75    HD3  LYS   9           2HD      LYS   9  -3.079  12.955  -6.343
   76    HE2  LYS   9           1HE      LYS   9  -5.493  13.558  -6.567
   77    HE3  LYS   9           2HE      LYS   9  -4.507  14.344  -7.800
   78    HZ1  LYS   9           3HZ      LYS   9  -5.414  13.126  -9.440
   79    HZ2  LYS   9           1HZ      LYS   9  -6.710  12.983  -8.358
   80    HZ3  LYS   9           2HZ      LYS   9  -5.574  11.728  -8.488
   81    H    GLU  10           H        GLU  10   0.992  11.024 -11.078
   82    HA   GLU  10           HA       GLU  10   2.367  13.391 -10.514
   83    HB2  GLU  10           1HB      GLU  10   3.045  13.262 -13.006
   84    HB3  GLU  10           2HB      GLU  10   3.385  11.825 -12.043
   85    HG2  GLU  10           1HG      GLU  10   1.597  10.574 -13.006
   86    HG3  GLU  10           2HG      GLU  10   0.737  12.008 -13.541
   87    H    THR  11           H        THR  11  -0.687  12.899 -12.096
   88    HA   THR  11           HA       THR  11  -0.984  15.844 -12.479
   89    HB   THR  11           HB       THR  11  -0.536  14.779 -14.658
   90    HG1  THR  11           HG1      THR  11  -2.182  15.813 -15.646
   91   HG21  THR  11          3HG2      THR  11  -2.023  13.136 -15.627
   92   HG22  THR  11          1HG2      THR  11  -3.172  13.303 -14.307
   93   HG23  THR  11          2HG2      THR  11  -1.617  12.528 -14.024
   94    HA   PRO  12           HA       PRO  12  -4.795  14.842 -10.248
   95    HB2  PRO  12           1HB      PRO  12  -6.022  17.250 -10.153
   96    HB3  PRO  12           2HB      PRO  12  -4.469  17.001  -9.316
   97    HG2  PRO  12           1HG      PRO  12  -4.931  18.210 -12.049
   98    HG3  PRO  12           2HG      PRO  12  -4.003  18.880 -10.690
   99    HD2  PRO  12           1HD      PRO  12  -2.761  17.494 -12.710
  100    HD3  PRO  12           2HD      PRO  12  -2.179  17.397 -11.028
  101    H    PHE  13           H        PHE  13  -6.199  13.543 -11.329
  102    HA   PHE  13           HA       PHE  13  -8.259  14.658 -12.995
  103    HB2  PHE  13           1HB      PHE  13  -6.244  14.428 -14.596
  104    HB3  PHE  13           2HB      PHE  13  -6.414  12.687 -14.428
  105    HD1  PHE  13           HD2      PHE  13  -8.633  11.573 -15.091
  106    HD2  PHE  13           HD1      PHE  13  -7.793  15.697 -16.018
  107    HE1  PHE  13           HE2      PHE  13 -10.457  11.573 -16.764
  108    HE2  PHE  13           HE1      PHE  13  -9.630  15.690 -17.681
  109    HZ   PHE  13           HZ       PHE  13 -10.959  13.630 -18.057
  110    H    GLU  14           H        GLU  14  -9.769  13.661 -11.737
  111    HA   GLU  14           HA       GLU  14  -9.659  11.099 -10.627
  112    HB2  GLU  14           1HB      GLU  14 -11.319  12.880 -10.034
  113    HB3  GLU  14           2HB      GLU  14 -12.179  12.555 -11.536
  114    HG2  GLU  14           1HG      GLU  14 -12.587  10.213 -10.800
  115    HG3  GLU  14           2HG      GLU  14 -11.694  10.522  -9.314
  116    H    GLY  15           H        GLY  15 -10.466   9.073 -11.261
  117    HA2  GLY  15           1HA      GLY  15 -11.372   7.459 -12.721
  118    HA3  GLY  15           2HA      GLY  15 -11.451   8.648 -14.012
  119    H    GLU  16           H        GLU  16  -8.584   9.430 -13.282
  120    HA   GLU  16           HA       GLU  16  -7.280   7.767 -15.215
  121    HB2  GLU  16           1HB      GLU  16  -6.667  10.165 -14.758
  122    HB3  GLU  16           2HB      GLU  16  -6.013   9.682 -13.199
  123    HG2  GLU  16           1HG      GLU  16  -4.174   9.860 -14.805
  124    HG3  GLU  16           2HG      GLU  16  -4.392   8.158 -14.421
  125    H    GLU  17           H        GLU  17  -5.953   6.042 -14.957
  126    HA   GLU  17           HA       GLU  17  -6.153   4.496 -12.568
  127    HB2  GLU  17           1HB      GLU  17  -5.839   3.567 -14.894
  128    HB3  GLU  17           2HB      GLU  17  -4.168   4.126 -14.861
  129    HG2  GLU  17           1HG      GLU  17  -3.759   2.711 -12.837
  130    HG3  GLU  17           2HG      GLU  17  -5.427   2.144 -12.908
  131    H    ILE  18           H        ILE  18  -4.789   4.312 -10.866
  132    HA   ILE  18           HA       ILE  18  -2.219   5.852 -10.850
  133    HB   ILE  18           HB       ILE  18  -2.674   6.388  -8.463
  134   HG12  ILE  18          1HG1      ILE  18  -5.501   5.338  -9.001
  135   HG13  ILE  18          2HG1      ILE  18  -4.307   4.487  -8.031
  136   HG21  ILE  18          1HG2      ILE  18  -3.227   8.027 -10.252
  137   HG22  ILE  18          2HG2      ILE  18  -4.352   8.169  -8.909
  138   HG23  ILE  18          3HG2      ILE  18  -4.845   7.340 -10.383
  139   HD11  ILE  18          3HD1      ILE  18  -5.780   5.723  -6.546
  140   HD12  ILE  18          1HD1      ILE  18  -5.482   7.220  -7.423
  141   HD13  ILE  18          2HD1      ILE  18  -4.184   6.465  -6.495
  142    H    THR  19           H        THR  19  -0.533   4.985  -9.715
  143    HA   THR  19           HA       THR  19  -0.686   2.067  -9.243
  144    HB   THR  19           HB       THR  19   1.757   3.890  -9.338
  145    HG1  THR  19           HG1      THR  19   1.535   3.813 -11.398
  146   HG21  THR  19          3HG2      THR  19   2.152   1.713  -8.202
  147   HG22  THR  19          1HG2      THR  19   2.962   1.766  -9.766
  148   HG23  THR  19          2HG2      THR  19   1.458   0.870  -9.587
  149    H    VAL  20           H        VAL  20  -1.163   1.488  -7.227
  150    HA   VAL  20           HA       VAL  20  -0.437   3.224  -4.941
  151    HB   VAL  20           HB       VAL  20  -2.114   0.671  -4.939
  152   HG11  VAL  20          1HG1      VAL  20  -2.971   1.658  -2.780
  153   HG12  VAL  20          2HG1      VAL  20  -1.786   2.948  -2.916
  154   HG13  VAL  20          3HG1      VAL  20  -1.251   1.279  -2.705
  155   HG21  VAL  20          3HG2      VAL  20  -3.148   2.391  -6.408
  156   HG22  VAL  20          1HG2      VAL  20  -3.002   3.588  -5.122
  157   HG23  VAL  20          2HG2      VAL  20  -4.076   2.203  -4.925
  158    H    SER  21           H        SER  21   1.365   2.840  -3.833
  159    HA   SER  21           HA       SER  21   2.508   0.089  -3.697
  160    HB2  SER  21           1HB      SER  21   4.077   2.683  -3.968
  161    HB3  SER  21           2HB      SER  21   4.746   1.061  -3.824
  162    HG   SER  21           HG       SER  21   4.302   0.714  -5.850
  163    H    ALA  22           H        ALA  22   2.934  -0.596  -1.720
  164    HA   ALA  22           HA       ALA  22   2.990   1.349   0.561
  165    HB1  ALA  22           3HB      ALA  22   1.825  -1.465   0.477
  166    HB2  ALA  22           1HB      ALA  22   0.897   0.033   0.500
  167    HB3  ALA  22           2HB      ALA  22   1.886  -0.409   1.892
  168    H    ARG  23           H        ARG  23   4.866   1.345   1.578
  169    HA   ARG  23           HA       ARG  23   6.891  -0.661   1.059
  170    HB2  ARG  23           1HB      ARG  23   8.306   0.717   2.560
  171    HB3  ARG  23           2HB      ARG  23   7.591   1.668   1.262
  172    HG2  ARG  23           1HG      ARG  23   5.961   2.680   2.724
  173    HG3  ARG  23           2HG      ARG  23   6.294   1.535   4.025
  174    HD2  ARG  23           1HD      ARG  23   8.265   3.601   2.999
  175    HD3  ARG  23           2HD      ARG  23   7.346   3.698   4.504
  176    HE   ARG  23           HE       ARG  23   8.772   1.277   4.503
  177   HH11  ARG  23          1HH2      ARG  23   9.298   4.716   4.664
  178   HH12  ARG  23          2HH2      ARG  23  10.762   4.580   5.579
  179   HH21  ARG  23          1HH1      ARG  23  10.678   1.114   5.702
  180   HH22  ARG  23          2HH1      ARG  23  11.540   2.544   6.166
  181    H    VAL  24           H        VAL  24   7.723  -2.161   2.509
  182    HA   VAL  24           HA       VAL  24   6.308  -2.533   5.118
  183    HB   VAL  24           HB       VAL  24   5.443  -4.124   3.440
  184   HG11  VAL  24          1HG1      VAL  24   7.439  -4.266   1.985
  185   HG12  VAL  24          2HG1      VAL  24   6.829  -5.854   2.428
  186   HG13  VAL  24          3HG1      VAL  24   8.268  -5.215   3.214
  187   HG21  VAL  24          3HG2      VAL  24   7.228  -5.521   5.485
  188   HG22  VAL  24          1HG2      VAL  24   5.772  -6.181   4.745
  189   HG23  VAL  24          2HG2      VAL  24   5.660  -4.806   5.839
  190    H    THR  25           H        THR  25   7.602  -2.898   6.816
  191    HA   THR  25           HA       THR  25  10.543  -3.040   6.360
  192    HB   THR  25           HB       THR  25   8.961  -2.362   8.877
  193    HG1  THR  25           HG1      THR  25  10.048  -0.895   6.762
  194   HG21  THR  25          3HG2      THR  25  11.192  -1.481   9.652
  195   HG22  THR  25          1HG2      THR  25  11.946  -2.220   8.239
  196   HG23  THR  25          2HG2      THR  25  11.186  -3.234   9.472
  197    H    ASN  26           H        ASN  26  11.538  -4.925   6.631
  198    HA   ASN  26           HA       ASN  26  10.138  -7.237   7.719
  199    HB2  ASN  26           1HB      ASN  26  11.565  -7.442   5.737
  200    HB3  ASN  26           2HB      ASN  26  12.976  -6.946   6.650
  201   HD21  ASN  26          2HD2      ASN  26  10.349  -9.128   7.738
  202   HD22  ASN  26          1HD2      ASN  26  11.347 -10.478   7.956
  203    H    ARG  27           H        ARG  27  10.134  -7.708   9.797
  204    HA   ARG  27           HA       ARG  27  12.299  -6.727  11.609
  205    HB2  ARG  27           1HB      ARG  27   9.421  -7.545  12.165
  206    HB3  ARG  27           2HB      ARG  27  10.584  -7.003  13.380
  207    HG2  ARG  27           1HG      ARG  27  10.795  -4.820  12.197
  208    HG3  ARG  27           2HG      ARG  27   9.620  -5.361  10.995
  209    HD2  ARG  27           1HD      ARG  27   8.521  -3.954  12.690
  210    HD3  ARG  27           2HD      ARG  27   7.917  -5.611  12.798
  211    HE   ARG  27           HE       ARG  27  10.150  -5.272  14.530
  212   HH11  ARG  27          1HH2      ARG  27   6.792  -4.394  14.222
  213   HH12  ARG  27          2HH2      ARG  27   6.548  -4.247  15.929
  214   HH21  ARG  27          1HH1      ARG  27   9.814  -5.075  16.740
  215   HH22  ARG  27          2HH1      ARG  27   8.255  -4.632  17.352
  216    H    GLY  28           H        GLY  28  13.763  -8.387  11.380
  217    HA2  GLY  28           1HA      GLY  28  13.306 -10.754  12.934
  218    HA3  GLY  28           2HA      GLY  28  13.324 -11.109  11.207
  219    H    ALA  29           H        ALA  29  15.223 -11.558  13.615
  220    HA   ALA  29           HA       ALA  29  17.681 -10.200  12.920
  221    HB1  ALA  29           3HB      ALA  29  17.196 -10.984  15.217
  222    HB2  ALA  29           1HB      ALA  29  18.679 -11.714  14.598
  223    HB3  ALA  29           2HB      ALA  29  17.186 -12.654  14.652
  224    H    ALA  30           H        ALA  30  16.047 -12.207  11.075
  225    HA   ALA  30           HA       ALA  30  18.447 -13.365   9.794
  226    HB1  ALA  30           3HB      ALA  30  17.642 -15.122  11.352
  227    HB2  ALA  30           1HB      ALA  30  17.413 -15.606   9.670
  228    HB3  ALA  30           2HB      ALA  30  16.040 -15.038  10.622
  229    H    GLU  31           H        GLU  31  17.918 -14.289   7.661
  230    HA   GLU  31           HA       GLU  31  16.546 -12.445   6.042
  231    HB2  GLU  31           1HB      GLU  31  17.275 -15.343   5.459
  232    HB3  GLU  31           2HB      GLU  31  16.784 -14.167   4.237
  233    HG2  GLU  31           1HG      GLU  31  18.719 -12.732   4.835
  234    HG3  GLU  31           2HG      GLU  31  19.212 -13.898   6.059
  235    H    ALA  32           H        ALA  32  14.426 -12.163   5.626
  236    HA   ALA  32           HA       ALA  32  12.461 -14.246   6.464
  237    HB1  ALA  32           3HB      ALA  32  10.857 -12.417   6.576
  238    HB2  ALA  32           1HB      ALA  32  12.039 -11.293   5.896
  239    HB3  ALA  32           2HB      ALA  32  12.300 -11.984   7.496
  240    H    HIS  33           H        HIS  33  10.740 -14.754   5.095
  241    HA   HIS  33           HA       HIS  33  10.759 -13.806   2.312
  242    HB2  HIS  33           1HB      HIS  33  10.999 -16.754   3.050
  243    HB3  HIS  33           2HB      HIS  33  10.844 -16.092   1.420
  244    HD1  HIS  33           HD1      HIS  33  13.325 -17.011   3.929
  245    HD2  HIS  33           HD2      HIS  33  13.189 -14.324   0.736
  246    HE1  HIS  33           HE1      HIS  33  15.721 -16.366   3.430
  247    HE2  HIS  33           HE2      HIS  33  15.655 -14.731   1.490
  248    H    ASN  34           H        ASN  34   8.970 -15.197   1.156
  249    HA   ASN  34           HA       ASN  34   6.668 -15.273   0.919
  250    HB2  ASN  34           1HB      ASN  34   7.166 -17.429   2.057
  251    HB3  ASN  34           2HB      ASN  34   6.889 -16.660   3.617
  252   HD21  ASN  34          2HD2      ASN  34   5.190 -17.090   0.458
  253   HD22  ASN  34          1HD2      ASN  34   3.651 -17.284   1.147
  254    H    VAL  35           H        VAL  35   7.077 -12.800   1.447
  255    HA   VAL  35           HA       VAL  35   5.443 -11.948   3.805
  256    HB   VAL  35           HB       VAL  35   7.350 -10.293   2.106
  257   HG11  VAL  35          1HG1      VAL  35   7.167  -8.685   4.011
  258   HG12  VAL  35          2HG1      VAL  35   5.975  -9.732   4.777
  259   HG13  VAL  35          3HG1      VAL  35   5.602  -8.942   3.246
  260   HG21  VAL  35          3HG2      VAL  35   7.748 -11.614   4.831
  261   HG22  VAL  35          1HG2      VAL  35   8.875 -10.480   4.080
  262   HG23  VAL  35          2HG2      VAL  35   8.580 -12.048   3.338
  263    HA   PRO  36           HA       PRO  36   2.806 -11.003   0.077
  264    HB2  PRO  36           1HB      PRO  36   0.408 -11.914   0.905
  265    HB3  PRO  36           2HB      PRO  36   1.684 -13.071   0.439
  266    HG2  PRO  36           1HG      PRO  36   0.994 -12.091   3.226
  267    HG3  PRO  36           2HG      PRO  36   1.107 -13.773   2.642
  268    HD2  PRO  36           1HD      PRO  36   3.224 -12.602   3.884
  269    HD3  PRO  36           2HD      PRO  36   3.481 -13.715   2.520
  270    H    VAL  37           H        VAL  37   1.135  -9.431  -0.199
  271    HA   VAL  37           HA       VAL  37   0.473  -7.729   2.141
  272    HB   VAL  37           HB       VAL  37   2.526  -6.794   1.086
  273   HG11  VAL  37          1HG1      VAL  37   0.823  -6.390  -1.411
  274   HG12  VAL  37          2HG1      VAL  37   2.111  -7.585  -1.250
  275   HG13  VAL  37          3HG1      VAL  37   2.487  -5.865  -1.176
  276   HG21  VAL  37          3HG2      VAL  37   0.857  -5.279   2.163
  277   HG22  VAL  37          1HG2      VAL  37   0.057  -5.063   0.604
  278   HG23  VAL  37          2HG2      VAL  37   1.704  -4.481   0.835
  279    H    ALA  38           H        ALA  38  -1.471  -6.788   2.037
  280    HA   ALA  38           HA       ALA  38  -3.121  -7.094  -0.439
  281    HB1  ALA  38           3HB      ALA  38  -5.021  -7.684   1.003
  282    HB2  ALA  38           1HB      ALA  38  -3.998  -7.575   2.444
  283    HB3  ALA  38           2HB      ALA  38  -3.704  -8.832   1.241
  284    H    VAL  39           H        VAL  39  -4.006  -5.242  -1.057
  285    HA   VAL  39           HA       VAL  39  -4.248  -2.984   0.879
  286    HB   VAL  39           HB       VAL  39  -3.816  -2.819  -2.144
  287   HG11  VAL  39          1HG1      VAL  39  -4.921  -0.838  -1.076
  288   HG12  VAL  39          2HG1      VAL  39  -3.307  -0.455  -1.654
  289   HG13  VAL  39          3HG1      VAL  39  -3.577  -0.724   0.061
  290   HG21  VAL  39          3HG2      VAL  39  -1.818  -3.826  -1.085
  291   HG22  VAL  39          1HG2      VAL  39  -1.794  -2.544   0.127
  292   HG23  VAL  39          2HG2      VAL  39  -1.472  -2.169  -1.566
  293    H    TYR  40           H        TYR  40  -6.100  -1.796   0.825
  294    HA   TYR  40           HA       TYR  40  -8.248  -2.410  -1.075
  295    HB2  TYR  40           1HB      TYR  40  -9.852  -2.953   0.793
  296    HB3  TYR  40           2HB      TYR  40  -8.598  -4.173   0.568
  297    HD1  TYR  40           HD1      TYR  40  -9.748  -1.390   2.765
  298    HD2  TYR  40           HD2      TYR  40  -6.796  -4.496   2.240
  299    HE1  TYR  40           HE1      TYR  40  -8.983  -1.071   5.093
  300    HE2  TYR  40           HE2      TYR  40  -6.053  -4.171   4.577
  301    HH   TYR  40           HH       TYR  40  -7.103  -3.239   6.742
  302    H    LEU  41           H        LEU  41  -9.855  -0.843  -1.123
  303    HA   LEU  41           HA       LEU  41  -9.080   1.758   0.083
  304    HB2  LEU  41           1HB      LEU  41  -9.538   1.431  -2.443
  305    HB3  LEU  41           2HB      LEU  41 -11.239   1.293  -2.021
  306    HG   LEU  41           HG       LEU  41 -10.657   3.626  -0.640
  307   HD11  LEU  41          1HD1      LEU  41  -9.121   5.039  -1.912
  308   HD12  LEU  41          2HD1      LEU  41  -8.790   3.729  -3.049
  309   HD13  LEU  41          3HD1      LEU  41  -8.280   3.593  -1.367
  310   HD21  LEU  41          3HD2      LEU  41 -11.515   4.911  -2.618
  311   HD22  LEU  41          1HD2      LEU  41 -12.469   3.469  -2.267
  312   HD23  LEU  41          2HD2      LEU  41 -11.323   3.458  -3.594
  313    H    GLY  42           H        GLY  42 -10.238   2.683   1.671
  314    HA2  GLY  42           1HA      GLY  42 -12.421   3.290   2.578
  315    HA3  GLY  42           2HA      GLY  42 -12.963   1.632   2.351
  316    H    ASN  43           H        ASN  43 -13.477   1.433   4.527
  317    HA   ASN  43           HA       ASN  43 -11.180   1.297   6.424
  318    HB2  ASN  43           1HB      ASN  43 -14.085   1.904   6.974
  319    HB3  ASN  43           2HB      ASN  43 -12.829   1.776   8.204
  320   HD21  ASN  43          2HD2      ASN  43 -14.321   3.949   5.961
  321   HD22  ASN  43          1HD2      ASN  43 -13.219   5.229   6.136
  322    HA   PRO  44           HA       PRO  44 -11.898  -3.134   6.739
  323    HB2  PRO  44           1HB      PRO  44 -11.604  -2.702   9.738
  324    HB3  PRO  44           2HB      PRO  44 -10.850  -3.947   8.711
  325    HG2  PRO  44           1HG      PRO  44  -9.427  -1.843   9.506
  326    HG3  PRO  44           2HG      PRO  44  -9.270  -2.445   7.840
  327    HD2  PRO  44           1HD      PRO  44 -10.739   0.027   8.809
  328    HD3  PRO  44           2HD      PRO  44  -9.822  -0.242   7.307
  329    H    ALA  45           H        ALA  45 -13.576  -1.012   9.042
  330    HA   ALA  45           HA       ALA  45 -15.621  -2.810   9.846
  331    HB1  ALA  45           3HB      ALA  45 -16.801  -0.780  10.615
  332    HB2  ALA  45           1HB      ALA  45 -15.689   0.227   9.685
  333    HB3  ALA  45           2HB      ALA  45 -15.093  -0.712  11.050
  334    H    GLN  46           H        GLN  46 -15.453  -0.428   7.215
  335    HA   GLN  46           HA       GLN  46 -18.149  -0.880   6.276
  336    HB2  GLN  46           1HB      GLN  46 -15.735   0.402   4.935
  337    HB3  GLN  46           2HB      GLN  46 -17.378   0.441   4.288
  338    HG2  GLN  46           1HG      GLN  46 -18.163   1.627   6.318
  339    HG3  GLN  46           2HG      GLN  46 -16.535   1.578   6.989
  340   HE21  GLN  46          2HE2      GLN  46 -18.326   3.914   6.044
  341   HE22  GLN  46          1HE2      GLN  46 -17.318   4.794   5.000
  342    H    GLY  47           H        GLY  47 -15.780  -3.030   6.429
  343    HA2  GLY  47           1HA      GLY  47 -15.370  -5.029   5.372
  344    HA3  GLY  47           2HA      GLY  47 -16.833  -4.762   4.429
  345    H    GLY  48           H        GLY  48 -13.424  -3.792   4.675
  346    HA2  GLY  48           1HA      GLY  48 -13.163  -2.536   2.171
  347    HA3  GLY  48           2HA      GLY  48 -11.854  -3.280   3.079
  348    H    VAL  49           H        VAL  49 -11.917  -3.382   0.295
  349    HA   VAL  49           HA       VAL  49 -12.338  -6.296  -0.232
  350    HB   VAL  49           HB       VAL  49 -14.102  -4.921  -1.320
  351   HG11  VAL  49          1HG1      VAL  49 -13.594  -3.316  -3.079
  352   HG12  VAL  49          2HG1      VAL  49 -11.869  -3.636  -2.958
  353   HG13  VAL  49          3HG1      VAL  49 -12.709  -2.831  -1.632
  354   HG21  VAL  49          3HG2      VAL  49 -12.123  -6.091  -3.332
  355   HG22  VAL  49          1HG2      VAL  49 -13.852  -5.853  -3.589
  356   HG23  VAL  49          2HG2      VAL  49 -13.292  -7.028  -2.402
  357    H    GLU  50           H        GLU  50 -10.634  -7.327  -1.031
  358    HA   GLU  50           HA       GLU  50  -8.091  -6.020  -1.228
  359    HB2  GLU  50           1HB      GLU  50  -8.399  -8.391  -0.503
  360    HB3  GLU  50           2HB      GLU  50  -8.866  -8.826  -2.145
  361    HG2  GLU  50           1HG      GLU  50  -6.639  -8.091  -2.975
  362    HG3  GLU  50           2HG      GLU  50  -6.184  -7.616  -1.343
  363    H    ILE  51           H        ILE  51  -7.041  -5.250  -2.980
  364    HA   ILE  51           HA       ILE  51  -8.462  -5.209  -5.600
  365    HB   ILE  51           HB       ILE  51  -6.093  -3.536  -4.636
  366   HG12  ILE  51          1HG1      ILE  51  -9.038  -2.734  -4.906
  367   HG13  ILE  51          2HG1      ILE  51  -8.287  -3.154  -3.378
  368   HG21  ILE  51          1HG2      ILE  51  -6.206  -3.720  -7.114
  369   HG22  ILE  51          2HG2      ILE  51  -6.691  -2.113  -6.623
  370   HG23  ILE  51          3HG2      ILE  51  -7.914  -3.290  -7.080
  371   HD11  ILE  51          3HD1      ILE  51  -6.650  -1.307  -3.670
  372   HD12  ILE  51          1HD1      ILE  51  -8.315  -0.728  -3.636
  373   HD13  ILE  51          2HD1      ILE  51  -7.458  -0.850  -5.171
  374    H    GLY  52           H        GLY  52  -5.440  -6.140  -4.053
  375    HA2  GLY  52           1HA      GLY  52  -4.849  -8.227  -5.813
  376    HA3  GLY  52           2HA      GLY  52  -3.987  -6.806  -6.406
  377    H    ARG  53           H        ARG  53  -2.446  -8.837  -5.688
  378    HA   ARG  53           HA       ARG  53  -0.980  -7.783  -3.393
  379    HB2  ARG  53           1HB      ARG  53  -0.879 -10.017  -2.260
  380    HB3  ARG  53           2HB      ARG  53  -2.509  -9.340  -2.261
  381    HG2  ARG  53           1HG      ARG  53  -3.114 -10.760  -4.197
  382    HG3  ARG  53           2HG      ARG  53  -1.486 -11.430  -4.235
  383    HD2  ARG  53           1HD      ARG  53  -1.804 -12.343  -1.944
  384    HD3  ARG  53           2HD      ARG  53  -3.441 -11.701  -1.930
  385    HE   ARG  53           HE       ARG  53  -4.111 -13.455  -3.294
  386   HH11  ARG  53          1HH2      ARG  53  -0.651 -13.134  -3.385
  387   HH12  ARG  53          2HH2      ARG  53  -0.409 -14.568  -4.329
  388   HH21  ARG  53          1HH1      ARG  53  -3.787 -15.320  -4.537
  389   HH22  ARG  53          2HH1      ARG  53  -2.184 -15.800  -4.980
  390    H    ASP  54           H        ASP  54   1.085  -8.959  -3.112
  391    HA   ASP  54           HA       ASP  54   2.117 -10.564  -5.312
  392    HB2  ASP  54           1HB      ASP  54   2.997  -7.661  -4.989
  393    HB3  ASP  54           2HB      ASP  54   3.932  -8.852  -5.888
  394    H    THR  55           H        THR  55   3.330 -11.995  -4.238
  395    HA   THR  55           HA       THR  55   4.483 -11.430  -1.640
  396    HB   THR  55           HB       THR  55   4.936 -13.863  -3.426
  397    HG1  THR  55           HG1      THR  55   2.920 -13.146  -1.593
  398   HG21  THR  55          3HG2      THR  55   6.550 -13.669  -1.537
  399   HG22  THR  55          1HG2      THR  55   5.416 -14.991  -1.263
  400   HG23  THR  55          2HG2      THR  55   5.205 -13.463  -0.414
  401    H    ILE  56           H        ILE  56   6.543 -10.912  -1.156
  402    HA   ILE  56           HA       ILE  56   8.430 -10.406  -3.413
  403    HB   ILE  56           HB       ILE  56   8.567  -9.221  -0.602
  404   HG12  ILE  56          1HG1      ILE  56   7.332  -7.928  -3.091
  405   HG13  ILE  56          2HG1      ILE  56   6.396  -8.572  -1.746
  406   HG21  ILE  56          1HG2      ILE  56  10.024  -7.520  -1.795
  407   HG22  ILE  56          2HG2      ILE  56   9.846  -8.434  -3.282
  408   HG23  ILE  56          3HG2      ILE  56  10.685  -9.147  -1.904
  409   HD11  ILE  56          3HD1      ILE  56   8.388  -6.285  -1.584
  410   HD12  ILE  56          1HD1      ILE  56   7.545  -6.987  -0.202
  411   HD13  ILE  56          2HD1      ILE  56   6.636  -6.165  -1.469
  412    H    SER  57           H        SER  57  10.475 -11.209  -3.358
  413    HA   SER  57           HA       SER  57  11.063 -13.319  -1.316
  414    HB2  SER  57           1HB      SER  57  12.562 -14.251  -3.004
  415    HB3  SER  57           2HB      SER  57  10.963 -14.013  -3.705
  416    HG   SER  57           HG       SER  57  11.706 -12.180  -4.722
  417    H    ARG  58           H        ARG  58  12.758 -10.850  -3.274
  418    HA   ARG  58           HA       ARG  58  15.134 -10.900  -1.718
  419    HB2  ARG  58           1HB      ARG  58  14.950 -10.017  -4.049
  420    HB3  ARG  58           2HB      ARG  58  14.081  -8.620  -3.424
  421    HG2  ARG  58           1HG      ARG  58  16.083  -8.055  -2.000
  422    HG3  ARG  58           2HG      ARG  58  16.937  -9.423  -2.704
  423    HD2  ARG  58           1HD      ARG  58  15.844  -7.049  -4.256
  424    HD3  ARG  58           2HD      ARG  58  17.535  -7.279  -3.819
  425    HE   ARG  58           HE       ARG  58  16.139  -8.538  -5.992
  426   HH11  ARG  58          1HH2      ARG  58  18.688  -8.996  -3.665
  427   HH12  ARG  58          2HH2      ARG  58  19.512 -10.185  -4.618
  428   HH21  ARG  58          1HH1      ARG  58  17.229 -10.075  -7.223
  429   HH22  ARG  58          2HH1      ARG  58  18.687 -10.795  -6.625
  430    H    ILE  59           H        ILE  59  14.103 -10.924   0.401
  431    HA   ILE  59           HA       ILE  59  13.616  -8.175   1.482
  432    HB   ILE  59           HB       ILE  59  12.383 -10.755   2.478
  433   HG12  ILE  59          1HG1      ILE  59  11.352  -9.984   0.346
  434   HG13  ILE  59          2HG1      ILE  59  10.236  -9.788   1.689
  435   HG21  ILE  59          1HG2      ILE  59  11.029  -9.159   3.925
  436   HG22  ILE  59          2HG2      ILE  59  12.132  -7.867   3.428
  437   HG23  ILE  59          3HG2      ILE  59  12.730  -9.236   4.364
  438   HD11  ILE  59          3HD1      ILE  59  11.621  -7.694   0.051
  439   HD12  ILE  59          1HD1      ILE  59  11.302  -7.284   1.728
  440   HD13  ILE  59          2HD1      ILE  59   9.981  -7.714   0.668
  441    HA   PRO  60           HA       PRO  60  17.273 -10.008   3.664
  442    HB2  PRO  60           1HB      PRO  60  19.026  -7.943   3.469
  443    HB3  PRO  60           2HB      PRO  60  18.717  -9.015   2.080
  444    HG2  PRO  60           1HG      PRO  60  17.532  -6.295   2.647
  445    HG3  PRO  60           2HG      PRO  60  18.246  -6.904   1.135
  446    HD2  PRO  60           1HD      PRO  60  15.526  -6.887   1.581
  447    HD3  PRO  60           2HD      PRO  60  16.296  -8.122   0.557
  448    H    VAL  61           H        VAL  61  18.358  -9.250   5.679
  449    HA   VAL  61           HA       VAL  61  16.444  -8.250   7.546
  450    HB   VAL  61           HB       VAL  61  18.362  -8.419   9.154
  451   HG11  VAL  61          1HG1      VAL  61  18.036 -10.791   7.277
  452   HG12  VAL  61          2HG1      VAL  61  16.988 -10.399   8.640
  453   HG13  VAL  61          3HG1      VAL  61  18.657 -10.876   8.927
  454   HG21  VAL  61          3HG2      VAL  61  20.221  -7.748   7.659
  455   HG22  VAL  61          1HG2      VAL  61  19.963  -9.189   6.677
  456   HG23  VAL  61          2HG2      VAL  61  20.530  -9.339   8.337
  457    H    GLY  62           H        GLY  62  16.205  -6.258   8.440
  458    HA2  GLY  62           1HA      GLY  62  16.465  -4.022   8.829
  459    HA3  GLY  62           2HA      GLY  62  18.139  -4.149   8.290
  460    H    GLY  63           H        GLY  63  15.865  -5.423   6.087
  461    HA2  GLY  63           1HA      GLY  63  16.124  -3.073   4.280
  462    HA3  GLY  63           2HA      GLY  63  15.874  -4.748   3.802
  463    H    THR  64           H        THR  64  14.144  -3.615   2.541
  464    HA   THR  64           HA       THR  64  11.595  -3.793   3.998
  465    HB   THR  64           HB       THR  64  10.758  -1.689   3.062
  466    HG1  THR  64           HG1      THR  64  11.685  -0.882   1.389
  467   HG21  THR  64          3HG2      THR  64  12.178  -1.578   5.186
  468   HG22  THR  64          1HG2      THR  64  12.134  -0.079   4.254
  469   HG23  THR  64          2HG2      THR  64  13.541  -1.130   4.158
  470    H    GLY  65           H        GLY  65   9.830  -3.229   2.142
  471    HA2  GLY  65           1HA      GLY  65  10.512  -4.695  -0.357
  472    HA3  GLY  65           2HA      GLY  65   9.202  -5.294   0.651
  473    H    LEU  66           H        LEU  66   9.194  -4.218  -2.090
  474    HA   LEU  66           HA       LEU  66   7.013  -2.258  -1.726
  475    HB2  LEU  66           1HB      LEU  66   9.543  -1.839  -3.322
  476    HB3  LEU  66           2HB      LEU  66   8.064  -1.116  -3.941
  477    HG   LEU  66           HG       LEU  66   9.004  -0.617  -1.062
  478   HD11  LEU  66          1HD1      LEU  66   9.614   1.059  -3.531
  479   HD12  LEU  66          2HD1      LEU  66  10.796   0.146  -2.587
  480   HD13  LEU  66          3HD1      LEU  66   9.971   1.524  -1.864
  481   HD21  LEU  66          3HD2      LEU  66   7.135   0.936  -2.930
  482   HD22  LEU  66          1HD2      LEU  66   7.575   1.438  -1.299
  483   HD23  LEU  66          2HD2      LEU  66   6.622  -0.011  -1.539
  484    H    ALA  67           H        ALA  67   5.292  -2.851  -2.715
  485    HA   ALA  67           HA       ALA  67   5.371  -4.823  -4.933
  486    HB1  ALA  67           3HB      ALA  67   3.215  -4.101  -2.915
  487    HB2  ALA  67           1HB      ALA  67   4.180  -5.577  -2.929
  488    HB3  ALA  67           2HB      ALA  67   3.020  -5.273  -4.223
  489    H    ARG  68           H        ARG  68   3.770  -4.550  -6.583
  490    HA   ARG  68           HA       ARG  68   2.973  -1.703  -7.072
  491    HB2  ARG  68           1HB      ARG  68   4.980  -2.502  -8.445
  492    HB3  ARG  68           2HB      ARG  68   3.904  -3.650  -9.237
  493    HG2  ARG  68           1HG      ARG  68   2.444  -1.731  -9.947
  494    HG3  ARG  68           2HG      ARG  68   3.583  -0.609  -9.213
  495    HD2  ARG  68           1HD      ARG  68   4.234  -2.542 -11.468
  496    HD3  ARG  68           2HD      ARG  68   3.949  -0.815 -11.667
  497    HE   ARG  68           HE       ARG  68   6.375  -2.063 -10.750
  498   HH11  ARG  68          1HH2      ARG  68   4.419   0.798 -10.488
  499   HH12  ARG  68          2HH2      ARG  68   5.727   1.801  -9.955
  500   HH21  ARG  68          1HH1      ARG  68   8.075  -0.745 -10.071
  501   HH22  ARG  68          2HH1      ARG  68   7.794   0.928  -9.723
  502    H    VAL  69           H        VAL  69   0.879  -1.489  -7.248
  503    HA   VAL  69           HA       VAL  69  -0.774  -3.612  -8.511
  504    HB   VAL  69           HB       VAL  69  -1.507  -2.187  -5.905
  505   HG11  VAL  69          1HG1      VAL  69  -3.479  -2.766  -7.292
  506   HG12  VAL  69          2HG1      VAL  69  -3.398  -3.818  -5.883
  507   HG13  VAL  69          3HG1      VAL  69  -2.885  -4.419  -7.460
  508   HG21  VAL  69          3HG2      VAL  69  -1.239  -4.463  -4.877
  509   HG22  VAL  69          1HG2      VAL  69   0.284  -3.817  -5.484
  510   HG23  VAL  69          2HG2      VAL  69  -0.578  -5.050  -6.404
  511    H    GLN  70           H        GLN  70  -2.224  -2.850  -9.875
  512    HA   GLN  70           HA       GLN  70  -2.424   0.095 -10.275
  513    HB2  GLN  70           1HB      GLN  70  -3.292  -2.185 -12.107
  514    HB3  GLN  70           2HB      GLN  70  -3.293  -0.463 -12.492
  515    HG2  GLN  70           1HG      GLN  70  -1.275  -1.354 -13.473
  516    HG3  GLN  70           2HG      GLN  70  -0.754  -0.469 -12.042
  517   HE21  GLN  70          2HE2      GLN  70   0.475  -1.652 -10.529
  518   HE22  GLN  70          1HE2      GLN  70   0.673  -3.338 -10.565
  519    H    TRP  71           H        TRP  71  -4.339   1.171 -10.088
  520    HA   TRP  71           HA       TRP  71  -6.856  -0.323  -9.727
  521    HB2  TRP  71           1HB      TRP  71  -5.906   0.048  -7.431
  522    HB3  TRP  71           2HB      TRP  71  -5.884   1.777  -7.732
  523    HD1  TRP  71           HD1      TRP  71  -8.504  -1.080  -7.969
  524    HE1  TRP  71           HE1      TRP  71 -10.773  -0.166  -7.181
  525    HE3  TRP  71           HE3      TRP  71  -7.182   3.725  -6.906
  526    HZ2  TRP  71           HZ2      TRP  71 -11.892   2.301  -6.248
  527    HZ3  TRP  71           HZ3      TRP  71  -8.860   5.346  -6.082
  528    HH2  TRP  71           HH2      TRP  71 -11.213   4.643  -5.751
  529    H    LYS  72           H        LYS  72  -8.628   0.758 -10.376
  530    HA   LYS  72           HA       LYS  72  -8.244   3.410 -11.706
  531    HB2  LYS  72           1HB      LYS  72  -8.722   1.483 -13.225
  532    HB3  LYS  72           2HB      LYS  72 -10.250   1.227 -12.386
  533    HG2  LYS  72           1HG      LYS  72 -11.045   3.469 -13.062
  534    HG3  LYS  72           2HG      LYS  72  -9.477   3.842 -13.775
  535    HD2  LYS  72           1HD      LYS  72 -11.045   3.224 -15.549
  536    HD3  LYS  72           2HD      LYS  72  -9.790   1.994 -15.419
  537    HE2  LYS  72           1HE      LYS  72 -12.385   1.584 -13.885
  538    HE3  LYS  72           2HE      LYS  72 -12.338   1.240 -15.613
  539    HZ1  LYS  72           3HZ      LYS  72 -11.270  -0.268 -13.470
  540    HZ2  LYS  72           1HZ      LYS  72 -10.046   0.123 -14.578
  541    HZ3  LYS  72           2HZ      LYS  72 -11.440  -0.690 -15.106
  542    H    ALA  73           H        ALA  73  -9.354   5.053 -10.915
  543    HA   ALA  73           HA       ALA  73 -11.117   4.750  -8.659
  544    HB1  ALA  73           3HB      ALA  73 -11.418   7.202  -8.866
  545    HB2  ALA  73           1HB      ALA  73 -10.576   7.171 -10.415
  546    HB3  ALA  73           2HB      ALA  73  -9.714   6.752  -8.940
  547    H    THR  74           H        THR  74 -13.171   4.084  -8.787
  548    HA   THR  74           HA       THR  74 -14.745   4.478 -11.298
  549    HB   THR  74           HB       THR  74 -16.124   2.647 -10.537
  550    HG1  THR  74           HG1      THR  74 -14.621   2.828  -8.139
  551   HG21  THR  74          3HG2      THR  74 -14.512   0.816 -10.426
  552   HG22  THR  74          1HG2      THR  74 -13.254   1.908  -9.854
  553   HG23  THR  74          2HG2      THR  74 -13.854   2.045 -11.508
  554    H    ARG  75           H        ARG  75 -16.132   6.113 -11.272
  555    HA   ARG  75           HA       ARG  75 -18.033   6.539  -9.182
  556    HB2  ARG  75           1HB      ARG  75 -16.050   7.562  -8.073
  557    HB3  ARG  75           2HB      ARG  75 -15.844   8.652  -9.435
  558    HG2  ARG  75           1HG      ARG  75 -18.003   9.712  -8.981
  559    HG3  ARG  75           2HG      ARG  75 -18.374   8.529  -7.725
  560    HD2  ARG  75           1HD      ARG  75 -16.068  10.511  -7.635
  561    HD3  ARG  75           2HD      ARG  75 -17.593  10.693  -6.772
  562    HE   ARG  75           HE       ARG  75 -16.529   8.190  -6.083
  563   HH11  ARG  75          1HH2      ARG  75 -15.713  11.559  -5.733
  564   HH12  ARG  75          2HH2      ARG  75 -14.907  11.332  -4.218
  565   HH21  ARG  75          1HH1      ARG  75 -15.474   7.921  -4.109
  566   HH22  ARG  75          2HH1      ARG  75 -14.787   9.285  -3.297
  567    H    LYS  76           H        LYS  76 -19.761   7.009 -10.381
  568    HA   LYS  76           HA       LYS  76 -19.589   9.067 -12.548
  569    HB2  LYS  76           1HB      LYS  76 -21.065   6.399 -12.707
  570    HB3  LYS  76           2HB      LYS  76 -21.133   7.689 -13.915
  571    HG2  LYS  76           1HG      LYS  76 -18.677   7.508 -14.234
  572    HG3  LYS  76           2HG      LYS  76 -18.632   6.194 -13.058
  573    HD2  LYS  76           1HD      LYS  76 -20.156   4.854 -14.520
  574    HD3  LYS  76           2HD      LYS  76 -20.138   6.160 -15.707
  575    HE2  LYS  76           1HE      LYS  76 -17.712   4.575 -14.768
  576    HE3  LYS  76           2HE      LYS  76 -18.503   4.419 -16.337
  577    HZ1  LYS  76           3HZ      LYS  76 -18.017   7.075 -16.161
  578    HZ2  LYS  76           1HZ      LYS  76 -17.045   5.959 -16.989
  579    HZ3  LYS  76           2HZ      LYS  76 -16.649   6.411 -15.401
  580    H    LEU  77           H        LEU  77 -20.490  10.612 -11.248
  581    HA   LEU  77           HA       LEU  77 -23.228  10.145 -10.198
  582    HB2  LEU  77           1HB      LEU  77 -21.332  12.465  -9.617
  583    HB3  LEU  77           2HB      LEU  77 -22.835  12.086  -8.773
  584    HG   LEU  77           HG       LEU  77 -20.322  10.369  -8.787
  585   HD11  LEU  77          1HD1      LEU  77 -21.573  12.017  -6.561
  586   HD12  LEU  77          2HD1      LEU  77 -20.093  12.430  -7.431
  587   HD13  LEU  77          3HD1      LEU  77 -20.140  10.999  -6.403
  588   HD21  LEU  77          3HD2      LEU  77 -22.121   8.820  -8.544
  589   HD22  LEU  77          1HD2      LEU  77 -23.053   9.917  -7.523
  590   HD23  LEU  77          2HD2      LEU  77 -21.604   9.126  -6.896
  591    H    ALA  78           H        ALA  78 -23.980  12.832 -10.096
  592    HA   ALA  78           HA       ALA  78 -23.830  14.046 -12.719
  593    HB1  ALA  78           3HB      ALA  78 -25.385  12.176 -13.197
  594    HB2  ALA  78           1HB      ALA  78 -26.204  13.734 -13.319
  595    HB3  ALA  78           2HB      ALA  78 -26.441  12.719 -11.894
  596    H    GLY  79           H        GLY  79 -23.078  15.446 -10.798
  597    HA2  GLY  79           1HA      GLY  79 -24.825  17.619 -10.529
  598    HA3  GLY  79           2HA      GLY  79 -24.935  16.669  -9.047
  599    H    ARG  80           H        ARG  80 -24.052  18.555  -7.985
  600    HA   ARG  80           HA       ARG  80 -21.490  19.644  -8.550
  601    HB2  ARG  80           1HB      ARG  80 -21.645  20.570  -6.229
  602    HB3  ARG  80           2HB      ARG  80 -23.105  20.857  -7.175
  603    HG2  ARG  80           1HG      ARG  80 -24.208  18.915  -6.095
  604    HG3  ARG  80           2HG      ARG  80 -22.757  18.606  -5.146
  605    HD2  ARG  80           1HD      ARG  80 -24.384  21.171  -5.032
  606    HD3  ARG  80           2HD      ARG  80 -24.465  19.871  -3.845
  607    HE   ARG  80           HE       ARG  80 -22.418  21.885  -4.047
  608   HH11  ARG  80          1HH2      ARG  80 -23.028  18.585  -3.112
  609   HH12  ARG  80          2HH2      ARG  80 -21.675  18.510  -2.034
  610   HH21  ARG  80          1HH1      ARG  80 -20.662  21.768  -2.635
  611   HH22  ARG  80          2HH1      ARG  80 -20.339  20.306  -1.766
  612    H    ALA  81           H        ALA  81 -19.693  19.541  -6.828
  613    HA   ALA  81           HA       ALA  81 -19.310  17.094  -5.362
  614    HB1  ALA  81           3HB      ALA  81 -18.963  16.229  -7.656
  615    HB2  ALA  81           1HB      ALA  81 -17.464  16.182  -6.728
  616    HB3  ALA  81           2HB      ALA  81 -17.722  17.445  -7.934
  617    H    ALA  82           H        ALA  82 -18.005  17.588  -3.718
  618    HA   ALA  82           HA       ALA  82 -15.566  19.094  -3.969
  619    HB1  ALA  82           3HB      ALA  82 -17.903  20.452  -2.568
  620    HB2  ALA  82           1HB      ALA  82 -17.175  20.977  -4.085
  621    HB3  ALA  82           2HB      ALA  82 -16.237  21.041  -2.593
  622    H    ASN  83           H        ASN  83 -16.955  16.636  -2.755
  623    HA   ASN  83           HA       ASN  83 -15.427  16.622  -0.245
  624    HB2  ASN  83           1HB      ASN  83 -18.427  16.134  -0.313
  625    HB3  ASN  83           2HB      ASN  83 -17.381  15.890   1.082
  626   HD21  ASN  83          2HD2      ASN  83 -16.106  17.983   1.753
  627   HD22  ASN  83          1HD2      ASN  83 -16.959  19.446   1.635
  628    HA   PRO  84           HA       PRO  84 -15.893  12.621  -2.776
  629    HB2  PRO  84           1HB      PRO  84 -13.218  12.316  -3.496
  630    HB3  PRO  84           2HB      PRO  84 -14.390  13.218  -4.483
  631    HG2  PRO  84           1HG      PRO  84 -12.409  14.306  -2.483
  632    HG3  PRO  84           2HG      PRO  84 -12.754  14.873  -4.129
  633    HD2  PRO  84           1HD      PRO  84 -13.858  16.126  -2.000
  634    HD3  PRO  84           2HD      PRO  84 -14.804  15.902  -3.487
  635    H    GLY  85           H        GLY  85 -12.787  13.221  -1.111
  636    HA2  GLY  85           1HA      GLY  85 -11.790  12.184   0.693
  637    HA3  GLY  85           2HA      GLY  85 -13.410  11.789   1.266
  638    H    VAL  86           H        VAL  86 -10.823  10.769  -0.916
  639    HA   VAL  86           HA       VAL  86 -11.766   7.926  -0.764
  640    HB   VAL  86           HB       VAL  86 -10.610   7.693  -3.024
  641   HG11  VAL  86          1HG1      VAL  86 -13.079   7.845  -2.841
  642   HG12  VAL  86          2HG1      VAL  86 -12.512   8.648  -4.303
  643   HG13  VAL  86          3HG1      VAL  86 -12.979   9.606  -2.895
  644   HG21  VAL  86          3HG2      VAL  86 -10.237   9.748  -4.348
  645   HG22  VAL  86          1HG2      VAL  86  -9.251   9.807  -2.895
  646   HG23  VAL  86          2HG2      VAL  86 -10.729  10.751  -2.986
  647    HA   PRO  87           HA       PRO  87  -7.432   8.513   1.026
  648    HB2  PRO  87           1HB      PRO  87  -7.896   7.334   3.483
  649    HB3  PRO  87           2HB      PRO  87  -8.246   9.056   3.182
  650    HG2  PRO  87           1HG      PRO  87 -10.156   6.713   2.959
  651    HG3  PRO  87           2HG      PRO  87 -10.349   8.200   3.921
  652    HD2  PRO  87           1HD      PRO  87 -11.516   8.078   1.541
  653    HD3  PRO  87           2HD      PRO  87 -10.626   9.561   1.954
  654    H    VAL  88           H        VAL  88  -5.977   6.748   1.680
  655    HA   VAL  88           HA       VAL  88  -6.791   4.067   0.598
  656    HB   VAL  88           HB       VAL  88  -4.418   3.848  -0.143
  657   HG11  VAL  88          1HG1      VAL  88  -6.119   4.669  -1.740
  658   HG12  VAL  88          2HG1      VAL  88  -4.571   5.440  -2.051
  659   HG13  VAL  88          3HG1      VAL  88  -5.843   6.327  -1.211
  660   HG21  VAL  88          3HG2      VAL  88  -3.332   5.403   1.447
  661   HG22  VAL  88          1HG2      VAL  88  -4.209   6.768   0.749
  662   HG23  VAL  88          2HG2      VAL  88  -3.000   5.915  -0.201
  663    H    TYR  89           H        TYR  89  -5.697   2.263   1.503
  664    HA   TYR  89           HA       TYR  89  -4.253   2.577   4.034
  665    HB2  TYR  89           1HB      TYR  89  -6.997   1.247   3.879
  666    HB3  TYR  89           2HB      TYR  89  -5.889   1.037   5.235
  667    HD1  TYR  89           HD1      TYR  89  -5.139   3.073   6.583
  668    HD2  TYR  89           HD2      TYR  89  -8.358   3.297   3.718
  669    HE1  TYR  89           HE1      TYR  89  -5.903   5.207   7.591
  670    HE2  TYR  89           HE2      TYR  89  -9.106   5.418   4.751
  671    HH   TYR  89           HH       TYR  89  -8.184   6.482   7.710
  672    H    ALA  90           H        ALA  90  -3.085   0.801   4.585
  673    HA   ALA  90           HA       ALA  90  -3.243  -1.652   2.908
  674    HB1  ALA  90           3HB      ALA  90  -0.720  -0.009   3.369
  675    HB2  ALA  90           1HB      ALA  90  -1.592  -0.140   1.842
  676    HB3  ALA  90           2HB      ALA  90  -0.807  -1.563   2.532
  677    H    VAL  91           H        VAL  91  -2.608  -3.472   3.943
  678    HA   VAL  91           HA       VAL  91  -1.600  -3.270   6.749
  679    HB   VAL  91           HB       VAL  91  -3.828  -5.118   5.777
  680   HG11  VAL  91          1HG1      VAL  91  -4.023  -5.666   8.229
  681   HG12  VAL  91          2HG1      VAL  91  -2.587  -4.694   8.539
  682   HG13  VAL  91          3HG1      VAL  91  -2.465  -6.161   7.571
  683   HG21  VAL  91          3HG2      VAL  91  -4.590  -2.764   5.983
  684   HG22  VAL  91          1HG2      VAL  91  -3.909  -2.676   7.609
  685   HG23  VAL  91          2HG2      VAL  91  -5.267  -3.749   7.280
  686    H    VAL  92           H        VAL  92  -0.098  -4.695   7.296
  687    HA   VAL  92           HA       VAL  92   1.024  -6.406   5.181
  688    HB   VAL  92           HB       VAL  92   2.172  -5.836   7.963
  689   HG11  VAL  92          1HG1      VAL  92   3.141  -7.764   6.684
  690   HG12  VAL  92          2HG1      VAL  92   4.297  -6.464   6.874
  691   HG13  VAL  92          3HG1      VAL  92   3.469  -6.688   5.333
  692   HG21  VAL  92          3HG2      VAL  92   3.513  -4.048   6.853
  693   HG22  VAL  92          1HG2      VAL  92   1.793  -3.673   6.814
  694   HG23  VAL  92          2HG2      VAL  92   2.597  -4.286   5.366
  695    H    ASP  93           H        ASP  93   0.972  -8.588   5.265
  696    HA   ASP  93           HA       ASP  93  -0.111  -9.960   7.710
  697    HB2  ASP  93           1HB      ASP  93  -0.642 -10.599   4.794
  698    HB3  ASP  93           2HB      ASP  93  -1.261 -11.498   6.179
  699    HA   PRO  94           HA       PRO  94   4.105 -11.648   6.582
  700    HB2  PRO  94           1HB      PRO  94   4.149 -12.059   9.590
  701    HB3  PRO  94           2HB      PRO  94   5.433 -11.419   8.534
  702    HG2  PRO  94           1HG      PRO  94   4.073  -9.743  10.076
  703    HG3  PRO  94           2HG      PRO  94   4.406  -9.294   8.384
  704    HD2  PRO  94           1HD      PRO  94   1.833 -10.456   9.527
  705    HD3  PRO  94           2HD      PRO  94   2.044  -9.044   8.473
  706    H    ASP  95           H        ASP  95   5.044 -13.853   7.403
  707    HA   ASP  95           HA       ASP  95   3.179 -15.900   6.769
  708    HB2  ASP  95           1HB      ASP  95   5.624 -16.057   6.347
  709    HB3  ASP  95           2HB      ASP  95   5.920 -16.126   8.081
  710    H    ASN  96           H        ASN  96   4.522 -14.719   9.831
  711    HA   ASN  96           HA       ASN  96   2.693 -16.492  11.393
  712    HB2  ASN  96           1HB      ASN  96   5.250 -15.067  12.224
  713    HB3  ASN  96           2HB      ASN  96   4.279 -16.132  13.243
  714   HD21  ASN  96          2HD2      ASN  96   4.066 -18.454  12.427
  715   HD22  ASN  96          1HD2      ASN  96   5.368 -19.115  11.560
  716    H    ARG  97           H        ARG  97   1.134 -14.707  10.556
  717    HA   ARG  97           HA       ARG  97   1.178 -12.117  11.733
  718    HB2  ARG  97           1HB      ARG  97  -1.379 -12.232  11.214
  719    HB3  ARG  97           2HB      ARG  97  -0.273 -12.353   9.850
  720    HG2  ARG  97           1HG      ARG  97  -0.504 -14.792   9.792
  721    HG3  ARG  97           2HG      ARG  97  -1.493 -14.782  11.239
  722    HD2  ARG  97           1HD      ARG  97  -3.225 -13.480  10.062
  723    HD3  ARG  97           2HD      ARG  97  -2.233 -13.466   8.604
  724    HE   ARG  97           HE       ARG  97  -3.859 -15.652   9.561
  725   HH11  ARG  97          1HH2      ARG  97  -0.971 -14.850   7.793
  726   HH12  ARG  97          2HH2      ARG  97  -0.923 -16.352   6.932
  727   HH21  ARG  97          1HH1      ARG  97  -3.776 -17.622   8.427
  728   HH22  ARG  97          2HH1      ARG  97  -2.502 -17.913   7.291
  729    H    VAL  98           H        VAL  98   1.536 -12.122  13.927
  730    HA   VAL  98           HA       VAL  98  -0.603 -13.259  15.675
  731    HB   VAL  98           HB       VAL  98   2.397 -13.334  16.229
  732   HG11  VAL  98          1HG1      VAL  98   1.222 -13.074  18.349
  733   HG12  VAL  98          2HG1      VAL  98   1.627 -14.778  18.213
  734   HG13  VAL  98          3HG1      VAL  98  -0.016 -14.238  17.877
  735   HG21  VAL  98          3HG2      VAL  98   2.104 -15.810  16.066
  736   HG22  VAL  98          1HG2      VAL  98   1.723 -15.016  14.542
  737   HG23  VAL  98          2HG2      VAL  98   0.421 -15.573  15.594
  738    H    ALA  99           H        ALA  99  -0.785 -12.210  17.722
  739    HA   ALA  99           HA       ALA  99  -1.157 -10.366  18.990
  740    HB1  ALA  99           3HB      ALA  99   1.540  -9.485  17.904
  741    HB2  ALA  99           1HB      ALA  99   1.285 -10.481  19.328
  742    HB3  ALA  99           2HB      ALA  99   0.730  -8.808  19.309
  743    H    GLU 100           H        GLU 100  -2.859  -9.235  18.280
  744    HA   GLU 100           HA       GLU 100  -2.982  -7.937  15.709
  745    HB2  GLU 100           1HB      GLU 100  -4.977  -8.840  16.905
  746    HB3  GLU 100           2HB      GLU 100  -4.814  -7.573  18.119
  747    HG2  GLU 100           1HG      GLU 100  -5.143  -5.841  16.359
  748    HG3  GLU 100           2HG      GLU 100  -5.272  -7.106  15.141
  749    H    SER 101           H        SER 101  -3.225  -6.535  18.977
  750    HA   SER 101           HA       SER 101  -3.003  -3.866  18.461
  751    HB2  SER 101           1HB      SER 101  -2.012  -3.614  20.682
  752    HB3  SER 101           2HB      SER 101  -3.183  -4.934  20.725
  753    HG   SER 101           HG       SER 101  -1.454  -5.860  21.596
  754    H    ASP 102           H        ASP 102  -0.376  -6.220  18.299
  755    HA   ASP 102           HA       ASP 102   1.792  -4.389  18.005
  756    HB2  ASP 102           1HB      ASP 102   2.046  -6.812  18.587
  757    HB3  ASP 102           2HB      ASP 102   1.540  -7.240  16.956
  758    H    LYS 103           H        LYS 103   0.228  -6.448  15.515
  759    HA   LYS 103           HA       LYS 103   1.334  -5.423  13.220
  760    HB2  LYS 103           1HB      LYS 103  -0.329  -7.293  13.310
  761    HB3  LYS 103           2HB      LYS 103  -1.610  -6.109  13.543
  762    HG2  LYS 103           1HG      LYS 103  -1.099  -5.101  11.326
  763    HG3  LYS 103           2HG      LYS 103   0.250  -6.211  11.129
  764    HD2  LYS 103           1HD      LYS 103  -1.607  -7.073   9.834
  765    HD3  LYS 103           2HD      LYS 103  -1.384  -8.141  11.212
  766    HE2  LYS 103           1HE      LYS 103  -3.816  -7.525  10.670
  767    HE3  LYS 103           2HE      LYS 103  -3.343  -7.213  12.331
  768    HZ1  LYS 103           3HZ      LYS 103  -4.561  -5.418  10.876
  769    HZ2  LYS 103           1HZ      LYS 103  -2.981  -5.061  10.377
  770    HZ3  LYS 103           2HZ      LYS 103  -3.390  -4.973  12.022
  771    H    ALA 104           H        ALA 104  -1.375  -4.009  15.031
  772    HA   ALA 104           HA       ALA 104  -2.048  -1.883  13.320
  773    HB1  ALA 104           3HB      ALA 104  -2.989  -0.782  15.306
  774    HB2  ALA 104           1HB      ALA 104  -2.063  -1.852  16.361
  775    HB3  ALA 104           2HB      ALA 104  -3.345  -2.509  15.348
  776    H    ASN 105           H        ASN 105   0.954  -2.439  14.530
  777    HA   ASN 105           HA       ASN 105   1.752   0.390  14.933
  778    HB2  ASN 105           1HB      ASN 105   3.442  -2.135  15.190
  779    HB3  ASN 105           2HB      ASN 105   3.921  -0.501  15.633
  780   HD21  ASN 105          2HD2      ASN 105   1.029  -0.046  16.686
  781   HD22  ASN 105          1HD2      ASN 105   1.046  -0.806  18.204
  782    H    ASN 106           H        ASN 106   0.857  -0.585  12.320
  783    HA   ASN 106           HA       ASN 106   3.060   0.422  10.709
  784    HB2  ASN 106           1HB      ASN 106   2.058  -2.439  10.393
  785    HB3  ASN 106           2HB      ASN 106   3.066  -1.609   9.211
  786   HD21  ASN 106          2HD2      ASN 106   5.121  -0.501  10.503
  787   HD22  ASN 106          1HD2      ASN 106   5.940  -1.608  11.497
  788    H    VAL 107           H        VAL 107   0.583   1.536  11.201
  789    HA   VAL 107           HA       VAL 107  -1.118   0.940   8.833
  790    HB   VAL 107           HB       VAL 107  -1.653   2.868  11.143
  791   HG11  VAL 107          1HG1      VAL 107  -2.979   3.329   9.086
  792   HG12  VAL 107          2HG1      VAL 107  -4.011   2.680  10.353
  793   HG13  VAL 107          3HG1      VAL 107  -3.486   1.640   9.029
  794   HG21  VAL 107          3HG2      VAL 107  -2.558  -0.020  10.743
  795   HG22  VAL 107          1HG2      VAL 107  -3.109   1.053  12.031
  796   HG23  VAL 107          2HG2      VAL 107  -1.427   0.541  11.976
  797    H    PHE 108           H        PHE 108  -0.249   1.883   7.078
  798    HA   PHE 108           HA       PHE 108   0.642   4.735   7.198
  799    HB2  PHE 108           1HB      PHE 108   1.255   2.577   5.146
  800    HB3  PHE 108           2HB      PHE 108   1.922   4.206   5.182
  801    HD1  PHE 108           HD2      PHE 108   3.129   4.950   7.405
  802    HD2  PHE 108           HD1      PHE 108   2.473   0.824   6.329
  803    HE1  PHE 108           HE2      PHE 108   4.937   4.252   8.948
  804    HE2  PHE 108           HE1      PHE 108   4.276   0.142   7.883
  805    HZ   PHE 108           HZ       PHE 108   5.510   1.852   9.189
  806    H    SER 109           H        SER 109  -0.501   6.209   6.125
  807    HA   SER 109           HA       SER 109  -2.086   5.641   3.765
  808    HB2  SER 109           1HB      SER 109  -3.707   4.833   5.353
  809    HB3  SER 109           2HB      SER 109  -3.405   6.181   6.441
  810    HG   SER 109           HG       SER 109  -4.425   7.535   5.057
  811    H    ARG 110           H        ARG 110  -2.567   7.487   2.657
  812    HA   ARG 110           HA       ARG 110  -1.946  10.127   3.914
  813    HB2  ARG 110           1HB      ARG 110   0.005   9.316   2.575
  814    HB3  ARG 110           2HB      ARG 110  -1.025   9.232   1.149
  815    HG2  ARG 110           1HG      ARG 110  -1.481  11.692   1.355
  816    HG3  ARG 110           2HG      ARG 110  -0.435  11.751   2.768
  817    HD2  ARG 110           1HD      ARG 110   1.466  10.955   1.349
  818    HD3  ARG 110           2HD      ARG 110   0.396  11.011  -0.058
  819    HE   ARG 110           HE       ARG 110   0.415  13.513   1.351
  820   HH11  ARG 110          1HH2      ARG 110   2.307  11.559  -0.823
  821   HH12  ARG 110          2HH2      ARG 110   3.109  12.914  -1.543
  822   HH21  ARG 110          1HH1      ARG 110   1.481  15.266   0.411
  823   HH22  ARG 110          2HH1      ARG 110   2.643  15.004  -0.846
  824    H    ILE 111           H        ILE 111  -3.416  11.621   3.533
  825    HA   ILE 111           HA       ILE 111  -5.770  10.997   1.929
  826    HB   ILE 111           HB       ILE 111  -4.984  13.346   3.721
  827   HG12  ILE 111          1HG1      ILE 111  -6.902  12.561   5.093
  828   HG13  ILE 111          2HG1      ILE 111  -7.258  11.310   3.908
  829   HG21  ILE 111          1HG2      ILE 111  -7.456  13.094   1.937
  830   HG22  ILE 111          2HG2      ILE 111  -6.311  14.435   1.985
  831   HG23  ILE 111          3HG2      ILE 111  -7.406  14.169   3.336
  832   HD11  ILE 111          3HD1      ILE 111  -5.362  10.049   4.481
  833   HD12  ILE 111          1HD1      ILE 111  -5.916  10.663   6.034
  834   HD13  ILE 111          2HD1      ILE 111  -4.536  11.418   5.238
  835    H    VAL 112           H        VAL 112  -6.266  11.810  -0.016
  836    HA   VAL 112           HA       VAL 112  -4.593  13.937  -1.252
  837    HB   VAL 112           HB       VAL 112  -4.492  12.560  -3.378
  838   HG11  VAL 112          1HG1      VAL 112  -2.541  12.696  -1.829
  839   HG12  VAL 112          2HG1      VAL 112  -2.610  11.148  -2.654
  840   HG13  VAL 112          3HG1      VAL 112  -3.124  11.268  -0.974
  841   HG21  VAL 112          3HG2      VAL 112  -6.347  10.985  -2.856
  842   HG22  VAL 112          1HG2      VAL 112  -5.394  10.294  -1.541
  843   HG23  VAL 112          2HG2      VAL 112  -4.859  10.110  -3.213
  844    H    LYS 113           H        LYS 113  -5.632  15.214  -2.659
  845    HA   LYS 113           HA       LYS 113  -8.550  14.751  -3.089
  846    HB2  LYS 113           1HB      LYS 113  -8.106  16.535  -1.421
  847    HB3  LYS 113           2HB      LYS 113  -7.136  17.400  -2.612
  848    HG2  LYS 113           1HG      LYS 113  -9.087  17.737  -4.058
  849    HG3  LYS 113           2HG      LYS 113 -10.073  16.664  -3.065
  850    HD2  LYS 113           1HD      LYS 113 -10.617  19.028  -2.603
  851    HD3  LYS 113           2HD      LYS 113  -9.943  18.256  -1.171
  852    HE2  LYS 113           1HE      LYS 113  -7.845  19.410  -1.424
  853    HE3  LYS 113           2HE      LYS 113  -8.207  19.865  -3.095
  854    HZ1  LYS 113           3HZ      LYS 113 -10.020  21.249  -2.278
  855    HZ2  LYS 113           1HZ      LYS 113  -8.538  21.721  -1.602
  856    HZ3  LYS 113           2HZ      LYS 113  -9.645  20.827  -0.676
  857    H    VAL 114           H        VAL 114  -9.380  15.208  -5.039
  858    HA   VAL 114           HA       VAL 114  -7.498  15.902  -7.255
  859    HB   VAL 114           HB       VAL 114  -8.100  13.493  -7.178
  860   HG11  VAL 114          1HG1      VAL 114 -10.974  14.385  -7.674
  861   HG12  VAL 114          2HG1      VAL 114 -10.370  13.741  -6.148
  862   HG13  VAL 114          3HG1      VAL 114 -10.380  12.727  -7.589
  863   HG21  VAL 114          3HG2      VAL 114  -9.388  14.943  -9.538
  864   HG22  VAL 114          1HG2      VAL 114  -8.788  13.285  -9.525
  865   HG23  VAL 114          2HG2      VAL 114  -7.660  14.626  -9.368
  866    H    LEU 115           H        LEU 115  -8.149  17.393  -8.669
  867    HA   LEU 115           HA       LEU 115 -10.955  18.244  -8.817
  868    HB2  LEU 115           1HB      LEU 115  -9.747  19.567  -6.931
  869    HB3  LEU 115           2HB      LEU 115  -8.797  20.319  -8.203
  870    HG   LEU 115           HG       LEU 115 -11.248  20.839  -9.271
  871   HD11  LEU 115          1HD1      LEU 115 -12.495  19.573  -7.506
  872   HD12  LEU 115          2HD1      LEU 115 -12.957  21.268  -7.562
  873   HD13  LEU 115          3HD1      LEU 115 -11.880  20.691  -6.291
  874   HD21  LEU 115          3HD2      LEU 115 -10.122  22.423  -6.921
  875   HD22  LEU 115          1HD2      LEU 115 -11.278  23.038  -8.107
  876   HD23  LEU 115          2HD2      LEU 115  -9.647  22.604  -8.609
  877    H    GLU 116           H        GLU 116 -11.497  18.927 -10.779
  878    HA   GLU 116           HA       GLU 116  -9.642  20.062 -12.668
  879    HB2  GLU 116           1HB      GLU 116  -9.608  18.203 -14.282
  880    HB3  GLU 116           2HB      GLU 116  -8.933  17.682 -12.743
  881    HG2  GLU 116           1HG      GLU 116 -10.369  15.863 -13.295
  882    HG3  GLU 116           2HG      GLU 116 -11.375  16.804 -12.205
  883    H    HIS 117           H        HIS 117 -10.717  21.071 -14.308
  884    HA   HIS 117           HA       HIS 117 -13.583  21.356 -14.035
  885    HB2  HIS 117           1HB      HIS 117 -12.065  23.242 -14.672
  886    HB3  HIS 117           2HB      HIS 117 -11.746  22.453 -16.215
  887    HD1  HIS 117           HD1      HIS 117 -14.733  23.712 -14.194
  888    HD2  HIS 117           HD2      HIS 117 -13.627  23.091 -18.165
  889    HE1  HIS 117           HE1      HIS 117 -16.657  24.548 -15.611
  890    HE2  HIS 117           HE2      HIS 117 -16.000  24.177 -18.036
  891    H    HIS 118           H        HIS 118 -15.149  20.323 -15.165
  892    HA   HIS 118           HA       HIS 118 -14.563  18.036 -16.761
  893    HB2  HIS 118           1HB      HIS 118 -17.170  19.594 -16.469
  894    HB3  HIS 118           2HB      HIS 118 -17.012  17.966 -17.131
  895    HD1  HIS 118           HD1      HIS 118 -15.988  16.133 -15.397
  896    HD2  HIS 118           HD2      HIS 118 -17.412  19.664 -13.703
  897    HE1  HIS 118           HE1      HIS 118 -16.274  15.675 -12.923
  898    HE2  HIS 118           HE2      HIS 118 -17.140  17.818 -11.876
  899    H    HIS 119           H        HIS 119 -14.120  17.911 -18.873
  900    HA   HIS 119           HA       HIS 119 -13.680  18.544 -21.038
  901    HB2  HIS 119           1HB      HIS 119 -16.323  20.020 -20.699
  902    HB3  HIS 119           2HB      HIS 119 -15.570  19.594 -22.236
  903    HD1  HIS 119           HD1      HIS 119 -15.219  16.922 -22.621
  904    HD2  HIS 119           HD2      HIS 119 -17.916  18.012 -19.635
  905    HE1  HIS 119           HE1      HIS 119 -16.616  14.866 -22.134
  906    HE2  HIS 119           HE2      HIS 119 -18.265  15.515 -20.314
  907    H    HIS 120           H        HIS 120 -11.828  19.801 -20.664
  908    HA   HIS 120           HA       HIS 120 -11.790  22.494 -19.795
  909    HB2  HIS 120           1HB      HIS 120  -9.826  21.008 -21.588
  910    HB3  HIS 120           2HB      HIS 120  -9.495  22.533 -20.766
  911    HD1  HIS 120           HD1      HIS 120  -9.620  22.431 -18.064
  912    HD2  HIS 120           HD2      HIS 120  -9.387  18.753 -20.013
  913    HE1  HIS 120           HE1      HIS 120  -8.969  20.727 -16.305
  914    HE2  HIS 120           HE2      HIS 120  -8.822  18.481 -17.478
  915    H    HIS 121           H        HIS 121 -11.960  21.068 -23.037
  916    HA   HIS 121           HA       HIS 121 -12.455  21.937 -25.087
  917    HB2  HIS 121           1HB      HIS 121 -14.594  22.448 -23.885
  918    HB3  HIS 121           2HB      HIS 121 -13.970  24.043 -23.482
  919    HD1  HIS 121           HD1      HIS 121 -14.392  21.958 -26.659
  920    HD2  HIS 121           HD2      HIS 121 -14.728  25.908 -25.371
  921    HE1  HIS 121           HE1      HIS 121 -15.169  23.298 -28.661
  922    HE2  HIS 121           HE2      HIS 121 -15.378  25.709 -27.893
  923    H    HIS 122           H        HIS 122 -12.315  24.025 -26.475
  924    HA   HIS 122           HA       HIS 122 -10.680  26.197 -25.562
  925    HB2  HIS 122           1HB      HIS 122  -8.964  24.371 -25.669
  926    HB3  HIS 122           2HB      HIS 122  -9.345  24.125 -27.368
  927    HD1  HIS 122           HD1      HIS 122  -8.099  25.570 -29.006
  928    HD2  HIS 122           HD2      HIS 122  -7.933  27.115 -25.138
  929    HE1  HIS 122           HE1      HIS 122  -6.575  27.592 -29.107
  930    HE2  HIS 122           HE2      HIS 122  -6.465  28.546 -26.755
  Start of MODEL    9
    1    H1   MET   1           1H       MET   1  11.008  13.112   1.072
    2    H2   MET   1           2H       MET   1  10.185  14.080  -0.055
    3    H3   MET   1           3H       MET   1  10.656  12.502  -0.471
    4    HA   MET   1           HA       MET   1   8.411  13.421   1.152
    5    HB2  MET   1           1HB      MET   1   8.847  11.006  -0.666
    6    HB3  MET   1           2HB      MET   1   7.314  11.470   0.072
    7    HG2  MET   1           1HG      MET   1   7.236  12.309  -2.188
    8    HG3  MET   1           2HG      MET   1   7.542  13.719  -1.177
    9    HE1  MET   1           3HE      MET   1   8.049  13.408  -4.386
   10    HE2  MET   1           1HE      MET   1   9.476  14.452  -4.462
   11    HE3  MET   1           2HE      MET   1   8.131  14.869  -3.405
   12    H    ASP   2           H        ASP   2  10.027  10.266   0.725
   13    HA   ASP   2           HA       ASP   2  10.594   8.604   2.168
   14    HB2  ASP   2           1HB      ASP   2  10.636  10.693   4.395
   15    HB3  ASP   2           2HB      ASP   2  11.500   9.163   4.342
   16    H    LEU   3           H        LEU   3   7.774   9.518   1.758
   17    HA   LEU   3           HA       LEU   3   6.417   8.894   4.256
   18    HB2  LEU   3           1HB      LEU   3   5.590   9.795   1.507
   19    HB3  LEU   3           2HB      LEU   3   4.375   8.888   2.394
   20    HG   LEU   3           HG       LEU   3   4.575  10.504   4.296
   21   HD11  LEU   3          1HD1      LEU   3   6.847  11.286   4.047
   22   HD12  LEU   3          2HD1      LEU   3   5.802  12.682   3.847
   23   HD13  LEU   3          3HD1      LEU   3   6.528  11.915   2.433
   24   HD21  LEU   3          3HD2      LEU   3   3.453  12.405   3.166
   25   HD22  LEU   3          1HD2      LEU   3   2.858  10.863   2.554
   26   HD23  LEU   3          2HD2      LEU   3   4.007  11.805   1.603
   27    HA   PRO   4           HA       PRO   4   6.095   4.493   3.686
   28    HB2  PRO   4           1HB      PRO   4   3.681   3.887   4.909
   29    HB3  PRO   4           2HB      PRO   4   5.105   4.437   5.832
   30    HG2  PRO   4           1HG      PRO   4   2.793   6.087   4.797
   31    HG3  PRO   4           2HG      PRO   4   3.474   6.050   6.433
   32    HD2  PRO   4           1HD      PRO   4   4.199   8.004   4.738
   33    HD3  PRO   4           2HD      PRO   4   5.411   7.264   5.813
   34    H    ILE   5           H        ILE   5   3.580   6.555   2.424
   35    HA   ILE   5           HA       ILE   5   2.867   4.508   0.346
   36    HB   ILE   5           HB       ILE   5   1.020   6.590   1.601
   37   HG12  ILE   5          1HG1      ILE   5   0.973   3.535   1.841
   38   HG13  ILE   5          2HG1      ILE   5   1.592   4.604   3.092
   39   HG21  ILE   5          1HG2      ILE   5   0.508   4.424  -0.499
   40   HG22  ILE   5          2HG2      ILE   5   0.440   6.162  -0.777
   41   HG23  ILE   5          3HG2      ILE   5  -0.756   5.396   0.246
   42   HD11  ILE   5          3HD1      ILE   5  -0.722   3.921   3.563
   43   HD12  ILE   5          1HD1      ILE   5  -1.258   4.632   2.049
   44   HD13  ILE   5          2HD1      ILE   5  -0.605   5.663   3.321
   45    H    THR   6           H        THR   6   3.189   5.127  -1.678
   46    HA   THR   6           HA       THR   6   3.325   8.031  -2.389
   47    HB   THR   6           HB       THR   6   5.314   5.948  -3.394
   48    HG1  THR   6           HG1      THR   6   6.652   6.677  -1.890
   49   HG21  THR   6          3HG2      THR   6   6.528   7.944  -4.243
   50   HG22  THR   6          1HG2      THR   6   5.228   8.983  -3.660
   51   HG23  THR   6          2HG2      THR   6   4.925   7.838  -4.967
   52    H    LEU   7           H        LEU   7   1.975   8.476  -3.960
   53    HA   LEU   7           HA       LEU   7   0.977   6.316  -5.748
   54    HB2  LEU   7           1HB      LEU   7  -0.259   9.041  -5.237
   55    HB3  LEU   7           2HB      LEU   7  -0.978   7.680  -6.082
   56    HG   LEU   7           HG       LEU   7  -0.346   6.520  -3.582
   57   HD11  LEU   7          1HD1      LEU   7  -1.076   8.051  -1.825
   58   HD12  LEU   7          2HD1      LEU   7  -1.333   9.341  -3.002
   59   HD13  LEU   7          3HD1      LEU   7   0.298   8.756  -2.680
   60   HD21  LEU   7          3HD2      LEU   7  -2.810   6.798  -3.065
   61   HD22  LEU   7          1HD2      LEU   7  -2.471   6.170  -4.673
   62   HD23  LEU   7          2HD2      LEU   7  -2.930   7.854  -4.471
   63    H    SER   8           H        SER   8   0.922   6.607  -7.971
   64    HA   SER   8           HA       SER   8   2.987   8.334  -9.079
   65    HB2  SER   8           1HB      SER   8   2.483   7.171 -11.179
   66    HB3  SER   8           2HB      SER   8   2.656   6.008  -9.872
   67    HG   SER   8           HG       SER   8   0.769   5.375 -10.586
   68    H    LYS   9           H        LYS   9   0.721   9.680  -7.864
   69    HA   LYS   9           HA       LYS   9  -1.070  10.671  -9.868
   70    HB2  LYS   9           1HB      LYS   9  -1.681  12.316  -8.092
   71    HB3  LYS   9           2HB      LYS   9  -1.700  10.652  -7.502
   72    HG2  LYS   9           1HG      LYS   9   0.539  10.970  -6.495
   73    HG3  LYS   9           2HG      LYS   9   0.592  12.621  -7.072
   74    HD2  LYS   9           1HD      LYS   9  -1.410  13.183  -5.719
   75    HD3  LYS   9           2HD      LYS   9  -1.467  11.523  -5.122
   76    HE2  LYS   9           1HE      LYS   9   0.839  13.472  -4.708
   77    HE3  LYS   9           2HE      LYS   9  -0.338  12.998  -3.481
   78    HZ1  LYS   9           3HZ      LYS   9   1.665  11.698  -3.261
   79    HZ2  LYS   9           1HZ      LYS   9   1.566  11.197  -4.880
   80    HZ3  LYS   9           2HZ      LYS   9   0.390  10.692  -3.761
   81    H    GLU  10           H        GLU  10   1.333  10.855 -11.063
   82    HA   GLU  10           HA       GLU  10   2.924  13.107 -10.756
   83    HB2  GLU  10           1HB      GLU  10   2.061  11.758 -13.347
   84    HB3  GLU  10           2HB      GLU  10   3.436  12.854 -13.191
   85    HG2  GLU  10           1HG      GLU  10   4.484  11.300 -11.559
   86    HG3  GLU  10           2HG      GLU  10   3.115  10.204 -11.726
   87    H    THR  11           H        THR  11  -0.271  12.816 -12.124
   88    HA   THR  11           HA       THR  11  -0.435  15.775 -12.374
   89    HB   THR  11           HB       THR  11  -1.586  15.598 -14.513
   90    HG1  THR  11           HG1      THR  11  -1.874  13.060 -13.725
   91   HG21  THR  11          3HG2      THR  11   0.285  14.874 -15.900
   92   HG22  THR  11          1HG2      THR  11   0.901  13.840 -14.611
   93   HG23  THR  11          2HG2      THR  11   0.972  15.598 -14.445
   94    HA   PRO  12           HA       PRO  12  -4.268  14.840 -10.178
   95    HB2  PRO  12           1HB      PRO  12  -5.456  17.284 -10.071
   96    HB3  PRO  12           2HB      PRO  12  -3.925  16.985  -9.209
   97    HG2  PRO  12           1HG      PRO  12  -4.324  18.265 -11.921
   98    HG3  PRO  12           2HG      PRO  12  -3.366  18.862 -10.545
   99    HD2  PRO  12           1HD      PRO  12  -2.190  17.479 -12.620
  100    HD3  PRO  12           2HD      PRO  12  -1.594  17.338 -10.944
  101    H    PHE  13           H        PHE  13  -5.728  13.589 -11.271
  102    HA   PHE  13           HA       PHE  13  -7.753  14.787 -12.923
  103    HB2  PHE  13           1HB      PHE  13  -5.759  14.520 -14.531
  104    HB3  PHE  13           2HB      PHE  13  -5.949  12.782 -14.368
  105    HD1  PHE  13           HD2      PHE  13  -8.137  11.675 -15.099
  106    HD2  PHE  13           HD1      PHE  13  -7.342  15.837 -15.888
  107    HE1  PHE  13           HE2      PHE  13  -9.973  11.715 -16.760
  108    HE2  PHE  13           HE1      PHE  13  -9.189  15.869 -17.537
  109    HZ   PHE  13           HZ       PHE  13 -10.505  13.812 -17.974
  110    H    GLU  14           H        GLU  14  -9.331  13.829 -11.747
  111    HA   GLU  14           HA       GLU  14  -9.372  11.283 -10.617
  112    HB2  GLU  14           1HB      GLU  14 -11.840  11.551 -10.519
  113    HB3  GLU  14           2HB      GLU  14 -11.008  13.015 -10.002
  114    HG2  GLU  14           1HG      GLU  14 -12.147  12.606 -12.812
  115    HG3  GLU  14           2HG      GLU  14 -12.978  13.458 -11.527
  116    H    GLY  15           H        GLY  15 -10.290   9.287 -11.266
  117    HA2  GLY  15           1HA      GLY  15 -11.187   7.705 -12.734
  118    HA3  GLY  15           2HA      GLY  15 -11.163   8.875 -14.046
  119    H    GLU  16           H        GLU  16  -8.283   9.534 -13.242
  120    HA   GLU  16           HA       GLU  16  -7.000   7.745 -15.074
  121    HB2  GLU  16           1HB      GLU  16  -6.302  10.147 -14.656
  122    HB3  GLU  16           2HB      GLU  16  -5.672   9.656 -13.094
  123    HG2  GLU  16           1HG      GLU  16  -3.825   9.725 -14.697
  124    HG3  GLU  16           2HG      GLU  16  -4.126   8.044 -14.286
  125    H    GLU  17           H        GLU  17  -5.567   6.085 -14.694
  126    HA   GLU  17           HA       GLU  17  -5.980   4.582 -12.278
  127    HB2  GLU  17           1HB      GLU  17  -5.611   3.577 -14.553
  128    HB3  GLU  17           2HB      GLU  17  -3.934   4.111 -14.490
  129    HG2  GLU  17           1HG      GLU  17  -3.596   2.751 -12.419
  130    HG3  GLU  17           2HG      GLU  17  -5.271   2.212 -12.512
  131    H    ILE  18           H        ILE  18  -4.687   4.387 -10.535
  132    HA   ILE  18           HA       ILE  18  -2.114   5.927 -10.430
  133    HB   ILE  18           HB       ILE  18  -2.649   6.419  -8.057
  134   HG12  ILE  18          1HG1      ILE  18  -5.396   5.258  -8.714
  135   HG13  ILE  18          2HG1      ILE  18  -4.217   4.500  -7.656
  136   HG21  ILE  18          1HG2      ILE  18  -4.331   8.186  -8.515
  137   HG22  ILE  18          2HG2      ILE  18  -4.809   7.363  -9.995
  138   HG23  ILE  18          3HG2      ILE  18  -3.202   8.066  -9.859
  139   HD11  ILE  18          3HD1      ILE  18  -4.313   6.666  -6.248
  140   HD12  ILE  18          1HD1      ILE  18  -5.719   5.606  -6.196
  141   HD13  ILE  18          2HD1      ILE  18  -5.750   7.057  -7.188
  142    H    THR  19           H        THR  19  -0.436   5.028  -9.327
  143    HA   THR  19           HA       THR  19  -0.616   2.096  -8.871
  144    HB   THR  19           HB       THR  19   1.874   3.852  -9.005
  145    HG1  THR  19           HG1      THR  19   0.244   3.367 -10.916
  146   HG21  THR  19          3HG2      THR  19   2.210   1.651  -7.895
  147   HG22  THR  19          1HG2      THR  19   3.018   1.705  -9.462
  148   HG23  THR  19          2HG2      THR  19   1.488   0.848  -9.288
  149    H    VAL  20           H        VAL  20  -1.063   1.510  -6.858
  150    HA   VAL  20           HA       VAL  20  -0.276   3.245  -4.576
  151    HB   VAL  20           HB       VAL  20  -2.054   0.770  -4.601
  152   HG11  VAL  20          1HG1      VAL  20  -1.092   1.262  -2.364
  153   HG12  VAL  20          2HG1      VAL  20  -2.798   1.664  -2.384
  154   HG13  VAL  20          3HG1      VAL  20  -1.602   2.944  -2.503
  155   HG21  VAL  20          3HG2      VAL  20  -3.036   2.592  -5.968
  156   HG22  VAL  20          1HG2      VAL  20  -2.788   3.728  -4.643
  157   HG23  VAL  20          2HG2      VAL  20  -3.934   2.401  -4.466
  158    H    SER  21           H        SER  21   1.578   2.804  -3.580
  159    HA   SER  21           HA       SER  21   2.553  -0.021  -3.384
  160    HB2  SER  21           1HB      SER  21   4.259   2.454  -3.851
  161    HB3  SER  21           2HB      SER  21   4.816   0.803  -3.688
  162    HG   SER  21           HG       SER  21   3.889   0.282  -5.599
  163    H    ALA  22           H        ALA  22   3.048  -0.641  -1.389
  164    HA   ALA  22           HA       ALA  22   3.103   1.366   0.838
  165    HB1  ALA  22           3HB      ALA  22   2.415  -1.597   0.873
  166    HB2  ALA  22           1HB      ALA  22   1.255  -0.272   0.933
  167    HB3  ALA  22           2HB      ALA  22   2.385  -0.513   2.267
  168    H    ARG  23           H        ARG  23   4.971   1.617   1.906
  169    HA   ARG  23           HA       ARG  23   7.288  -0.051   1.241
  170    HB2  ARG  23           1HB      ARG  23   7.052   2.345   3.081
  171    HB3  ARG  23           2HB      ARG  23   8.558   1.561   2.611
  172    HG2  ARG  23           1HG      ARG  23   8.055   2.078   0.211
  173    HG3  ARG  23           2HG      ARG  23   6.590   2.919   0.717
  174    HD2  ARG  23           1HD      ARG  23   7.979   4.491   2.050
  175    HD3  ARG  23           2HD      ARG  23   9.434   3.669   1.508
  176    HE   ARG  23           HE       ARG  23   7.876   5.581   0.007
  177   HH11  ARG  23          1HH2      ARG  23   9.904   2.765  -0.287
  178   HH12  ARG  23          2HH2      ARG  23  10.395   3.131  -1.908
  179   HH21  ARG  23          1HH1      ARG  23   8.525   6.039  -2.118
  180   HH22  ARG  23          2HH1      ARG  23   9.619   4.974  -2.939
  181    H    VAL  24           H        VAL  24   7.734  -1.855   2.309
  182    HA   VAL  24           HA       VAL  24   6.796  -2.210   5.119
  183    HB   VAL  24           HB       VAL  24   7.670  -4.403   3.182
  184   HG11  VAL  24          1HG1      VAL  24   6.413  -5.864   4.734
  185   HG12  VAL  24          2HG1      VAL  24   6.015  -4.468   5.735
  186   HG13  VAL  24          3HG1      VAL  24   7.689  -4.994   5.588
  187   HG21  VAL  24          3HG2      VAL  24   5.736  -3.248   2.182
  188   HG22  VAL  24          1HG2      VAL  24   4.865  -3.332   3.716
  189   HG23  VAL  24          2HG2      VAL  24   5.226  -4.809   2.818
  190    H    THR  25           H        THR  25   8.344  -1.766   6.524
  191    HA   THR  25           HA       THR  25  11.190  -1.999   5.819
  192    HB   THR  25           HB       THR  25   9.883  -1.166   8.457
  193    HG1  THR  25           HG1      THR  25   9.292   0.378   7.124
  194   HG21  THR  25          3HG2      THR  25  12.693  -0.743   7.360
  195   HG22  THR  25          1HG2      THR  25  12.268  -1.780   8.724
  196   HG23  THR  25          2HG2      THR  25  12.067  -0.033   8.846
  197    H    ASN  26           H        ASN  26  12.478  -3.674   6.388
  198    HA   ASN  26           HA       ASN  26  11.299  -6.004   7.737
  199    HB2  ASN  26           1HB      ASN  26  12.665  -6.278   5.700
  200    HB3  ASN  26           2HB      ASN  26  14.072  -5.634   6.526
  201   HD21  ASN  26          2HD2      ASN  26  11.721  -8.337   6.601
  202   HD22  ASN  26          1HD2      ASN  26  12.747  -9.418   7.414
  203    H    ARG  27           H        ARG  27  11.237  -5.852   9.898
  204    HA   ARG  27           HA       ARG  27  13.476  -4.655  11.429
  205    HB2  ARG  27           1HB      ARG  27  10.715  -5.590  12.315
  206    HB3  ARG  27           2HB      ARG  27  11.860  -4.675  13.291
  207    HG2  ARG  27           1HG      ARG  27  10.568  -3.657  10.717
  208    HG3  ARG  27           2HG      ARG  27  10.032  -3.249  12.339
  209    HD2  ARG  27           1HD      ARG  27  12.335  -2.269  12.782
  210    HD3  ARG  27           2HD      ARG  27  12.695  -2.506  11.075
  211    HE   ARG  27           HE       ARG  27  11.401  -0.688  10.565
  212   HH11  ARG  27          1HH2      ARG  27  10.530  -1.811  13.749
  213   HH12  ARG  27          2HH2      ARG  27   9.461  -0.483  14.056
  214   HH21  ARG  27          1HH1      ARG  27   9.995   1.026  10.986
  215   HH22  ARG  27          2HH1      ARG  27   9.162   1.116  12.500
  216    H    GLY  28           H        GLY  28  12.989  -6.078  13.816
  217    HA2  GLY  28           1HA      GLY  28  13.504  -8.026  14.927
  218    HA3  GLY  28           2HA      GLY  28  13.314  -8.922  13.420
  219    H    ALA  29           H        ALA  29  15.171 -10.009  13.065
  220    HA   ALA  29           HA       ALA  29  17.664  -8.605  12.657
  221    HB1  ALA  29           3HB      ALA  29  18.948  -9.750  14.430
  222    HB2  ALA  29           1HB      ALA  29  17.466 -10.507  15.024
  223    HB3  ALA  29           2HB      ALA  29  17.666  -8.760  15.128
  224    H    ALA  30           H        ALA  30  15.686 -10.601  11.479
  225    HA   ALA  30           HA       ALA  30  17.720 -12.447  10.365
  226    HB1  ALA  30           3HB      ALA  30  16.583 -13.670  12.200
  227    HB2  ALA  30           1HB      ALA  30  16.186 -14.360  10.625
  228    HB3  ALA  30           2HB      ALA  30  15.021 -13.329  11.460
  229    H    GLU  31           H        GLU  31  17.171 -13.293   8.331
  230    HA   GLU  31           HA       GLU  31  15.824 -11.463   6.616
  231    HB2  GLU  31           1HB      GLU  31  17.702 -12.964   5.924
  232    HB3  GLU  31           2HB      GLU  31  16.619 -14.347   6.034
  233    HG2  GLU  31           1HG      GLU  31  15.152 -13.333   4.310
  234    HG3  GLU  31           2HG      GLU  31  16.218 -11.940   4.219
  235    H    ALA  32           H        ALA  32  13.675 -11.226   6.465
  236    HA   ALA  32           HA       ALA  32  11.825 -13.337   7.330
  237    HB1  ALA  32           3HB      ALA  32  11.446 -10.965   7.963
  238    HB2  ALA  32           1HB      ALA  32  10.104 -11.610   7.017
  239    HB3  ALA  32           2HB      ALA  32  11.286 -10.540   6.262
  240    H    HIS  33           H        HIS  33  10.198 -14.190   5.985
  241    HA   HIS  33           HA       HIS  33  10.441 -13.783   3.055
  242    HB2  HIS  33           1HB      HIS  33  11.857 -15.777   3.743
  243    HB3  HIS  33           2HB      HIS  33  10.391 -16.563   4.326
  244    HD1  HIS  33           HD1      HIS  33   9.034 -17.812   2.574
  245    HD2  HIS  33           HD2      HIS  33  11.713 -15.123   0.851
  246    HE1  HIS  33           HE1      HIS  33   8.880 -18.148   0.063
  247    HE2  HIS  33           HE2      HIS  33  10.500 -16.506  -0.996
  248    H    ASN  34           H        ASN  34   8.660 -14.931   1.907
  249    HA   ASN  34           HA       ASN  34   6.398 -14.916   1.483
  250    HB2  ASN  34           1HB      ASN  34   6.340 -16.170   4.249
  251    HB3  ASN  34           2HB      ASN  34   5.039 -16.254   3.060
  252   HD21  ASN  34          2HD2      ASN  34   7.211 -18.271   4.293
  253   HD22  ASN  34          1HD2      ASN  34   7.679 -19.143   2.915
  254    H    VAL  35           H        VAL  35   6.855 -12.452   1.856
  255    HA   VAL  35           HA       VAL  35   5.064 -11.390   4.007
  256    HB   VAL  35           HB       VAL  35   7.316  -9.932   2.570
  257   HG11  VAL  35          1HG1      VAL  35   5.660  -9.215   5.036
  258   HG12  VAL  35          2HG1      VAL  35   5.549  -8.428   3.464
  259   HG13  VAL  35          3HG1      VAL  35   7.019  -8.274   4.421
  260   HG21  VAL  35          3HG2      VAL  35   8.240 -11.746   3.974
  261   HG22  VAL  35          1HG2      VAL  35   7.236 -11.234   5.332
  262   HG23  VAL  35          2HG2      VAL  35   8.539 -10.195   4.752
  263    HA   PRO  36           HA       PRO  36   3.042 -10.346  -0.053
  264    HB2  PRO  36           1HB      PRO  36   0.533 -11.244   0.393
  265    HB3  PRO  36           2HB      PRO  36   1.847 -12.399   0.061
  266    HG2  PRO  36           1HG      PRO  36   0.710 -11.580   2.746
  267    HG3  PRO  36           2HG      PRO  36   1.012 -13.222   2.117
  268    HD2  PRO  36           1HD      PRO  36   2.822 -11.918   3.739
  269    HD3  PRO  36           2HD      PRO  36   3.338 -13.090   2.523
  270    H    VAL  37           H        VAL  37   1.173  -8.887  -0.446
  271    HA   VAL  37           HA       VAL  37   0.589  -7.053   1.847
  272    HB   VAL  37           HB       VAL  37   1.336  -6.165  -0.974
  273   HG11  VAL  37          1HG1      VAL  37   1.388  -3.889   0.075
  274   HG12  VAL  37          2HG1      VAL  37   0.803  -4.588   1.583
  275   HG13  VAL  37          3HG1      VAL  37  -0.226  -4.597   0.153
  276   HG21  VAL  37          3HG2      VAL  37   2.916  -6.059   1.631
  277   HG22  VAL  37          1HG2      VAL  37   3.412  -5.310   0.111
  278   HG23  VAL  37          2HG2      VAL  37   3.300  -7.062   0.232
  279    H    ALA  38           H        ALA  38  -1.449  -6.399   1.991
  280    HA   ALA  38           HA       ALA  38  -3.348  -6.998  -0.246
  281    HB1  ALA  38           3HB      ALA  38  -3.569  -8.637   1.605
  282    HB2  ALA  38           1HB      ALA  38  -5.001  -7.613   1.473
  283    HB3  ALA  38           2HB      ALA  38  -3.814  -7.319   2.752
  284    H    VAL  39           H        VAL  39  -4.013  -5.118  -1.017
  285    HA   VAL  39           HA       VAL  39  -4.353  -2.771   0.772
  286    HB   VAL  39           HB       VAL  39  -4.274  -2.873  -2.280
  287   HG11  VAL  39          1HG1      VAL  39  -3.939  -0.430  -2.070
  288   HG12  VAL  39          2HG1      VAL  39  -4.037  -0.544  -0.316
  289   HG13  VAL  39          3HG1      VAL  39  -5.453  -0.888  -1.304
  290   HG21  VAL  39          3HG2      VAL  39  -2.090  -3.577  -1.341
  291   HG22  VAL  39          1HG2      VAL  39  -2.076  -2.166  -0.281
  292   HG23  VAL  39          2HG2      VAL  39  -1.959  -1.960  -2.027
  293    H    TYR  40           H        TYR  40  -6.306  -1.892   1.072
  294    HA   TYR  40           HA       TYR  40  -8.616  -2.668  -0.604
  295    HB2  TYR  40           1HB      TYR  40  -9.961  -3.265   1.436
  296    HB3  TYR  40           2HB      TYR  40  -8.646  -4.396   1.119
  297    HD1  TYR  40           HD2      TYR  40  -6.580  -4.394   2.516
  298    HD2  TYR  40           HD1      TYR  40  -9.866  -1.745   3.399
  299    HE1  TYR  40           HE2      TYR  40  -5.594  -3.900   4.736
  300    HE2  TYR  40           HE1      TYR  40  -8.861  -1.255   5.615
  301    HH   TYR  40           HH       TYR  40  -5.917  -1.608   6.414
  302    H    LEU  41           H        LEU  41  -9.808  -0.937  -1.029
  303    HA   LEU  41           HA       LEU  41  -9.283   1.582   0.378
  304    HB2  LEU  41           1HB      LEU  41  -9.557   1.335  -2.168
  305    HB3  LEU  41           2HB      LEU  41 -11.276   1.123  -1.888
  306    HG   LEU  41           HG       LEU  41 -10.871   3.439  -0.400
  307   HD11  LEU  41          1HD1      LEU  41  -8.441   3.482  -1.008
  308   HD12  LEU  41          2HD1      LEU  41  -9.302   4.929  -1.518
  309   HD13  LEU  41          3HD1      LEU  41  -8.887   3.688  -2.702
  310   HD21  LEU  41          3HD2      LEU  41 -11.324   3.340  -3.400
  311   HD22  LEU  41          1HD2      LEU  41 -11.666   4.738  -2.381
  312   HD23  LEU  41          2HD2      LEU  41 -12.563   3.236  -2.159
  313    H    GLY  42           H        GLY  42 -10.479   2.299   2.025
  314    HA2  GLY  42           1HA      GLY  42 -12.736   2.918   2.793
  315    HA3  GLY  42           2HA      GLY  42 -13.255   1.267   2.476
  316    H    ASN  43           H        ASN  43 -13.910   1.145   4.672
  317    HA   ASN  43           HA       ASN  43 -11.689   0.923   6.655
  318    HB2  ASN  43           1HB      ASN  43 -14.618   1.515   7.103
  319    HB3  ASN  43           2HB      ASN  43 -13.388   1.409   8.366
  320   HD21  ASN  43          2HD2      ASN  43 -15.031   3.823   7.316
  321   HD22  ASN  43          1HD2      ASN  43 -13.852   4.992   6.966
  322    HA   PRO  44           HA       PRO  44 -12.428  -3.521   6.882
  323    HB2  PRO  44           1HB      PRO  44 -12.237  -3.108   9.889
  324    HB3  PRO  44           2HB      PRO  44 -11.454  -4.350   8.881
  325    HG2  PRO  44           1HG      PRO  44 -10.052  -2.249   9.751
  326    HG3  PRO  44           2HG      PRO  44  -9.824  -2.857   8.094
  327    HD2  PRO  44           1HD      PRO  44 -11.303  -0.370   8.991
  328    HD3  PRO  44           2HD      PRO  44 -10.350  -0.663   7.515
  329    H    ALA  45           H        ALA  45 -14.152  -1.431   9.186
  330    HA   ALA  45           HA       ALA  45 -16.339  -3.292   9.647
  331    HB1  ALA  45           3HB      ALA  45 -15.617  -1.658  11.355
  332    HB2  ALA  45           1HB      ALA  45 -17.312  -1.418  10.923
  333    HB3  ALA  45           2HB      ALA  45 -16.073  -0.332  10.287
  334    H    GLN  46           H        GLN  46 -15.682  -2.288   6.845
  335    HA   GLN  46           HA       GLN  46 -18.398  -2.049   5.919
  336    HB2  GLN  46           1HB      GLN  46 -17.998   0.295   6.708
  337    HB3  GLN  46           2HB      GLN  46 -16.629   0.419   5.611
  338    HG2  GLN  46           1HG      GLN  46 -18.142   0.062   3.669
  339    HG3  GLN  46           2HG      GLN  46 -19.510  -0.110   4.765
  340   HE21  GLN  46          2HE2      GLN  46 -20.695   1.790   4.220
  341   HE22  GLN  46          1HE2      GLN  46 -20.062   3.358   4.364
  342    H    GLY  47           H        GLY  47 -15.355  -0.693   4.652
  343    HA2  GLY  47           1HA      GLY  47 -15.651  -1.781   2.065
  344    HA3  GLY  47           2HA      GLY  47 -14.152  -1.170   2.757
  345    H    GLY  48           H        GLY  48 -12.638  -2.611   3.563
  346    HA2  GLY  48           1HA      GLY  48 -11.526  -4.611   3.826
  347    HA3  GLY  48           2HA      GLY  48 -13.080  -5.314   4.257
  348    H    VAL  49           H        VAL  49 -12.292  -3.775   1.179
  349    HA   VAL  49           HA       VAL  49 -12.809  -6.345  -0.244
  350    HB   VAL  49           HB       VAL  49 -12.927  -3.498  -1.331
  351   HG11  VAL  49          1HG1      VAL  49 -13.819  -6.172  -2.508
  352   HG12  VAL  49          2HG1      VAL  49 -12.487  -5.181  -3.099
  353   HG13  VAL  49          3HG1      VAL  49 -14.142  -4.598  -3.236
  354   HG21  VAL  49          3HG2      VAL  49 -14.695  -3.876   0.353
  355   HG22  VAL  49          1HG2      VAL  49 -15.164  -5.375  -0.444
  356   HG23  VAL  49          2HG2      VAL  49 -15.403  -3.827  -1.255
  357    H    GLU  50           H        GLU  50 -11.023  -7.376  -0.861
  358    HA   GLU  50           HA       GLU  50  -8.445  -6.104  -1.031
  359    HB2  GLU  50           1HB      GLU  50  -8.786  -8.501  -0.404
  360    HB3  GLU  50           2HB      GLU  50  -9.280  -8.852  -2.059
  361    HG2  GLU  50           1HG      GLU  50  -7.047  -8.080  -2.876
  362    HG3  GLU  50           2HG      GLU  50  -6.569  -7.736  -1.217
  363    H    ILE  51           H        ILE  51  -7.450  -5.219  -2.755
  364    HA   ILE  51           HA       ILE  51  -8.905  -5.051  -5.346
  365    HB   ILE  51           HB       ILE  51  -6.467  -3.475  -4.392
  366   HG12  ILE  51          1HG1      ILE  51  -9.401  -2.592  -4.492
  367   HG13  ILE  51          2HG1      ILE  51  -8.593  -3.101  -3.018
  368   HG21  ILE  51          1HG2      ILE  51  -6.711  -3.548  -6.877
  369   HG22  ILE  51          2HG2      ILE  51  -7.102  -1.952  -6.279
  370   HG23  ILE  51          3HG2      ILE  51  -8.395  -3.050  -6.730
  371   HD11  ILE  51          3HD1      ILE  51  -8.572  -0.670  -3.171
  372   HD12  ILE  51          1HD1      ILE  51  -7.781  -0.741  -4.742
  373   HD13  ILE  51          2HD1      ILE  51  -6.927  -1.283  -3.297
  374    H    GLY  52           H        GLY  52  -5.702  -5.822  -4.026
  375    HA2  GLY  52           1HA      GLY  52  -5.219  -7.967  -5.797
  376    HA3  GLY  52           2HA      GLY  52  -4.433  -6.518  -6.432
  377    H    ARG  53           H        ARG  53  -2.928  -8.688  -5.716
  378    HA   ARG  53           HA       ARG  53  -1.219  -7.569  -3.628
  379    HB2  ARG  53           1HB      ARG  53  -1.205  -9.685  -2.299
  380    HB3  ARG  53           2HB      ARG  53  -2.778  -8.883  -2.267
  381    HG2  ARG  53           1HG      ARG  53  -3.608 -10.422  -4.026
  382    HG3  ARG  53           2HG      ARG  53  -2.044 -11.228  -4.074
  383    HD2  ARG  53           1HD      ARG  53  -2.299 -11.883  -1.700
  384    HD3  ARG  53           2HD      ARG  53  -3.873 -11.083  -1.652
  385    HE   ARG  53           HE       ARG  53  -3.901 -12.914  -3.788
  386   HH11  ARG  53          1HH2      ARG  53  -3.688 -12.901  -0.315
  387   HH12  ARG  53          2HH2      ARG  53  -4.452 -14.445  -0.133
  388   HH21  ARG  53          1HH1      ARG  53  -4.897 -14.927  -3.538
  389   HH22  ARG  53          2HH1      ARG  53  -5.134 -15.588  -1.954
  390    H    ASP  54           H        ASP  54   0.782  -8.891  -3.380
  391    HA   ASP  54           HA       ASP  54   1.492 -10.755  -5.490
  392    HB2  ASP  54           1HB      ASP  54   1.626  -8.558  -6.670
  393    HB3  ASP  54           2HB      ASP  54   2.802  -8.000  -5.485
  394    H    THR  55           H        THR  55   2.752 -12.183  -4.467
  395    HA   THR  55           HA       THR  55   4.066 -11.575  -1.960
  396    HB   THR  55           HB       THR  55   4.375 -14.079  -3.687
  397    HG1  THR  55           HG1      THR  55   2.343 -14.282  -3.241
  398   HG21  THR  55          3HG2      THR  55   4.872 -15.165  -1.514
  399   HG22  THR  55          1HG2      THR  55   4.701 -13.615  -0.693
  400   HG23  THR  55          2HG2      THR  55   6.025 -13.871  -1.828
  401    H    ILE  56           H        ILE  56   6.122 -10.947  -1.642
  402    HA   ILE  56           HA       ILE  56   7.808 -10.282  -3.923
  403    HB   ILE  56           HB       ILE  56   8.324  -9.994  -0.924
  404   HG12  ILE  56          1HG1      ILE  56   7.421  -7.817  -2.893
  405   HG13  ILE  56          2HG1      ILE  56   6.277  -8.716  -1.911
  406   HG21  ILE  56          1HG2      ILE  56  10.448  -9.869  -2.148
  407   HG22  ILE  56          2HG2      ILE  56   9.995  -8.208  -1.745
  408   HG23  ILE  56          3HG2      ILE  56   9.740  -8.823  -3.378
  409   HD11  ILE  56          3HD1      ILE  56   8.592  -7.172  -0.695
  410   HD12  ILE  56          1HD1      ILE  56   7.193  -7.876   0.120
  411   HD13  ILE  56          2HD1      ILE  56   6.984  -6.492  -0.946
  412    H    SER  57           H        SER  57   9.973 -11.039  -4.185
  413    HA   SER  57           HA       SER  57  10.236 -13.873  -3.982
  414    HB2  SER  57           1HB      SER  57  12.551 -13.478  -4.794
  415    HB3  SER  57           2HB      SER  57  11.379 -12.541  -5.721
  416    HG   SER  57           HG       SER  57  12.902 -11.611  -3.512
  417    H    ARG  58           H        ARG  58  11.918 -11.226  -2.293
  418    HA   ARG  58           HA       ARG  58  11.926 -12.454   0.251
  419    HB2  ARG  58           1HB      ARG  58  14.408 -12.991   0.396
  420    HB3  ARG  58           2HB      ARG  58  13.508 -14.096  -0.631
  421    HG2  ARG  58           1HG      ARG  58  14.214 -12.826  -2.647
  422    HG3  ARG  58           2HG      ARG  58  15.122 -11.710  -1.628
  423    HD2  ARG  58           1HD      ARG  58  16.619 -13.413  -2.586
  424    HD3  ARG  58           2HD      ARG  58  16.529 -13.595  -0.831
  425    HE   ARG  58           HE       ARG  58  14.544 -15.210  -2.062
  426   HH11  ARG  58          1HH2      ARG  58  17.988 -15.001  -1.634
  427   HH12  ARG  58          2HH2      ARG  58  18.235 -16.711  -1.750
  428   HH21  ARG  58          1HH1      ARG  58  14.873 -17.429  -2.205
  429   HH22  ARG  58          2HH1      ARG  58  16.470 -18.085  -2.074
  430    H    ILE  59           H        ILE  59  12.708 -11.069   1.812
  431    HA   ILE  59           HA       ILE  59  13.715  -8.432   0.853
  432    HB   ILE  59           HB       ILE  59  12.123  -8.974   3.380
  433   HG12  ILE  59          1HG1      ILE  59  11.239  -7.701   0.739
  434   HG13  ILE  59          2HG1      ILE  59  10.800  -9.323   1.250
  435   HG21  ILE  59          1HG2      ILE  59  13.050  -6.391   2.029
  436   HG22  ILE  59          2HG2      ILE  59  13.587  -6.990   3.587
  437   HG23  ILE  59          3HG2      ILE  59  11.936  -6.435   3.383
  438   HD11  ILE  59          3HD1      ILE  59   8.980  -7.766   1.741
  439   HD12  ILE  59          1HD1      ILE  59  10.049  -6.761   2.706
  440   HD13  ILE  59          2HD1      ILE  59   9.649  -8.394   3.237
  441    HA   PRO  60           HA       PRO  60  17.261  -9.818   3.414
  442    HB2  PRO  60           1HB      PRO  60  19.107  -7.920   2.761
  443    HB3  PRO  60           2HB      PRO  60  18.621  -9.173   1.595
  444    HG2  PRO  60           1HG      PRO  60  17.606  -6.337   1.824
  445    HG3  PRO  60           2HG      PRO  60  18.188  -7.190   0.373
  446    HD2  PRO  60           1HD      PRO  60  15.517  -6.989   0.931
  447    HD3  PRO  60           2HD      PRO  60  16.179  -8.449   0.150
  448    H    VAL  61           H        VAL  61  18.474  -8.985   5.270
  449    HA   VAL  61           HA       VAL  61  16.831  -7.450   7.049
  450    HB   VAL  61           HB       VAL  61  19.731  -8.305   7.444
  451   HG11  VAL  61          1HG1      VAL  61  19.124  -8.217   9.868
  452   HG12  VAL  61          2HG1      VAL  61  17.524  -7.613   9.438
  453   HG13  VAL  61          3HG1      VAL  61  18.952  -6.633   9.114
  454   HG21  VAL  61          3HG2      VAL  61  18.740 -10.303   8.566
  455   HG22  VAL  61          1HG2      VAL  61  18.293 -10.242   6.862
  456   HG23  VAL  61          2HG2      VAL  61  17.129  -9.760   8.097
  457    H    GLY  62           H        GLY  62  16.983  -5.329   7.686
  458    HA2  GLY  62           1HA      GLY  62  17.675  -3.142   7.782
  459    HA3  GLY  62           2HA      GLY  62  19.263  -3.646   7.212
  460    H    GLY  63           H        GLY  63  16.608  -4.679   5.315
  461    HA2  GLY  63           1HA      GLY  63  17.113  -2.592   3.236
  462    HA3  GLY  63           2HA      GLY  63  16.748  -4.282   2.922
  463    H    THR  64           H        THR  64  15.098  -3.138   1.576
  464    HA   THR  64           HA       THR  64  12.551  -2.858   3.102
  465    HB   THR  64           HB       THR  64  11.889  -1.003   1.663
  466    HG1  THR  64           HG1      THR  64  12.846  -1.165  -0.214
  467   HG21  THR  64          3HG2      THR  64  13.459   0.719   2.441
  468   HG22  THR  64          1HG2      THR  64  14.684  -0.510   2.759
  469   HG23  THR  64          2HG2      THR  64  13.207  -0.467   3.724
  470    H    GLY  65           H        GLY  65  10.701  -2.842   1.465
  471    HA2  GLY  65           1HA      GLY  65  10.939  -4.265  -1.010
  472    HA3  GLY  65           2HA      GLY  65  10.532  -5.379   0.294
  473    H    LEU  66           H        LEU  66   9.142  -3.655  -2.089
  474    HA   LEU  66           HA       LEU  66   6.533  -3.482  -0.662
  475    HB2  LEU  66           1HB      LEU  66   6.049  -1.455  -2.101
  476    HB3  LEU  66           2HB      LEU  66   7.227  -1.204  -0.839
  477    HG   LEU  66           HG       LEU  66   8.489  -2.063  -3.426
  478   HD11  LEU  66          1HD1      LEU  66   8.275   0.125  -4.526
  479   HD12  LEU  66          2HD1      LEU  66   7.192   0.675  -3.248
  480   HD13  LEU  66          3HD1      LEU  66   6.693  -0.632  -4.326
  481   HD21  LEU  66          3HD2      LEU  66   9.750  -1.279  -1.397
  482   HD22  LEU  66          1HD2      LEU  66   9.017   0.317  -1.591
  483   HD23  LEU  66          2HD2      LEU  66  10.104  -0.317  -2.833
  484    H    ALA  67           H        ALA  67   4.716  -3.599  -2.043
  485    HA   ALA  67           HA       ALA  67   5.091  -5.403  -4.347
  486    HB1  ALA  67           3HB      ALA  67   3.656  -6.180  -2.480
  487    HB2  ALA  67           1HB      ALA  67   2.717  -5.952  -3.957
  488    HB3  ALA  67           2HB      ALA  67   2.639  -4.752  -2.664
  489    H    ARG  68           H        ARG  68   3.657  -5.086  -6.148
  490    HA   ARG  68           HA       ARG  68   3.031  -2.190  -6.666
  491    HB2  ARG  68           1HB      ARG  68   5.039  -3.096  -7.926
  492    HB3  ARG  68           2HB      ARG  68   3.959  -4.214  -8.755
  493    HG2  ARG  68           1HG      ARG  68   2.632  -2.255  -9.597
  494    HG3  ARG  68           2HG      ARG  68   3.762  -1.163  -8.802
  495    HD2  ARG  68           1HD      ARG  68   4.506  -3.165 -10.969
  496    HD3  ARG  68           2HD      ARG  68   4.280  -1.434 -11.222
  497    HE   ARG  68           HE       ARG  68   6.160  -1.784  -9.151
  498   HH11  ARG  68          1HH2      ARG  68   5.834  -2.322 -12.577
  499   HH12  ARG  68          2HH2      ARG  68   7.530  -2.159 -12.892
  500   HH21  ARG  68          1HH1      ARG  68   8.364  -1.576  -9.577
  501   HH22  ARG  68          2HH1      ARG  68   8.959  -1.738 -11.195
  502    H    VAL  69           H        VAL  69   0.978  -1.805  -6.996
  503    HA   VAL  69           HA       VAL  69  -0.744  -3.781  -8.377
  504    HB   VAL  69           HB       VAL  69  -2.555  -3.307  -6.646
  505   HG11  VAL  69          1HG1      VAL  69  -1.242  -5.428  -6.599
  506   HG12  VAL  69          2HG1      VAL  69  -1.699  -4.912  -4.978
  507   HG13  VAL  69          3HG1      VAL  69  -0.052  -4.662  -5.549
  508   HG21  VAL  69          3HG2      VAL  69  -1.883  -2.420  -4.455
  509   HG22  VAL  69          1HG2      VAL  69  -1.489  -1.245  -5.702
  510   HG23  VAL  69          2HG2      VAL  69  -0.218  -2.235  -5.002
  511    H    GLN  70           H        GLN  70  -2.601  -2.882  -9.280
  512    HA   GLN  70           HA       GLN  70  -2.499   0.081  -9.731
  513    HB2  GLN  70           1HB      GLN  70  -3.298  -2.053 -11.764
  514    HB3  GLN  70           2HB      GLN  70  -3.176  -0.315 -12.031
  515    HG2  GLN  70           1HG      GLN  70  -1.139  -1.246 -12.918
  516    HG3  GLN  70           2HG      GLN  70  -0.677  -0.512 -11.390
  517   HE21  GLN  70          2HE2      GLN  70   0.907  -1.888 -10.524
  518   HE22  GLN  70          1HE2      GLN  70   0.769  -3.576 -10.423
  519    H    TRP  71           H        TRP  71  -4.395   1.160  -9.694
  520    HA   TRP  71           HA       TRP  71  -6.940  -0.335  -9.464
  521    HB2  TRP  71           1HB      TRP  71  -6.140   0.067  -7.137
  522    HB3  TRP  71           2HB      TRP  71  -6.044   1.784  -7.464
  523    HD1  TRP  71           HD1      TRP  71  -8.798  -0.932  -7.949
  524    HE1  TRP  71           HE1      TRP  71 -11.058   0.091  -7.252
  525    HE3  TRP  71           HE3      TRP  71  -7.254   3.705  -6.498
  526    HZ2  TRP  71           HZ2      TRP  71 -12.076   2.561  -6.222
  527    HZ3  TRP  71           HZ3      TRP  71  -8.876   5.377  -5.667
  528    HH2  TRP  71           HH2      TRP  71 -11.287   4.811  -5.522
  529    H    LYS  72           H        LYS  72  -8.595   0.632 -10.411
  530    HA   LYS  72           HA       LYS  72  -8.099   3.207 -11.817
  531    HB2  LYS  72           1HB      LYS  72  -8.775   1.186 -13.145
  532    HB3  LYS  72           2HB      LYS  72 -10.312   1.155 -12.282
  533    HG2  LYS  72           1HG      LYS  72 -10.835   3.439 -13.116
  534    HG3  LYS  72           2HG      LYS  72  -9.278   3.496 -13.947
  535    HD2  LYS  72           1HD      LYS  72  -9.960   1.553 -15.344
  536    HD3  LYS  72           2HD      LYS  72 -11.525   1.523 -14.527
  537    HE2  LYS  72           1HE      LYS  72 -11.996   3.823 -15.337
  538    HE3  LYS  72           2HE      LYS  72 -10.427   3.860 -16.146
  539    HZ1  LYS  72           3HZ      LYS  72 -12.673   3.094 -17.329
  540    HZ2  LYS  72           1HZ      LYS  72 -12.124   1.591 -16.768
  541    HZ3  LYS  72           2HZ      LYS  72 -11.137   2.529 -17.784
  542    H    ALA  73           H        ALA  73  -8.998   4.993 -11.041
  543    HA   ALA  73           HA       ALA  73 -10.791   4.968  -8.793
  544    HB1  ALA  73           3HB      ALA  73  -9.164   6.790  -9.147
  545    HB2  ALA  73           1HB      ALA  73 -10.808   7.429  -9.096
  546    HB3  ALA  73           2HB      ALA  73  -9.978   7.245 -10.640
  547    H    THR  74           H        THR  74 -12.983   5.200  -8.750
  548    HA   THR  74           HA       THR  74 -14.559   6.110 -10.990
  549    HB   THR  74           HB       THR  74 -14.127   3.892 -11.896
  550    HG1  THR  74           HG1      THR  74 -16.160   3.588 -12.292
  551   HG21  THR  74          3HG2      THR  74 -15.063   2.795  -9.214
  552   HG22  THR  74          1HG2      THR  74 -13.403   2.757  -9.809
  553   HG23  THR  74          2HG2      THR  74 -14.661   1.835 -10.632
  554    H    ARG  75           H        ARG  75 -16.735   6.400 -10.457
  555    HA   ARG  75           HA       ARG  75 -17.907   5.446  -8.025
  556    HB2  ARG  75           1HB      ARG  75 -16.321   7.152  -7.093
  557    HB3  ARG  75           2HB      ARG  75 -17.104   8.390  -8.071
  558    HG2  ARG  75           1HG      ARG  75 -19.262   7.948  -6.894
  559    HG3  ARG  75           2HG      ARG  75 -18.473   6.704  -5.928
  560    HD2  ARG  75           1HD      ARG  75 -17.702   9.646  -5.959
  561    HD3  ARG  75           2HD      ARG  75 -18.650   8.855  -4.698
  562    HE   ARG  75           HE       ARG  75 -16.246   7.420  -5.028
  563   HH11  ARG  75          1HH2      ARG  75 -17.367  10.528  -3.927
  564   HH12  ARG  75          2HH2      ARG  75 -16.066  10.736  -2.803
  565   HH21  ARG  75          1HH1      ARG  75 -14.557   7.717  -3.570
  566   HH22  ARG  75          2HH1      ARG  75 -14.484   9.153  -2.605
  567    H    LYS  76           H        LYS  76 -19.457   4.888  -9.655
  568    HA   LYS  76           HA       LYS  76 -20.779   6.876 -11.248
  569    HB2  LYS  76           1HB      LYS  76 -20.730   4.437 -11.821
  570    HB3  LYS  76           2HB      LYS  76 -21.787   4.104 -10.452
  571    HG2  LYS  76           1HG      LYS  76 -23.539   5.571 -11.445
  572    HG3  LYS  76           2HG      LYS  76 -22.467   5.929 -12.798
  573    HD2  LYS  76           1HD      LYS  76 -22.471   3.517 -13.423
  574    HD3  LYS  76           2HD      LYS  76 -23.553   3.174 -12.071
  575    HE2  LYS  76           1HE      LYS  76 -24.825   3.404 -14.198
  576    HE3  LYS  76           2HE      LYS  76 -25.271   4.671 -13.054
  577    HZ1  LYS  76           3HZ      LYS  76 -23.028   5.382 -14.691
  578    HZ2  LYS  76           1HZ      LYS  76 -24.458   6.241 -14.383
  579    HZ3  LYS  76           2HZ      LYS  76 -24.424   5.064 -15.608
  580    H    LEU  77           H        LEU  77 -22.316   8.283 -10.631
  581    HA   LEU  77           HA       LEU  77 -24.320   7.652  -8.658
  582    HB2  LEU  77           1HB      LEU  77 -22.242   8.320  -7.283
  583    HB3  LEU  77           2HB      LEU  77 -22.431   9.937  -7.939
  584    HG   LEU  77           HG       LEU  77 -24.952   9.723  -7.015
  585   HD11  LEU  77          1HD1      LEU  77 -23.500   7.717  -5.230
  586   HD12  LEU  77          2HD1      LEU  77 -24.785   7.318  -6.362
  587   HD13  LEU  77          3HD1      LEU  77 -25.133   8.330  -4.970
  588   HD21  LEU  77          3HD2      LEU  77 -22.590  10.106  -5.128
  589   HD22  LEU  77          1HD2      LEU  77 -24.242  10.637  -4.803
  590   HD23  LEU  77          2HD2      LEU  77 -23.328  11.358  -6.126
  591    H    ALA  78           H        ALA  78 -26.120   8.530  -9.437
  592    HA   ALA  78           HA       ALA  78 -26.178  10.441 -11.538
  593    HB1  ALA  78           3HB      ALA  78 -27.980   8.788 -11.145
  594    HB2  ALA  78           1HB      ALA  78 -28.623  10.432 -11.154
  595    HB3  ALA  78           2HB      ALA  78 -28.384   9.583  -9.624
  596    H    GLY  79           H        GLY  79 -26.652  10.688  -8.028
  597    HA2  GLY  79           1HA      GLY  79 -27.427  13.410  -7.923
  598    HA3  GLY  79           2HA      GLY  79 -26.756  12.459  -6.602
  599    H    ARG  80           H        ARG  80 -26.168  15.206  -7.165
  600    HA   ARG  80           HA       ARG  80 -23.691  15.581  -8.502
  601    HB2  ARG  80           1HB      ARG  80 -24.879  17.162  -6.190
  602    HB3  ARG  80           2HB      ARG  80 -23.640  17.739  -7.304
  603    HG2  ARG  80           1HG      ARG  80 -26.489  16.979  -8.082
  604    HG3  ARG  80           2HG      ARG  80 -25.897  18.620  -7.878
  605    HD2  ARG  80           1HD      ARG  80 -24.184  18.142  -9.709
  606    HD3  ARG  80           2HD      ARG  80 -25.041  16.632 -10.017
  607    HE   ARG  80           HE       ARG  80 -26.946  18.677 -10.072
  608   HH11  ARG  80          1HH2      ARG  80 -24.120  17.654 -11.825
  609   HH12  ARG  80          2HH2      ARG  80 -24.672  18.274 -13.346
  610   HH21  ARG  80          1HH1      ARG  80 -27.667  19.477 -12.089
  611   HH22  ARG  80          2HH1      ARG  80 -26.667  19.301 -13.494
  612    H    ALA  81           H        ALA  81 -22.055  16.871  -6.720
  613    HA   ALA  81           HA       ALA  81 -21.394  15.208  -4.446
  614    HB1  ALA  81           3HB      ALA  81 -20.583  13.767  -6.298
  615    HB2  ALA  81           1HB      ALA  81 -19.238  14.381  -5.336
  616    HB3  ALA  81           2HB      ALA  81 -19.601  15.098  -6.908
  617    H    ALA  82           H        ALA  82 -19.614  16.040  -3.251
  618    HA   ALA  82           HA       ALA  82 -18.140  18.388  -4.062
  619    HB1  ALA  82           3HB      ALA  82 -20.405  18.795  -2.066
  620    HB2  ALA  82           1HB      ALA  82 -20.366  19.430  -3.708
  621    HB3  ALA  82           2HB      ALA  82 -19.201  20.005  -2.518
  622    H    ASN  83           H        ASN  83 -17.867  15.725  -2.781
  623    HA   ASN  83           HA       ASN  83 -15.901  16.476  -0.802
  624    HB2  ASN  83           1HB      ASN  83 -16.984  15.227   1.085
  625    HB3  ASN  83           2HB      ASN  83 -17.843  16.693   0.626
  626   HD21  ASN  83          2HD2      ASN  83 -18.201  13.295   1.079
  627   HD22  ASN  83          1HD2      ASN  83 -19.764  13.159   0.431
  628    HA   PRO  84           HA       PRO  84 -15.154  12.394  -2.882
  629    HB2  PRO  84           1HB      PRO  84 -12.403  12.493  -3.072
  630    HB3  PRO  84           2HB      PRO  84 -13.467  13.338  -4.216
  631    HG2  PRO  84           1HG      PRO  84 -11.980  14.470  -1.849
  632    HG3  PRO  84           2HG      PRO  84 -12.191  15.155  -3.466
  633    HD2  PRO  84           1HD      PRO  84 -13.716  15.943  -1.299
  634    HD3  PRO  84           2HD      PRO  84 -14.330  16.019  -2.968
  635    H    GLY  85           H        GLY  85 -12.334  13.054  -0.869
  636    HA2  GLY  85           1HA      GLY  85 -11.498  11.983   1.011
  637    HA3  GLY  85           2HA      GLY  85 -13.168  11.707   1.490
  638    H    VAL  86           H        VAL  86 -10.526  10.475  -0.499
  639    HA   VAL  86           HA       VAL  86 -11.650   7.704  -0.340
  640    HB   VAL  86           HB       VAL  86 -10.282   7.343  -2.479
  641   HG11  VAL  86          1HG1      VAL  86 -12.748   7.574  -2.546
  642   HG12  VAL  86          2HG1      VAL  86 -12.021   8.329  -3.963
  643   HG13  VAL  86          3HG1      VAL  86 -12.590   9.329  -2.626
  644   HG21  VAL  86          3HG2      VAL  86  -9.727   9.333  -3.833
  645   HG22  VAL  86          1HG2      VAL  86  -8.871   9.416  -2.299
  646   HG23  VAL  86          2HG2      VAL  86 -10.303  10.401  -2.556
  647    HA   PRO  87           HA       PRO  87  -7.506   8.125   1.907
  648    HB2  PRO  87           1HB      PRO  87  -8.289   6.754   4.220
  649    HB3  PRO  87           2HB      PRO  87  -8.460   8.514   4.021
  650    HG2  PRO  87           1HG      PRO  87 -10.523   6.373   3.469
  651    HG3  PRO  87           2HG      PRO  87 -10.699   7.844   4.458
  652    HD2  PRO  87           1HD      PRO  87 -11.608   7.864   1.972
  653    HD3  PRO  87           2HD      PRO  87 -10.656   9.261   2.518
  654    H    VAL  88           H        VAL  88  -5.964   6.562   1.803
  655    HA   VAL  88           HA       VAL  88  -6.736   3.902   0.737
  656    HB   VAL  88           HB       VAL  88  -3.980   5.210   0.831
  657   HG11  VAL  88          1HG1      VAL  88  -3.927   2.729   0.586
  658   HG12  VAL  88          2HG1      VAL  88  -3.441   3.515  -0.909
  659   HG13  VAL  88          3HG1      VAL  88  -5.061   2.835  -0.760
  660   HG21  VAL  88          3HG2      VAL  88  -4.407   5.694  -1.587
  661   HG22  VAL  88          1HG2      VAL  88  -5.532   6.559  -0.545
  662   HG23  VAL  88          2HG2      VAL  88  -6.058   5.111  -1.406
  663    H    TYR  89           H        TYR  89  -6.013   2.010   1.654
  664    HA   TYR  89           HA       TYR  89  -4.636   2.133   4.291
  665    HB2  TYR  89           1HB      TYR  89  -7.170   0.560   3.675
  666    HB3  TYR  89           2HB      TYR  89  -6.225   0.424   5.156
  667    HD1  TYR  89           HD2      TYR  89  -5.873   2.514   6.621
  668    HD2  TYR  89           HD1      TYR  89  -8.795   2.384   3.452
  669    HE1  TYR  89           HE2      TYR  89  -7.037   4.475   7.599
  670    HE2  TYR  89           HE1      TYR  89  -9.950   4.316   4.462
  671    HH   TYR  89           HH       TYR  89  -8.687   5.930   7.379
  672    H    ALA  90           H        ALA  90  -3.205   0.585   4.622
  673    HA   ALA  90           HA       ALA  90  -3.093  -1.806   2.889
  674    HB1  ALA  90           3HB      ALA  90  -0.795   0.168   3.193
  675    HB2  ALA  90           1HB      ALA  90  -1.747  -0.078   1.731
  676    HB3  ALA  90           2HB      ALA  90  -0.724  -1.378   2.343
  677    H    VAL  91           H        VAL  91  -2.431  -3.542   3.970
  678    HA   VAL  91           HA       VAL  91  -0.938  -3.256   6.529
  679    HB   VAL  91           HB       VAL  91  -3.444  -4.988   6.231
  680   HG11  VAL  91          1HG1      VAL  91  -1.788  -5.870   7.864
  681   HG12  VAL  91          2HG1      VAL  91  -3.190  -5.234   8.714
  682   HG13  VAL  91          3HG1      VAL  91  -1.700  -4.293   8.647
  683   HG21  VAL  91          3HG2      VAL  91  -4.117  -2.621   6.267
  684   HG22  VAL  91          1HG2      VAL  91  -3.055  -2.298   7.637
  685   HG23  VAL  91          2HG2      VAL  91  -4.475  -3.328   7.836
  686    H    VAL  92           H        VAL  92   0.398  -4.932   7.004
  687    HA   VAL  92           HA       VAL  92   0.986  -6.806   4.802
  688    HB   VAL  92           HB       VAL  92   2.785  -5.397   5.869
  689   HG11  VAL  92          1HG1      VAL  92   1.885  -5.564   8.241
  690   HG12  VAL  92          2HG1      VAL  92   3.613  -5.888   8.102
  691   HG13  VAL  92          3HG1      VAL  92   2.481  -7.221   8.301
  692   HG21  VAL  92          3HG2      VAL  92   3.353  -7.504   4.686
  693   HG22  VAL  92          1HG2      VAL  92   3.124  -8.412   6.180
  694   HG23  VAL  92          2HG2      VAL  92   4.440  -7.250   6.049
  695    H    ASP  93           H        ASP  93   0.974  -9.015   5.048
  696    HA   ASP  93           HA       ASP  93  -0.097 -10.192   7.572
  697    HB2  ASP  93           1HB      ASP  93  -1.124 -10.739   4.779
  698    HB3  ASP  93           2HB      ASP  93  -1.631 -11.584   6.242
  699    HA   PRO  94           HA       PRO  94   3.437 -12.730   5.943
  700    HB2  PRO  94           1HB      PRO  94   4.946 -12.933   8.199
  701    HB3  PRO  94           2HB      PRO  94   4.941 -11.447   7.223
  702    HG2  PRO  94           1HG      PRO  94   3.510 -12.002   9.813
  703    HG3  PRO  94           2HG      PRO  94   4.322 -10.520   9.275
  704    HD2  PRO  94           1HD      PRO  94   1.544 -10.956   9.103
  705    HD3  PRO  94           2HD      PRO  94   2.412  -9.744   8.155
  706    H    ASP  95           H        ASP  95   2.358 -13.354   9.304
  707    HA   ASP  95           HA       ASP  95   2.217 -16.251   8.731
  708    HB2  ASP  95           1HB      ASP  95   3.318 -15.358  10.817
  709    HB3  ASP  95           2HB      ASP  95   1.746 -14.806  11.367
  710    H    ASN  96           H        ASN  96   0.269 -14.120   7.735
  711    HA   ASN  96           HA       ASN  96  -1.941 -13.918   7.317
  712    HB2  ASN  96           1HB      ASN  96  -1.703 -16.345   6.735
  713    HB3  ASN  96           2HB      ASN  96  -2.164 -16.768   8.376
  714   HD21  ASN  96          2HD2      ASN  96  -3.407 -14.843   5.583
  715   HD22  ASN  96          1HD2      ASN  96  -5.038 -15.216   5.874
  716    H    ARG  97           H        ARG  97  -2.563 -12.343   8.698
  717    HA   ARG  97           HA       ARG  97  -3.510 -11.301  10.492
  718    HB2  ARG  97           1HB      ARG  97  -4.838 -14.011  10.891
  719    HB3  ARG  97           2HB      ARG  97  -5.398 -12.471  11.545
  720    HG2  ARG  97           1HG      ARG  97  -5.731 -11.595   9.253
  721    HG3  ARG  97           2HG      ARG  97  -5.125 -13.109   8.570
  722    HD2  ARG  97           1HD      ARG  97  -7.590 -13.103   8.563
  723    HD3  ARG  97           2HD      ARG  97  -6.991 -14.340   9.670
  724    HE   ARG  97           HE       ARG  97  -7.405 -11.891  11.065
  725   HH11  ARG  97          1HH2      ARG  97  -9.147 -14.522   9.591
  726   HH12  ARG  97          2HH2      ARG  97 -10.529 -14.347  10.622
  727   HH21  ARG  97          1HH1      ARG  97  -9.208 -11.685  12.402
  728   HH22  ARG  97          2HH1      ARG  97 -10.562 -12.747  12.207
  729    H    VAL  98           H        VAL  98  -1.590 -11.004  11.681
  730    HA   VAL  98           HA       VAL  98  -0.599 -13.015  13.540
  731    HB   VAL  98           HB       VAL  98   0.129 -10.064  13.263
  732   HG11  VAL  98          1HG1      VAL  98   0.865 -10.966  15.445
  733   HG12  VAL  98          2HG1      VAL  98   2.268 -10.789  14.396
  734   HG13  VAL  98          3HG1      VAL  98   1.555 -12.382  14.648
  735   HG21  VAL  98          3HG2      VAL  98   1.455 -12.524  12.081
  736   HG22  VAL  98          1HG2      VAL  98   2.025 -10.870  11.908
  737   HG23  VAL  98          2HG2      VAL  98   0.498 -11.361  11.180
  738    H    ALA  99           H        ALA  99  -1.419  -9.631  14.251
  739    HA   ALA  99           HA       ALA  99  -3.483 -10.226  16.144
  740    HB1  ALA  99           3HB      ALA  99  -1.542 -11.065  17.438
  741    HB2  ALA  99           1HB      ALA  99  -2.222  -9.623  18.191
  742    HB3  ALA  99           2HB      ALA  99  -0.736  -9.512  17.245
  743    H    GLU 100           H        GLU 100  -4.270  -8.324  17.207
  744    HA   GLU 100           HA       GLU 100  -4.347  -6.022  15.557
  745    HB2  GLU 100           1HB      GLU 100  -5.091  -6.308  18.494
  746    HB3  GLU 100           2HB      GLU 100  -5.567  -4.966  17.451
  747    HG2  GLU 100           1HG      GLU 100  -6.778  -6.546  15.967
  748    HG3  GLU 100           2HG      GLU 100  -6.307  -7.887  17.006
  749    H    SER 101           H        SER 101  -1.859  -7.079  17.490
  750    HA   SER 101           HA       SER 101  -0.876  -4.459  18.406
  751    HB2  SER 101           1HB      SER 101  -0.562  -6.455  19.818
  752    HB3  SER 101           2HB      SER 101   0.352  -7.237  18.533
  753    HG   SER 101           HG       SER 101   0.998  -4.833  19.909
  754    H    ASP 102           H        ASP 102   0.371  -7.078  16.302
  755    HA   ASP 102           HA       ASP 102   2.535  -5.585  15.241
  756    HB2  ASP 102           1HB      ASP 102   2.282  -8.088  15.174
  757    HB3  ASP 102           2HB      ASP 102   1.075  -7.898  13.912
  758    H    LYS 103           H        LYS 103  -0.762  -6.147  14.012
  759    HA   LYS 103           HA       LYS 103  -0.555  -4.859  11.533
  760    HB2  LYS 103           1HB      LYS 103  -2.908  -5.019  13.455
  761    HB3  LYS 103           2HB      LYS 103  -3.047  -4.480  11.779
  762    HG2  LYS 103           1HG      LYS 103  -2.203  -6.672  10.993
  763    HG3  LYS 103           2HG      LYS 103  -2.039  -7.219  12.663
  764    HD2  LYS 103           1HD      LYS 103  -4.487  -6.942  12.997
  765    HD3  LYS 103           2HD      LYS 103  -4.654  -6.393  11.330
  766    HE2  LYS 103           1HE      LYS 103  -3.825  -8.586  10.521
  767    HE3  LYS 103           2HE      LYS 103  -3.648  -9.135  12.189
  768    HZ1  LYS 103           3HZ      LYS 103  -6.019  -8.902  10.576
  769    HZ2  LYS 103           1HZ      LYS 103  -6.192  -8.222  12.120
  770    HZ3  LYS 103           2HZ      LYS 103  -5.733  -9.850  11.956
  771    H    ALA 104           H        ALA 104  -1.815  -3.416  14.563
  772    HA   ALA 104           HA       ALA 104  -2.021  -0.779  13.708
  773    HB1  ALA 104           3HB      ALA 104  -1.231  -1.777  16.471
  774    HB2  ALA 104           1HB      ALA 104  -2.883  -1.615  15.876
  775    HB3  ALA 104           2HB      ALA 104  -1.885  -0.178  16.105
  776    H    ASN 105           H        ASN 105   0.827  -2.546  14.844
  777    HA   ASN 105           HA       ASN 105   2.590  -0.233  14.837
  778    HB2  ASN 105           1HB      ASN 105   3.193  -3.213  14.959
  779    HB3  ASN 105           2HB      ASN 105   4.343  -1.917  15.288
  780   HD21  ASN 105          2HD2      ASN 105   2.337  -0.235  16.738
  781   HD22  ASN 105          1HD2      ASN 105   2.070  -1.012  18.222
  782    H    ASN 106           H        ASN 106   1.063  -1.081  12.335
  783    HA   ASN 106           HA       ASN 106   3.158  -0.532  10.444
  784    HB2  ASN 106           1HB      ASN 106   3.539  -2.992  10.867
  785    HB3  ASN 106           2HB      ASN 106   1.915  -3.317  10.274
  786   HD21  ASN 106          2HD2      ASN 106   1.696  -3.561   8.008
  787   HD22  ASN 106          1HD2      ASN 106   2.915  -3.187   6.887
  788    H    VAL 107           H        VAL 107   0.799   0.769  11.053
  789    HA   VAL 107           HA       VAL 107  -0.988   0.257   8.708
  790    HB   VAL 107           HB       VAL 107  -2.083   0.105  10.940
  791   HG11  VAL 107          1HG1      VAL 107  -2.328   2.051  12.388
  792   HG12  VAL 107          2HG1      VAL 107  -1.480   3.086  11.243
  793   HG13  VAL 107          3HG1      VAL 107  -0.605   1.821  12.094
  794   HG21  VAL 107          3HG2      VAL 107  -3.376   0.883   8.937
  795   HG22  VAL 107          1HG2      VAL 107  -2.984   2.554   9.345
  796   HG23  VAL 107          2HG2      VAL 107  -3.984   1.594  10.430
  797    H    PHE 108           H        PHE 108  -1.334   1.839   7.259
  798    HA   PHE 108           HA       PHE 108  -0.341   4.581   7.730
  799    HB2  PHE 108           1HB      PHE 108   0.607   2.892   5.373
  800    HB3  PHE 108           2HB      PHE 108   1.030   4.573   5.697
  801    HD1  PHE 108           HD1      PHE 108   2.045   5.065   8.115
  802    HD2  PHE 108           HD2      PHE 108   2.113   1.184   6.221
  803    HE1  PHE 108           HE1      PHE 108   3.931   4.378   9.562
  804    HE2  PHE 108           HE2      PHE 108   3.991   0.513   7.688
  805    HZ   PHE 108           HZ       PHE 108   4.901   2.107   9.355
  806    H    SER 109           H        SER 109  -1.176   6.100   6.286
  807    HA   SER 109           HA       SER 109  -2.991   5.390   4.161
  808    HB2  SER 109           1HB      SER 109  -4.168   6.509   6.734
  809    HB3  SER 109           2HB      SER 109  -5.042   6.300   5.219
  810    HG   SER 109           HG       SER 109  -4.185   4.001   5.493
  811    H    ARG 110           H        ARG 110  -3.548   7.145   2.910
  812    HA   ARG 110           HA       ARG 110  -2.693   9.856   3.768
  813    HB2  ARG 110           1HB      ARG 110  -0.770   8.775   2.587
  814    HB3  ARG 110           2HB      ARG 110  -1.789   8.552   1.168
  815    HG2  ARG 110           1HG      ARG 110  -2.118  11.040   1.036
  816    HG3  ARG 110           2HG      ARG 110  -1.074  11.229   2.440
  817    HD2  ARG 110           1HD      ARG 110   0.781  10.138   1.156
  818    HD3  ARG 110           2HD      ARG 110  -0.279  10.091  -0.262
  819    HE   ARG 110           HE       ARG 110  -0.210  12.738   0.718
  820   HH11  ARG 110          1HH2      ARG 110   1.883  10.394  -0.770
  821   HH12  ARG 110          2HH2      ARG 110   2.871  11.582  -1.553
  822   HH21  ARG 110          1HH1      ARG 110   1.082  14.281  -0.308
  823   HH22  ARG 110          2HH1      ARG 110   2.418  13.781  -1.291
  824    H    ILE 111           H        ILE 111  -4.061  11.376   3.150
  825    HA   ILE 111           HA       ILE 111  -6.442  10.656   1.626
  826    HB   ILE 111           HB       ILE 111  -5.557  13.279   2.926
  827   HG12  ILE 111          1HG1      ILE 111  -7.417  12.724   4.558
  828   HG13  ILE 111          2HG1      ILE 111  -7.624  11.178   3.749
  829   HG21  ILE 111          1HG2      ILE 111  -7.067  13.895   1.112
  830   HG22  ILE 111          2HG2      ILE 111  -8.028  13.929   2.586
  831   HG23  ILE 111          3HG2      ILE 111  -8.153  12.556   1.485
  832   HD11  ILE 111          3HD1      ILE 111  -5.664  10.308   4.640
  833   HD12  ILE 111          1HD1      ILE 111  -6.152  11.386   5.935
  834   HD13  ILE 111          2HD1      ILE 111  -4.885  11.884   4.820
  835    H    VAL 112           H        VAL 112  -6.574  10.823  -0.501
  836    HA   VAL 112           HA       VAL 112  -4.576  12.403  -2.036
  837    HB   VAL 112           HB       VAL 112  -6.595  10.366  -3.093
  838   HG11  VAL 112          1HG1      VAL 112  -5.666  11.931  -4.796
  839   HG12  VAL 112          2HG1      VAL 112  -5.053  10.303  -5.049
  840   HG13  VAL 112          3HG1      VAL 112  -4.030  11.523  -4.288
  841   HG21  VAL 112          3HG2      VAL 112  -4.708   8.764  -3.096
  842   HG22  VAL 112          1HG2      VAL 112  -5.051   9.296  -1.456
  843   HG23  VAL 112          2HG2      VAL 112  -3.670   9.962  -2.324
  844    H    LYS 113           H        LYS 113  -5.147  14.139  -3.224
  845    HA   LYS 113           HA       LYS 113  -8.040  14.799  -3.541
  846    HB2  LYS 113           1HB      LYS 113  -6.859  16.052  -1.599
  847    HB3  LYS 113           2HB      LYS 113  -5.951  16.918  -2.834
  848    HG2  LYS 113           1HG      LYS 113  -8.097  17.685  -3.853
  849    HG3  LYS 113           2HG      LYS 113  -8.994  16.819  -2.605
  850    HD2  LYS 113           1HD      LYS 113  -7.901  18.235  -0.857
  851    HD3  LYS 113           2HD      LYS 113  -7.073  19.135  -2.127
  852    HE2  LYS 113           1HE      LYS 113  -9.280  19.798  -3.079
  853    HE3  LYS 113           2HE      LYS 113 -10.087  18.922  -1.774
  854    HZ1  LYS 113           3HZ      LYS 113  -9.930  21.249  -1.241
  855    HZ2  LYS 113           1HZ      LYS 113  -8.250  21.236  -1.470
  856    HZ3  LYS 113           2HZ      LYS 113  -8.938  20.363  -0.185
  857    H    VAL 114           H        VAL 114  -8.555  15.175  -5.557
  858    HA   VAL 114           HA       VAL 114  -6.529  16.162  -7.511
  859    HB   VAL 114           HB       VAL 114  -7.583  14.655  -9.194
  860   HG11  VAL 114          1HG1      VAL 114  -5.549  13.920  -7.972
  861   HG12  VAL 114          2HG1      VAL 114  -6.589  12.544  -8.337
  862   HG13  VAL 114          3HG1      VAL 114  -6.558  13.218  -6.708
  863   HG21  VAL 114          3HG2      VAL 114  -9.822  14.365  -8.180
  864   HG22  VAL 114          1HG2      VAL 114  -9.110  13.554  -6.786
  865   HG23  VAL 114          2HG2      VAL 114  -9.062  12.790  -8.376
  866    H    LEU 115           H        LEU 115  -7.162  17.740  -8.805
  867    HA   LEU 115           HA       LEU 115 -10.017  18.645  -8.780
  868    HB2  LEU 115           1HB      LEU 115  -7.497  20.348  -8.743
  869    HB3  LEU 115           2HB      LEU 115  -9.144  20.965  -8.830
  870    HG   LEU 115           HG       LEU 115  -8.048  19.303  -6.506
  871   HD11  LEU 115          1HD1      LEU 115  -8.064  21.436  -5.227
  872   HD12  LEU 115          2HD1      LEU 115  -8.543  22.303  -6.688
  873   HD13  LEU 115          3HD1      LEU 115  -6.964  21.522  -6.605
  874   HD21  LEU 115          3HD2      LEU 115 -10.432  19.007  -6.498
  875   HD22  LEU 115          1HD2      LEU 115 -10.739  20.673  -6.979
  876   HD23  LEU 115          2HD2      LEU 115 -10.175  20.302  -5.351
  877    H    GLU 116           H        GLU 116 -10.913  18.734 -10.691
  878    HA   GLU 116           HA       GLU 116  -9.375  18.278 -13.122
  879    HB2  GLU 116           1HB      GLU 116 -11.622  18.247 -14.195
  880    HB3  GLU 116           2HB      GLU 116 -11.521  17.152 -12.822
  881    HG2  GLU 116           1HG      GLU 116 -12.642  18.835 -11.378
  882    HG3  GLU 116           2HG      GLU 116 -12.762  19.930 -12.749
  883    H    HIS 117           H        HIS 117 -10.851  20.950 -11.443
  884    HA   HIS 117           HA       HIS 117 -10.974  22.784 -13.639
  885    HB2  HIS 117           1HB      HIS 117 -10.813  23.284 -10.638
  886    HB3  HIS 117           2HB      HIS 117 -11.278  24.477 -11.854
  887    HD1  HIS 117           HD1      HIS 117 -13.396  23.534 -13.445
  888    HD2  HIS 117           HD2      HIS 117 -13.005  21.990  -9.593
  889    HE1  HIS 117           HE1      HIS 117 -15.644  22.538 -12.841
  890    HE2  HIS 117           HE2      HIS 117 -15.422  21.592 -10.494
  891    H    HIS 118           H        HIS 118  -9.671  24.763 -13.717
  892    HA   HIS 118           HA       HIS 118  -7.664  25.759 -14.130
  893    HB2  HIS 118           1HB      HIS 118  -7.812  25.844 -11.576
  894    HB3  HIS 118           2HB      HIS 118  -6.737  24.452 -11.528
  895    HD1  HIS 118           HD1      HIS 118  -5.801  26.491 -14.347
  896    HD2  HIS 118           HD2      HIS 118  -5.046  26.677 -10.253
  897    HE1  HIS 118           HE1      HIS 118  -3.862  28.084 -14.053
  898    HE2  HIS 118           HE2      HIS 118  -3.383  28.209 -11.564
  899    H    HIS 119           H        HIS 119  -7.194  24.528 -15.980
  900    HA   HIS 119           HA       HIS 119  -5.765  22.005 -15.871
  901    HB2  HIS 119           1HB      HIS 119  -6.190  23.941 -18.186
  902    HB3  HIS 119           2HB      HIS 119  -5.636  22.270 -18.324
  903    HD1  HIS 119           HD1      HIS 119  -7.409  20.436 -17.286
  904    HD2  HIS 119           HD2      HIS 119  -8.945  24.192 -18.246
  905    HE1  HIS 119           HE1      HIS 119  -9.924  20.171 -17.414
  906    HE2  HIS 119           HE2      HIS 119 -10.876  22.452 -17.998
  907    H    HIS 120           H        HIS 120  -4.699  24.699 -14.706
  908    HA   HIS 120           HA       HIS 120  -2.685  25.766 -14.462
  909    HB2  HIS 120           1HB      HIS 120  -1.607  23.086 -15.418
  910    HB3  HIS 120           2HB      HIS 120  -0.689  24.316 -14.549
  911    HD1  HIS 120           HD1      HIS 120  -1.544  24.853 -12.052
  912    HD2  HIS 120           HD2      HIS 120  -3.115  21.397 -13.779
  913    HE1  HIS 120           HE1      HIS 120  -2.547  23.499 -10.161
  914    HE2  HIS 120           HE2      HIS 120  -3.509  21.389 -11.197
  915    H    HIS 121           H        HIS 121  -0.353  25.905 -15.765
  916    HA   HIS 121           HA       HIS 121   0.647  26.917 -17.554
  917    HB2  HIS 121           1HB      HIS 121   0.313  24.591 -18.446
  918    HB3  HIS 121           2HB      HIS 121  -1.197  25.116 -19.182
  919    HD1  HIS 121           HD1      HIS 121  -1.047  26.453 -21.357
  920    HD2  HIS 121           HD2      HIS 121   2.673  25.804 -19.595
  921    HE1  HIS 121           HE1      HIS 121   0.684  27.247 -23.027
  922    HE2  HIS 121           HE2      HIS 121   2.959  26.857 -21.966
  923    H    HIS 122           H        HIS 122  -2.114  27.859 -16.538
  924    HA   HIS 122           HA       HIS 122  -3.512  29.065 -18.703
  925    HB2  HIS 122           1HB      HIS 122  -4.489  28.719 -16.435
  926    HB3  HIS 122           2HB      HIS 122  -3.409  29.950 -15.788
  927    HD1  HIS 122           HD1      HIS 122  -6.007  29.664 -18.581
  928    HD2  HIS 122           HD2      HIS 122  -4.570  32.473 -15.856
  929    HE1  HIS 122           HE1      HIS 122  -7.356  31.775 -18.949
  930    HE2  HIS 122           HE2      HIS 122  -6.494  33.497 -17.295
  Start of MODEL   10
    1    H1   MET   1           1H       MET   1  12.825  12.962   3.083
    2    H2   MET   1           2H       MET   1  12.281  14.216   4.091
    3    H3   MET   1           3H       MET   1  12.585  14.515   2.446
    4    HA   MET   1           HA       MET   1  10.231  13.499   3.715
    5    HB2  MET   1           1HB      MET   1  10.924  14.510   0.924
    6    HB3  MET   1           2HB      MET   1   9.279  14.201   1.483
    7    HG2  MET   1           1HG      MET   1   9.581  15.874   3.295
    8    HG3  MET   1           2HG      MET   1  11.220  16.193   2.724
    9    HE1  MET   1           3HE      MET   1  11.019  18.674   2.291
   10    HE2  MET   1           1HE      MET   1   9.472  18.538   3.135
   11    HE3  MET   1           2HE      MET   1   9.582  19.450   1.632
   12    H    ASP   2           H        ASP   2   9.416  11.486   3.561
   13    HA   ASP   2           HA       ASP   2   9.672   9.794   1.260
   14    HB2  ASP   2           1HB      ASP   2  11.979   9.554   2.231
   15    HB3  ASP   2           2HB      ASP   2  11.269   8.961   3.725
   16    H    LEU   3           H        LEU   3   7.374  10.097   1.782
   17    HA   LEU   3           HA       LEU   3   6.263   9.028   4.149
   18    HB2  LEU   3           1HB      LEU   3   5.105   9.853   1.515
   19    HB3  LEU   3           2HB      LEU   3   4.064   9.029   2.668
   20    HG   LEU   3           HG       LEU   3   3.903  11.507   2.820
   21   HD11  LEU   3          1HD1      LEU   3   3.727  11.699   5.118
   22   HD12  LEU   3          2HD1      LEU   3   5.095  10.644   5.453
   23   HD13  LEU   3          3HD1      LEU   3   3.571   9.965   4.876
   24   HD21  LEU   3          3HD2      LEU   3   5.717  12.883   3.657
   25   HD22  LEU   3          1HD2      LEU   3   6.302  12.007   2.242
   26   HD23  LEU   3          2HD2      LEU   3   6.753  11.474   3.863
   27    HA   PRO   4           HA       PRO   4   6.512   4.619   3.356
   28    HB2  PRO   4           1HB      PRO   4   3.723   4.489   4.561
   29    HB3  PRO   4           2HB      PRO   4   5.152   3.500   4.953
   30    HG2  PRO   4           1HG      PRO   4   4.449   5.446   6.586
   31    HG3  PRO   4           2HG      PRO   4   6.164   5.260   6.160
   32    HD2  PRO   4           1HD      PRO   4   4.159   7.276   5.042
   33    HD3  PRO   4           2HD      PRO   4   5.831   7.520   5.584
   34    H    ILE   5           H        ILE   5   3.598   6.370   2.476
   35    HA   ILE   5           HA       ILE   5   3.004   4.456   0.242
   36    HB   ILE   5           HB       ILE   5   1.157   6.418   1.674
   37   HG12  ILE   5          1HG1      ILE   5   1.130   3.351   1.734
   38   HG13  ILE   5          2HG1      ILE   5   1.879   4.321   2.989
   39   HG21  ILE   5          1HG2      ILE   5   0.612   4.367  -0.531
   40   HG22  ILE   5          2HG2      ILE   5   0.465   6.115  -0.686
   41   HG23  ILE   5          3HG2      ILE   5  -0.648   5.233   0.346
   42   HD11  ILE   5          3HD1      ILE   5  -0.252   5.409   3.478
   43   HD12  ILE   5          1HD1      ILE   5  -0.384   3.659   3.630
   44   HD13  ILE   5          2HD1      ILE   5  -1.040   4.468   2.208
   45    H    THR   6           H        THR   6   3.263   5.168  -1.765
   46    HA   THR   6           HA       THR   6   3.239   8.100  -2.354
   47    HB   THR   6           HB       THR   6   5.259   6.133  -3.525
   48    HG1  THR   6           HG1      THR   6   6.641   7.649  -2.192
   49   HG21  THR   6          3HG2      THR   6   5.047   9.172  -3.646
   50   HG22  THR   6          1HG2      THR   6   4.742   8.070  -4.990
   51   HG23  THR   6          2HG2      THR   6   6.363   8.215  -4.317
   52    H    LEU   7           H        LEU   7   1.774   8.524  -3.820
   53    HA   LEU   7           HA       LEU   7   0.790   6.418  -5.672
   54    HB2  LEU   7           1HB      LEU   7  -0.432   9.103  -4.953
   55    HB3  LEU   7           2HB      LEU   7  -1.218   7.774  -5.807
   56    HG   LEU   7           HG       LEU   7  -0.285   7.763  -2.892
   57   HD11  LEU   7          1HD1      LEU   7  -2.314   9.076  -3.275
   58   HD12  LEU   7          2HD1      LEU   7  -2.692   7.614  -2.374
   59   HD13  LEU   7          3HD1      LEU   7  -3.070   7.709  -4.094
   60   HD21  LEU   7          3HD2      LEU   7  -1.468   5.529  -4.592
   61   HD22  LEU   7          1HD2      LEU   7  -1.579   5.514  -2.828
   62   HD23  LEU   7          2HD2      LEU   7  -0.006   5.494  -3.608
   63    H    SER   8           H        SER   8   0.662   6.785  -7.885
   64    HA   SER   8           HA       SER   8   2.512   8.820  -8.983
   65    HB2  SER   8           1HB      SER   8   2.808   6.505  -9.747
   66    HB3  SER   8           2HB      SER   8   1.130   6.447 -10.285
   67    HG   SER   8           HG       SER   8   1.581   7.894 -11.856
   68    H    LYS   9           H        LYS   9   0.991  10.548  -8.452
   69    HA   LYS   9           HA       LYS   9  -1.239  10.875 -10.385
   70    HB2  LYS   9           1HB      LYS   9  -1.975  12.634  -8.525
   71    HB3  LYS   9           2HB      LYS   9  -2.322  10.919  -8.315
   72    HG2  LYS   9           1HG      LYS   9  -1.440  11.884  -6.231
   73    HG3  LYS   9           2HG      LYS   9  -0.335  10.668  -6.858
   74    HD2  LYS   9           1HD      LYS   9   1.130  12.431  -7.772
   75    HD3  LYS   9           2HD      LYS   9  -0.008  13.673  -7.248
   76    HE2  LYS   9           1HE      LYS   9   0.372  13.019  -4.896
   77    HE3  LYS   9           2HE      LYS   9   1.472  11.740  -5.417
   78    HZ1  LYS   9           3HZ      LYS   9   2.477  13.879  -6.679
   79    HZ2  LYS   9           1HZ      LYS   9   3.021  13.313  -5.176
   80    HZ3  LYS   9           2HZ      LYS   9   1.905  14.592  -5.246
   81    H    GLU  10           H        GLU  10   0.919  11.389 -11.637
   82    HA   GLU  10           HA       GLU  10   2.296  13.784 -11.294
   83    HB2  GLU  10           1HB      GLU  10   2.844  11.972 -12.949
   84    HB3  GLU  10           2HB      GLU  10   1.510  12.527 -13.951
   85    HG2  GLU  10           1HG      GLU  10   3.578  13.494 -14.821
   86    HG3  GLU  10           2HG      GLU  10   2.641  14.795 -14.100
   87    H    THR  11           H        THR  11  -0.879  13.221 -12.680
   88    HA   THR  11           HA       THR  11  -1.315  16.167 -12.900
   89    HB   THR  11           HB       THR  11  -1.239  15.412 -15.162
   90    HG1  THR  11           HG1      THR  11  -3.782  15.215 -15.417
   91   HG21  THR  11          3HG2      THR  11  -2.516  13.469 -15.984
   92   HG22  THR  11          1HG2      THR  11  -3.086  13.133 -14.360
   93   HG23  THR  11          2HG2      THR  11  -1.376  12.967 -14.743
   94    HA   PRO  12           HA       PRO  12  -4.765  14.946 -10.205
   95    HB2  PRO  12           1HB      PRO  12  -5.827  17.342  -9.595
   96    HB3  PRO  12           2HB      PRO  12  -4.162  16.957  -9.084
   97    HG2  PRO  12           1HG      PRO  12  -5.038  18.531 -11.514
   98    HG3  PRO  12           2HG      PRO  12  -3.863  18.991 -10.267
   99    HD2  PRO  12           1HD      PRO  12  -3.064  17.839 -12.645
  100    HD3  PRO  12           2HD      PRO  12  -2.184  17.559 -11.120
  101    H    PHE  13           H        PHE  13  -6.208  13.787 -11.431
  102    HA   PHE  13           HA       PHE  13  -8.551  15.090 -12.427
  103    HB2  PHE  13           1HB      PHE  13  -6.814  15.455 -14.330
  104    HB3  PHE  13           2HB      PHE  13  -6.912  13.729 -14.621
  105    HD1  PHE  13           HD2      PHE  13  -8.840  16.920 -14.605
  106    HD2  PHE  13           HD1      PHE  13  -8.922  12.745 -15.678
  107    HE1  PHE  13           HE2      PHE  13 -10.914  17.293 -15.911
  108    HE2  PHE  13           HE1      PHE  13 -10.999  13.131 -16.980
  109    HZ   PHE  13           HZ       PHE  13 -11.993  15.401 -17.097
  110    H    GLU  14           H        GLU  14 -10.082  13.724 -11.812
  111    HA   GLU  14           HA       GLU  14  -9.728  11.072 -11.023
  112    HB2  GLU  14           1HB      GLU  14 -11.693  12.708 -10.540
  113    HB3  GLU  14           2HB      GLU  14 -12.381  12.153 -12.060
  114    HG2  GLU  14           1HG      GLU  14 -13.376  10.791 -10.314
  115    HG3  GLU  14           2HG      GLU  14 -12.211   9.756 -11.141
  116    H    GLY  15           H        GLY  15 -10.340   9.059 -11.970
  117    HA2  GLY  15           1HA      GLY  15 -10.914   7.599 -13.740
  118    HA3  GLY  15           2HA      GLY  15 -10.838   8.930 -14.884
  119    H    GLU  16           H        GLU  16  -8.188   9.711 -13.553
  120    HA   GLU  16           HA       GLU  16  -6.475   8.277 -15.395
  121    HB2  GLU  16           1HB      GLU  16  -5.819  10.218 -13.141
  122    HB3  GLU  16           2HB      GLU  16  -4.609   9.570 -14.246
  123    HG2  GLU  16           1HG      GLU  16  -7.028  11.214 -15.102
  124    HG3  GLU  16           2HG      GLU  16  -5.392  11.841 -14.919
  125    H    GLU  17           H        GLU  17  -5.460   6.429 -15.087
  126    HA   GLU  17           HA       GLU  17  -5.762   4.886 -12.719
  127    HB2  GLU  17           1HB      GLU  17  -5.400   3.942 -15.019
  128    HB3  GLU  17           2HB      GLU  17  -3.725   4.490 -14.960
  129    HG2  GLU  17           1HG      GLU  17  -3.338   3.068 -12.953
  130    HG3  GLU  17           2HG      GLU  17  -5.014   2.533 -13.005
  131    H    ILE  18           H        ILE  18  -4.544   4.799 -10.914
  132    HA   ILE  18           HA       ILE  18  -1.906   6.231 -10.832
  133    HB   ILE  18           HB       ILE  18  -2.420   6.667  -8.404
  134   HG12  ILE  18          1HG1      ILE  18  -5.279   5.839  -9.139
  135   HG13  ILE  18          2HG1      ILE  18  -4.191   4.839  -8.186
  136   HG21  ILE  18          1HG2      ILE  18  -2.764   8.422 -10.123
  137   HG22  ILE  18          2HG2      ILE  18  -3.974   8.558  -8.853
  138   HG23  ILE  18          3HG2      ILE  18  -4.406   7.837 -10.401
  139   HD11  ILE  18          3HD1      ILE  18  -5.148   7.620  -7.425
  140   HD12  ILE  18          1HD1      ILE  18  -4.009   6.648  -6.493
  141   HD13  ILE  18          2HD1      ILE  18  -5.671   6.107  -6.699
  142    H    THR  19           H        THR  19  -0.257   5.307  -9.704
  143    HA   THR  19           HA       THR  19  -0.450   2.389  -9.320
  144    HB   THR  19           HB       THR  19   1.973   4.238  -9.323
  145    HG1  THR  19           HG1      THR  19   2.169   3.708 -11.407
  146   HG21  THR  19          3HG2      THR  19   1.707   1.203  -9.385
  147   HG22  THR  19          1HG2      THR  19   2.500   2.166  -8.136
  148   HG23  THR  19          2HG2      THR  19   3.196   2.067  -9.752
  149    H    VAL  20           H        VAL  20  -0.782   1.611  -7.346
  150    HA   VAL  20           HA       VAL  20  -0.237   3.304  -4.956
  151    HB   VAL  20           HB       VAL  20  -1.811   0.688  -5.112
  152   HG11  VAL  20          1HG1      VAL  20  -2.778   1.541  -2.965
  153   HG12  VAL  20          2HG1      VAL  20  -1.684   2.914  -3.020
  154   HG13  VAL  20          3HG1      VAL  20  -1.041   1.281  -2.837
  155   HG21  VAL  20          3HG2      VAL  20  -3.838   2.136  -5.127
  156   HG22  VAL  20          1HG2      VAL  20  -2.867   2.392  -6.572
  157   HG23  VAL  20          2HG2      VAL  20  -2.818   3.565  -5.259
  158    H    SER  21           H        SER  21   1.585   2.927  -3.855
  159    HA   SER  21           HA       SER  21   2.832   0.206  -3.866
  160    HB2  SER  21           1HB      SER  21   5.011   1.358  -3.705
  161    HB3  SER  21           2HB      SER  21   4.183   1.809  -5.184
  162    HG   SER  21           HG       SER  21   5.124   3.426  -3.430
  163    H    ALA  22           H        ALA  22   3.256  -0.629  -1.937
  164    HA   ALA  22           HA       ALA  22   3.023   1.066   0.526
  165    HB1  ALA  22           3HB      ALA  22   2.088  -1.771   0.006
  166    HB2  ALA  22           1HB      ALA  22   1.057  -0.365   0.243
  167    HB3  ALA  22           2HB      ALA  22   2.040  -0.972   1.579
  168    H    ARG  23           H        ARG  23   4.892   1.152   1.574
  169    HA   ARG  23           HA       ARG  23   7.042  -0.782   1.054
  170    HB2  ARG  23           1HB      ARG  23   6.936   1.682   2.841
  171    HB3  ARG  23           2HB      ARG  23   8.381   0.714   2.528
  172    HG2  ARG  23           1HG      ARG  23   8.159   1.212   0.086
  173    HG3  ARG  23           2HG      ARG  23   6.761   2.225   0.433
  174    HD2  ARG  23           1HD      ARG  23   8.183   3.685   1.848
  175    HD3  ARG  23           2HD      ARG  23   9.576   2.666   1.496
  176    HE   ARG  23           HE       ARG  23   8.322   3.624  -0.908
  177   HH11  ARG  23          1HH2      ARG  23  10.434   4.523   1.701
  178   HH12  ARG  23          2HH2      ARG  23  11.266   5.735   0.785
  179   HH21  ARG  23          1HH1      ARG  23   9.414   5.225  -2.097
  180   HH22  ARG  23          2HH1      ARG  23  10.684   6.137  -1.355
  181    H    VAL  24           H        VAL  24   7.330  -2.552   2.234
  182    HA   VAL  24           HA       VAL  24   6.075  -2.795   4.932
  183    HB   VAL  24           HB       VAL  24   6.111  -5.195   4.549
  184   HG11  VAL  24          1HG1      VAL  24   4.484  -5.301   2.705
  185   HG12  VAL  24          2HG1      VAL  24   5.049  -3.756   2.077
  186   HG13  VAL  24          3HG1      VAL  24   4.213  -3.824   3.623
  187   HG21  VAL  24          3HG2      VAL  24   6.784  -6.110   2.266
  188   HG22  VAL  24          1HG2      VAL  24   8.140  -5.549   3.237
  189   HG23  VAL  24          2HG2      VAL  24   7.511  -4.545   1.941
  190    H    THR  25           H        THR  25   7.362  -2.937   6.659
  191    HA   THR  25           HA       THR  25  10.289  -2.995   6.308
  192    HB   THR  25           HB       THR  25   8.618  -2.608   8.831
  193    HG1  THR  25           HG1      THR  25   8.221  -0.981   7.362
  194   HG21  THR  25          3HG2      THR  25  10.955  -3.261   9.326
  195   HG22  THR  25          1HG2      THR  25  10.710  -1.555   9.692
  196   HG23  THR  25          2HG2      THR  25  11.547  -2.025   8.215
  197    H    ASN  26           H        ASN  26  11.418  -4.833   6.510
  198    HA   ASN  26           HA       ASN  26  10.182  -7.320   7.292
  199    HB2  ASN  26           1HB      ASN  26  11.992  -7.114   5.582
  200    HB3  ASN  26           2HB      ASN  26  13.143  -6.735   6.845
  201   HD21  ASN  26          2HD2      ASN  26  13.531  -9.042   5.248
  202   HD22  ASN  26          1HD2      ASN  26  13.265 -10.428   6.188
  203    H    ARG  27           H        ARG  27   9.813  -7.838   9.361
  204    HA   ARG  27           HA       ARG  27  11.699  -6.940  11.511
  205    HB2  ARG  27           1HB      ARG  27   8.729  -7.613  11.639
  206    HB3  ARG  27           2HB      ARG  27   9.734  -7.147  13.016
  207    HG2  ARG  27           1HG      ARG  27  10.213  -4.962  11.917
  208    HG3  ARG  27           2HG      ARG  27   9.195  -5.428  10.556
  209    HD2  ARG  27           1HD      ARG  27   7.916  -3.990  12.078
  210    HD3  ARG  27           2HD      ARG  27   7.251  -5.623  12.117
  211    HE   ARG  27           HE       ARG  27   7.900  -5.787  14.338
  212   HH11  ARG  27          1HH2      ARG  27   9.624  -3.174  12.817
  213   HH12  ARG  27          2HH2      ARG  27  10.385  -2.651  14.283
  214   HH21  ARG  27          1HH1      ARG  27   8.899  -5.095  16.243
  215   HH22  ARG  27          2HH1      ARG  27   9.976  -3.737  16.218
  216    H    GLY  28           H        GLY  28  13.091  -8.670  11.500
  217    HA2  GLY  28           1HA      GLY  28  12.228 -11.059  12.857
  218    HA3  GLY  28           2HA      GLY  28  12.617 -11.352  11.161
  219    H    ALA  29           H        ALA  29  13.971 -12.352  13.526
  220    HA   ALA  29           HA       ALA  29  16.510 -10.942  13.777
  221    HB1  ALA  29           3HB      ALA  29  15.629 -13.681  14.767
  222    HB2  ALA  29           1HB      ALA  29  15.515 -12.176  15.677
  223    HB3  ALA  29           2HB      ALA  29  17.099 -12.833  15.254
  224    H    ALA  30           H        ALA  30  15.233 -12.706  11.332
  225    HA   ALA  30           HA       ALA  30  17.876 -13.444  10.254
  226    HB1  ALA  30           3HB      ALA  30  15.605 -15.452  10.535
  227    HB2  ALA  30           1HB      ALA  30  17.112 -15.476  11.448
  228    HB3  ALA  30           2HB      ALA  30  17.135 -15.737   9.703
  229    H    GLU  31           H        GLU  31  17.636 -14.236   7.967
  230    HA   GLU  31           HA       GLU  31  16.182 -12.305   6.442
  231    HB2  GLU  31           1HB      GLU  31  17.581 -14.868   5.561
  232    HB3  GLU  31           2HB      GLU  31  16.972 -13.628   4.468
  233    HG2  GLU  31           1HG      GLU  31  19.351 -13.219   4.775
  234    HG3  GLU  31           2HG      GLU  31  18.485 -11.945   5.630
  235    H    ALA  32           H        ALA  32  14.119 -12.354   5.786
  236    HA   ALA  32           HA       ALA  32  12.546 -14.895   5.871
  237    HB1  ALA  32           3HB      ALA  32  11.823 -13.171   7.499
  238    HB2  ALA  32           1HB      ALA  32  10.594 -13.432   6.259
  239    HB3  ALA  32           2HB      ALA  32  11.636 -12.007   6.190
  240    H    HIS  33           H        HIS  33  10.855 -15.089   4.284
  241    HA   HIS  33           HA       HIS  33  10.806 -13.356   1.958
  242    HB2  HIS  33           1HB      HIS  33  11.454 -15.313   0.405
  243    HB3  HIS  33           2HB      HIS  33  12.777 -14.569   1.303
  244    HD1  HIS  33           HD1      HIS  33  10.577 -16.707   3.363
  245    HD2  HIS  33           HD2      HIS  33  14.071 -17.142   1.154
  246    HE1  HIS  33           HE1      HIS  33  11.622 -18.884   4.121
  247    HE2  HIS  33           HE2      HIS  33  13.759 -19.175   2.778
  248    H    ASN  34           H        ASN  34   8.647 -13.189   2.409
  249    HA   ASN  34           HA       ASN  34   6.748 -14.592   1.098
  250    HB2  ASN  34           1HB      ASN  34   5.641 -16.107   2.917
  251    HB3  ASN  34           2HB      ASN  34   7.082 -16.754   2.168
  252   HD21  ASN  34          2HD2      ASN  34   6.055 -14.853   5.046
  253   HD22  ASN  34          1HD2      ASN  34   7.300 -15.422   6.050
  254    H    VAL  35           H        VAL  35   6.788 -12.046   1.639
  255    HA   VAL  35           HA       VAL  35   4.769 -11.502   3.766
  256    HB   VAL  35           HB       VAL  35   6.824  -9.642   2.512
  257   HG11  VAL  35          1HG1      VAL  35   4.865  -9.240   4.828
  258   HG12  VAL  35          2HG1      VAL  35   4.777  -8.441   3.259
  259   HG13  VAL  35          3HG1      VAL  35   6.112  -8.089   4.345
  260   HG21  VAL  35          3HG2      VAL  35   7.891  -9.777   4.807
  261   HG22  VAL  35          1HG2      VAL  35   7.885 -11.343   3.995
  262   HG23  VAL  35          2HG2      VAL  35   6.711 -10.996   5.263
  263    HA   PRO  36           HA       PRO  36   2.727 -10.559  -0.299
  264    HB2  PRO  36           1HB      PRO  36   0.405 -11.902  -0.028
  265    HB3  PRO  36           2HB      PRO  36   1.917 -12.792  -0.327
  266    HG2  PRO  36           1HG      PRO  36   0.519 -12.333   2.306
  267    HG3  PRO  36           2HG      PRO  36   1.146 -13.853   1.635
  268    HD2  PRO  36           1HD      PRO  36   2.587 -12.317   3.422
  269    HD3  PRO  36           2HD      PRO  36   3.382 -13.345   2.226
  270    H    VAL  37           H        VAL  37   2.489  -8.393   0.113
  271    HA   VAL  37           HA       VAL  37   0.881  -7.320   2.218
  272    HB   VAL  37           HB       VAL  37   2.784  -6.124   1.156
  273   HG11  VAL  37          1HG1      VAL  37   2.349  -6.790  -1.210
  274   HG12  VAL  37          2HG1      VAL  37   2.580  -5.053  -1.028
  275   HG13  VAL  37          3HG1      VAL  37   0.958  -5.704  -1.242
  276   HG21  VAL  37          3HG2      VAL  37   0.150  -4.618   0.890
  277   HG22  VAL  37          1HG2      VAL  37   1.741  -3.901   1.132
  278   HG23  VAL  37          2HG2      VAL  37   1.014  -4.870   2.408
  279    H    ALA  38           H        ALA  38  -1.199  -6.519   2.154
  280    HA   ALA  38           HA       ALA  38  -2.846  -7.011  -0.291
  281    HB1  ALA  38           3HB      ALA  38  -4.646  -7.726   1.247
  282    HB2  ALA  38           1HB      ALA  38  -3.563  -7.506   2.628
  283    HB3  ALA  38           2HB      ALA  38  -3.222  -8.752   1.431
  284    H    VAL  39           H        VAL  39  -3.645  -5.126  -0.989
  285    HA   VAL  39           HA       VAL  39  -4.183  -2.915   0.937
  286    HB   VAL  39           HB       VAL  39  -3.703  -2.752  -2.075
  287   HG11  VAL  39          1HG1      VAL  39  -3.820  -0.612   0.100
  288   HG12  VAL  39          2HG1      VAL  39  -5.039  -0.871  -1.147
  289   HG13  VAL  39          3HG1      VAL  39  -3.432  -0.327  -1.591
  290   HG21  VAL  39          3HG2      VAL  39  -1.803  -2.199   0.248
  291   HG22  VAL  39          1HG2      VAL  39  -1.461  -1.862  -1.449
  292   HG23  VAL  39          2HG2      VAL  39  -1.657  -3.524  -0.907
  293    H    TYR  40           H        TYR  40  -6.150  -1.943   0.920
  294    HA   TYR  40           HA       TYR  40  -8.199  -2.659  -1.055
  295    HB2  TYR  40           1HB      TYR  40  -9.786  -3.408   0.757
  296    HB3  TYR  40           2HB      TYR  40  -8.431  -4.509   0.505
  297    HD1  TYR  40           HD1      TYR  40  -6.516  -4.591   2.115
  298    HD2  TYR  40           HD2      TYR  40  -9.962  -2.104   2.869
  299    HE1  TYR  40           HE1      TYR  40  -5.818  -4.315   4.483
  300    HE2  TYR  40           HE2      TYR  40  -9.248  -1.844   5.226
  301    HH   TYR  40           HH       TYR  40  -6.983  -1.969   6.481
  302    H    LEU  41           H        LEU  41  -9.316  -0.888  -1.507
  303    HA   LEU  41           HA       LEU  41  -8.986   1.547   0.031
  304    HB2  LEU  41           1HB      LEU  41  -9.242   1.389  -2.516
  305    HB3  LEU  41           2HB      LEU  41 -10.951   1.079  -2.254
  306    HG   LEU  41           HG       LEU  41 -10.698   3.371  -0.723
  307   HD11  LEU  41          1HD1      LEU  41  -8.264   3.585  -1.248
  308   HD12  LEU  41          2HD1      LEU  41  -9.194   4.980  -1.792
  309   HD13  LEU  41          3HD1      LEU  41  -8.660   3.768  -2.960
  310   HD21  LEU  41          3HD2      LEU  41 -12.332   3.119  -2.543
  311   HD22  LEU  41          1HD2      LEU  41 -11.061   3.332  -3.740
  312   HD23  LEU  41          2HD2      LEU  41 -11.516   4.674  -2.694
  313    H    GLY  42           H        GLY  42 -10.274   2.272   1.638
  314    HA2  GLY  42           1HA      GLY  42 -12.594   2.732   2.356
  315    HA3  GLY  42           2HA      GLY  42 -12.965   1.033   2.089
  316    H    ASN  43           H        ASN  43 -13.648   0.980   4.291
  317    HA   ASN  43           HA       ASN  43 -11.449   0.922   6.298
  318    HB2  ASN  43           1HB      ASN  43 -14.389   1.505   6.649
  319    HB3  ASN  43           2HB      ASN  43 -13.212   1.448   7.956
  320   HD21  ASN  43          2HD2      ASN  43 -13.523   3.064   4.718
  321   HD22  ASN  43          1HD2      ASN  43 -12.912   4.556   5.253
  322    HA   PRO  44           HA       PRO  44 -12.175  -3.517   6.710
  323    HB2  PRO  44           1HB      PRO  44 -11.941  -2.968   9.693
  324    HB3  PRO  44           2HB      PRO  44 -11.180  -4.265   8.738
  325    HG2  PRO  44           1HG      PRO  44  -9.738  -2.162   9.459
  326    HG3  PRO  44           2HG      PRO  44  -9.587  -2.806   7.808
  327    HD2  PRO  44           1HD      PRO  44 -11.061  -0.310   8.718
  328    HD3  PRO  44           2HD      PRO  44 -10.108  -0.595   7.243
  329    H    ALA  45           H        ALA  45 -13.857  -1.381   9.011
  330    HA   ALA  45           HA       ALA  45 -15.966  -3.166   9.703
  331    HB1  ALA  45           3HB      ALA  45 -15.371  -1.167  11.037
  332    HB2  ALA  45           1HB      ALA  45 -17.077  -1.142  10.583
  333    HB3  ALA  45           2HB      ALA  45 -15.918  -0.126   9.723
  334    H    GLN  46           H        GLN  46 -15.700  -0.621   7.234
  335    HA   GLN  46           HA       GLN  46 -18.382  -0.805   6.281
  336    HB2  GLN  46           1HB      GLN  46 -16.673   1.064   5.872
  337    HB3  GLN  46           2HB      GLN  46 -15.963   0.054   4.620
  338    HG2  GLN  46           1HG      GLN  46 -18.870   0.992   4.673
  339    HG3  GLN  46           2HG      GLN  46 -17.596   1.736   3.714
  340   HE21  GLN  46          2HE2      GLN  46 -16.530   0.241   2.039
  341   HE22  GLN  46          1HE2      GLN  46 -17.502  -0.952   1.324
  342    H    GLY  47           H        GLY  47 -15.368  -2.062   4.811
  343    HA2  GLY  47           1HA      GLY  47 -15.866  -4.643   4.317
  344    HA3  GLY  47           2HA      GLY  47 -16.890  -3.908   3.084
  345    H    GLY  48           H        GLY  48 -13.569  -4.259   4.223
  346    HA2  GLY  48           1HA      GLY  48 -12.264  -2.821   2.156
  347    HA3  GLY  48           2HA      GLY  48 -11.549  -4.094   3.139
  348    H    VAL  49           H        VAL  49 -11.879  -3.339   0.058
  349    HA   VAL  49           HA       VAL  49 -12.517  -6.094  -0.929
  350    HB   VAL  49           HB       VAL  49 -12.523  -3.454  -2.466
  351   HG11  VAL  49          1HG1      VAL  49 -13.741  -4.795  -4.187
  352   HG12  VAL  49          2HG1      VAL  49 -13.519  -6.242  -3.204
  353   HG13  VAL  49          3HG1      VAL  49 -12.122  -5.432  -3.909
  354   HG21  VAL  49          3HG2      VAL  49 -14.841  -5.074  -1.321
  355   HG22  VAL  49          1HG2      VAL  49 -15.006  -3.663  -2.369
  356   HG23  VAL  49          2HG2      VAL  49 -14.317  -3.486  -0.761
  357    H    GLU  50           H        GLU  50 -10.862  -7.253  -1.652
  358    HA   GLU  50           HA       GLU  50  -8.176  -6.253  -1.689
  359    HB2  GLU  50           1HB      GLU  50  -8.806  -8.636  -1.206
  360    HB3  GLU  50           2HB      GLU  50  -9.243  -8.843  -2.897
  361    HG2  GLU  50           1HG      GLU  50  -6.980  -9.714  -2.559
  362    HG3  GLU  50           2HG      GLU  50  -6.864  -8.253  -3.532
  363    H    ILE  51           H        ILE  51  -7.214  -5.106  -3.253
  364    HA   ILE  51           HA       ILE  51  -8.436  -4.883  -5.945
  365    HB   ILE  51           HB       ILE  51  -6.112  -3.322  -4.719
  366   HG12  ILE  51          1HG1      ILE  51  -9.045  -2.492  -5.016
  367   HG13  ILE  51          2HG1      ILE  51  -8.337  -3.042  -3.504
  368   HG21  ILE  51          1HG2      ILE  51  -7.806  -2.870  -7.231
  369   HG22  ILE  51          2HG2      ILE  51  -6.084  -3.242  -7.193
  370   HG23  ILE  51          3HG2      ILE  51  -6.658  -1.696  -6.595
  371   HD11  ILE  51          3HD1      ILE  51  -7.479  -0.590  -5.069
  372   HD12  ILE  51          1HD1      ILE  51  -6.698  -1.177  -3.597
  373   HD13  ILE  51          2HD1      ILE  51  -8.364  -0.617  -3.550
  374    H    GLY  52           H        GLY  52  -5.334  -5.695  -4.411
  375    HA2  GLY  52           1HA      GLY  52  -4.653  -7.738  -6.221
  376    HA3  GLY  52           2HA      GLY  52  -3.883  -6.249  -6.768
  377    H    ARG  53           H        ARG  53  -2.296  -8.319  -6.055
  378    HA   ARG  53           HA       ARG  53  -0.767  -7.200  -3.850
  379    HB2  ARG  53           1HB      ARG  53  -0.732  -9.324  -2.545
  380    HB3  ARG  53           2HB      ARG  53  -2.337  -8.596  -2.590
  381    HG2  ARG  53           1HG      ARG  53  -3.000 -10.147  -4.413
  382    HG3  ARG  53           2HG      ARG  53  -1.402 -10.886  -4.372
  383    HD2  ARG  53           1HD      ARG  53  -1.775 -11.576  -2.020
  384    HD3  ARG  53           2HD      ARG  53  -3.383 -10.851  -2.067
  385    HE   ARG  53           HE       ARG  53  -3.191 -12.646  -4.218
  386   HH11  ARG  53          1HH2      ARG  53  -3.197 -12.704  -0.735
  387   HH12  ARG  53          2HH2      ARG  53  -3.897 -14.285  -0.640
  388   HH21  ARG  53          1HH1      ARG  53  -4.099 -14.701  -4.074
  389   HH22  ARG  53          2HH1      ARG  53  -4.406 -15.412  -2.524
  390    H    ASP  54           H        ASP  54   1.236  -8.528  -3.489
  391    HA   ASP  54           HA       ASP  54   2.137 -10.273  -5.618
  392    HB2  ASP  54           1HB      ASP  54   2.255  -8.024  -6.715
  393    HB3  ASP  54           2HB      ASP  54   3.343  -7.474  -5.448
  394    H    THR  55           H        THR  55   3.243 -11.705  -4.438
  395    HA   THR  55           HA       THR  55   4.496 -11.052  -1.922
  396    HB   THR  55           HB       THR  55   4.789 -13.606  -3.570
  397    HG1  THR  55           HG1      THR  55   2.658 -13.353  -3.254
  398   HG21  THR  55          3HG2      THR  55   5.059 -13.052  -0.583
  399   HG22  THR  55          1HG2      THR  55   6.390 -13.412  -1.684
  400   HG23  THR  55          2HG2      THR  55   5.174 -14.638  -1.341
  401    H    ILE  56           H        ILE  56   6.645 -10.761  -1.490
  402    HA   ILE  56           HA       ILE  56   8.350  -9.971  -3.693
  403    HB   ILE  56           HB       ILE  56   9.108 -10.215  -0.742
  404   HG12  ILE  56          1HG1      ILE  56   7.049  -8.881  -0.845
  405   HG13  ILE  56          2HG1      ILE  56   8.416  -7.832  -0.502
  406   HG21  ILE  56          1HG2      ILE  56  11.070  -9.793  -2.107
  407   HG22  ILE  56          2HG2      ILE  56  10.628  -8.223  -1.436
  408   HG23  ILE  56          3HG2      ILE  56  10.228  -8.603  -3.099
  409   HD11  ILE  56          3HD1      ILE  56   7.114  -6.663  -2.094
  410   HD12  ILE  56          1HD1      ILE  56   6.873  -8.094  -3.091
  411   HD13  ILE  56          2HD1      ILE  56   8.452  -7.309  -3.038
  412    H    SER  57           H        SER  57  10.194 -11.012  -4.440
  413    HA   SER  57           HA       SER  57  10.275 -13.863  -4.277
  414    HB2  SER  57           1HB      SER  57  12.359 -11.918  -5.324
  415    HB3  SER  57           2HB      SER  57  12.349 -13.655  -5.619
  416    HG   SER  57           HG       SER  57  11.356 -12.258  -7.265
  417    H    ARG  58           H        ARG  58  12.448 -11.346  -2.995
  418    HA   ARG  58           HA       ARG  58  13.159 -13.098  -0.722
  419    HB2  ARG  58           1HB      ARG  58  14.825 -13.624  -2.494
  420    HB3  ARG  58           2HB      ARG  58  15.283 -11.923  -2.567
  421    HG2  ARG  58           1HG      ARG  58  15.984 -12.013  -0.175
  422    HG3  ARG  58           2HG      ARG  58  15.506 -13.707  -0.100
  423    HD2  ARG  58           1HD      ARG  58  17.196 -14.264  -1.812
  424    HD3  ARG  58           2HD      ARG  58  17.659 -12.565  -1.927
  425    HE   ARG  58           HE       ARG  58  18.456 -14.430   0.126
  426   HH11  ARG  58          1HH2      ARG  58  17.774 -11.086  -0.535
  427   HH12  ARG  58          2HH2      ARG  58  18.746 -10.494   0.768
  428   HH21  ARG  58          1HH1      ARG  58  19.719 -13.637   1.846
  429   HH22  ARG  58          2HH1      ARG  58  19.830 -11.929   2.120
  430    H    ILE  59           H        ILE  59  13.277 -11.987   1.086
  431    HA   ILE  59           HA       ILE  59  13.481  -9.014   0.981
  432    HB   ILE  59           HB       ILE  59  12.042 -10.605   3.121
  433   HG12  ILE  59          1HG1      ILE  59  10.971  -9.292   0.601
  434   HG13  ILE  59          2HG1      ILE  59  10.948 -11.008   0.936
  435   HG21  ILE  59          1HG2      ILE  59  11.084  -8.417   3.705
  436   HG22  ILE  59          2HG2      ILE  59  11.882  -7.657   2.328
  437   HG23  ILE  59          3HG2      ILE  59  12.836  -8.260   3.674
  438   HD11  ILE  59          3HD1      ILE  59   9.059  -8.949   1.689
  439   HD12  ILE  59          1HD1      ILE  59   9.601  -9.836   3.110
  440   HD13  ILE  59          2HD1      ILE  59   8.893 -10.700   1.751
  441    HA   PRO  60           HA       PRO  60  17.094 -10.252   3.546
  442    HB2  PRO  60           1HB      PRO  60  18.599  -7.992   3.355
  443    HB3  PRO  60           2HB      PRO  60  18.430  -9.102   1.976
  444    HG2  PRO  60           1HG      PRO  60  16.925  -6.549   2.511
  445    HG3  PRO  60           2HG      PRO  60  17.724  -7.067   1.012
  446    HD2  PRO  60           1HD      PRO  60  15.023  -7.381   1.408
  447    HD3  PRO  60           2HD      PRO  60  15.950  -8.541   0.429
  448    H    VAL  61           H        VAL  61  17.933  -9.601   5.622
  449    HA   VAL  61           HA       VAL  61  15.922  -8.596   7.407
  450    HB   VAL  61           HB       VAL  61  17.501 -10.377   8.041
  451   HG11  VAL  61          1HG1      VAL  61  19.659  -8.225   7.978
  452   HG12  VAL  61          2HG1      VAL  61  19.494  -9.537   6.811
  453   HG13  VAL  61          3HG1      VAL  61  19.869  -9.897   8.495
  454   HG21  VAL  61          3HG2      VAL  61  17.901  -7.887   9.769
  455   HG22  VAL  61          1HG2      VAL  61  18.063  -9.562  10.293
  456   HG23  VAL  61          2HG2      VAL  61  16.483  -8.935   9.823
  457    H    GLY  62           H        GLY  62  15.881  -6.676   8.594
  458    HA2  GLY  62           1HA      GLY  62  16.264  -4.471   9.093
  459    HA3  GLY  62           2HA      GLY  62  17.908  -4.665   8.495
  460    H    GLY  63           H        GLY  63  15.876  -5.748   6.125
  461    HA2  GLY  63           1HA      GLY  63  16.033  -3.218   4.582
  462    HA3  GLY  63           2HA      GLY  63  15.878  -4.847   3.938
  463    H    THR  64           H        THR  64  14.137  -3.747   2.703
  464    HA   THR  64           HA       THR  64  11.536  -4.043   4.088
  465    HB   THR  64           HB       THR  64  10.707  -1.960   3.177
  466    HG1  THR  64           HG1      THR  64  11.540  -1.519   1.312
  467   HG21  THR  64          3HG2      THR  64  12.157  -1.767   5.254
  468   HG22  THR  64          1HG2      THR  64  12.116  -0.299   4.276
  469   HG23  THR  64          2HG2      THR  64  13.511  -1.369   4.196
  470    H    GLY  65           H        GLY  65   9.822  -3.529   2.173
  471    HA2  GLY  65           1HA      GLY  65  10.613  -4.975  -0.305
  472    HA3  GLY  65           2HA      GLY  65   9.272  -5.592   0.652
  473    H    LEU  66           H        LEU  66   9.299  -4.549  -2.072
  474    HA   LEU  66           HA       LEU  66   7.206  -2.468  -1.775
  475    HB2  LEU  66           1HB      LEU  66   9.792  -2.251  -3.249
  476    HB3  LEU  66           2HB      LEU  66   8.417  -1.805  -4.245
  477    HG   LEU  66           HG       LEU  66   8.835  -0.597  -1.461
  478   HD11  LEU  66          1HD1      LEU  66   9.788   0.541  -4.121
  479   HD12  LEU  66          2HD1      LEU  66  10.830  -0.058  -2.827
  480   HD13  LEU  66          3HD1      LEU  66   9.842   1.379  -2.566
  481   HD21  LEU  66          3HD2      LEU  66   7.271   0.368  -3.904
  482   HD22  LEU  66          1HD2      LEU  66   7.367   1.211  -2.356
  483   HD23  LEU  66          2HD2      LEU  66   6.550  -0.338  -2.463
  484    H    ALA  67           H        ALA  67   5.647  -2.422  -3.363
  485    HA   ALA  67           HA       ALA  67   5.488  -4.690  -5.261
  486    HB1  ALA  67           3HB      ALA  67   3.382  -3.983  -3.174
  487    HB2  ALA  67           1HB      ALA  67   4.374  -5.440  -3.182
  488    HB3  ALA  67           2HB      ALA  67   3.187  -5.177  -4.459
  489    H    ARG  68           H        ARG  68   3.995  -4.349  -6.931
  490    HA   ARG  68           HA       ARG  68   3.176  -1.492  -7.330
  491    HB2  ARG  68           1HB      ARG  68   5.032  -2.278  -8.832
  492    HB3  ARG  68           2HB      ARG  68   3.959  -3.514  -9.480
  493    HG2  ARG  68           1HG      ARG  68   2.389  -1.750 -10.269
  494    HG3  ARG  68           2HG      ARG  68   3.437  -0.513  -9.577
  495    HD2  ARG  68           1HD      ARG  68   3.835  -0.699 -11.992
  496    HD3  ARG  68           2HD      ARG  68   5.266  -1.223 -11.102
  497    HE   ARG  68           HE       ARG  68   3.609  -3.463 -11.611
  498   HH11  ARG  68          1HH2      ARG  68   5.625  -1.179 -13.307
  499   HH12  ARG  68          2HH2      ARG  68   6.063  -2.303 -14.550
  500   HH21  ARG  68          1HH1      ARG  68   4.195  -4.908 -13.239
  501   HH22  ARG  68          2HH1      ARG  68   5.258  -4.405 -14.510
  502    H    VAL  69           H        VAL  69   1.072  -1.223  -7.308
  503    HA   VAL  69           HA       VAL  69  -0.740  -3.296  -8.445
  504    HB   VAL  69           HB       VAL  69  -1.239  -1.771  -5.845
  505   HG11  VAL  69          1HG1      VAL  69  -3.318  -2.315  -7.087
  506   HG12  VAL  69          2HG1      VAL  69  -3.188  -3.321  -5.650
  507   HG13  VAL  69          3HG1      VAL  69  -2.801  -3.996  -7.233
  508   HG21  VAL  69          3HG2      VAL  69  -0.493  -4.696  -6.304
  509   HG22  VAL  69          1HG2      VAL  69  -0.969  -4.003  -4.753
  510   HG23  VAL  69          2HG2      VAL  69   0.522  -3.480  -5.528
  511    H    GLN  70           H        GLN  70  -2.070  -2.473  -9.888
  512    HA   GLN  70           HA       GLN  70  -2.321   0.477 -10.187
  513    HB2  GLN  70           1HB      GLN  70  -3.045  -1.799 -12.074
  514    HB3  GLN  70           2HB      GLN  70  -3.175  -0.081 -12.452
  515    HG2  GLN  70           1HG      GLN  70  -0.580  -1.518 -11.745
  516    HG3  GLN  70           2HG      GLN  70  -1.087  -1.099 -13.379
  517   HE21  GLN  70          2HE2      GLN  70   1.190  -0.100 -11.429
  518   HE22  GLN  70          1HE2      GLN  70   1.092   1.587 -11.590
  519    H    TRP  71           H        TRP  71  -4.252   1.515 -10.039
  520    HA   TRP  71           HA       TRP  71  -6.736  -0.051  -9.652
  521    HB2  TRP  71           1HB      TRP  71  -5.853   0.503  -7.381
  522    HB3  TRP  71           2HB      TRP  71  -5.840   2.212  -7.807
  523    HD1  TRP  71           HD1      TRP  71  -8.473  -0.642  -8.029
  524    HE1  TRP  71           HE1      TRP  71 -10.742   0.291  -7.294
  525    HE3  TRP  71           HE3      TRP  71  -7.124   4.142  -6.903
  526    HZ2  TRP  71           HZ2      TRP  71 -11.862   2.767  -6.373
  527    HZ3  TRP  71           HZ3      TRP  71  -8.805   5.776  -6.100
  528    HH2  TRP  71           HH2      TRP  71 -11.175   5.089  -5.824
  529    H    LYS  72           H        LYS  72  -8.201   0.639 -11.004
  530    HA   LYS  72           HA       LYS  72  -7.984   3.283 -12.298
  531    HB2  LYS  72           1HB      LYS  72  -8.334   1.244 -13.668
  532    HB3  LYS  72           2HB      LYS  72  -9.864   0.950 -12.857
  533    HG2  LYS  72           1HG      LYS  72 -10.801   3.044 -13.722
  534    HG3  LYS  72           2HG      LYS  72  -9.250   3.522 -14.405
  535    HD2  LYS  72           1HD      LYS  72 -10.543   0.906 -15.315
  536    HD3  LYS  72           2HD      LYS  72 -11.100   2.431 -15.995
  537    HE2  LYS  72           1HE      LYS  72  -8.217   1.454 -16.085
  538    HE3  LYS  72           2HE      LYS  72  -9.359   1.396 -17.424
  539    HZ1  LYS  72           3HZ      LYS  72  -8.926   3.495 -17.900
  540    HZ2  LYS  72           1HZ      LYS  72  -7.710   3.497 -16.717
  541    HZ3  LYS  72           2HZ      LYS  72  -9.285   3.996 -16.317
  542    H    ALA  73           H        ALA  73  -9.196   4.965 -11.679
  543    HA   ALA  73           HA       ALA  73 -11.032   4.768  -9.466
  544    HB1  ALA  73           3HB      ALA  73 -10.514   7.055 -11.393
  545    HB2  ALA  73           1HB      ALA  73  -9.724   6.808  -9.840
  546    HB3  ALA  73           2HB      ALA  73 -11.446   7.181  -9.905
  547    H    THR  74           H        THR  74 -13.236   4.680  -9.460
  548    HA   THR  74           HA       THR  74 -14.788   4.970 -11.953
  549    HB   THR  74           HB       THR  74 -14.191   2.606 -11.996
  550    HG1  THR  74           HG1      THR  74 -16.587   2.033 -11.063
  551   HG21  THR  74          3HG2      THR  74 -13.565   2.307  -9.627
  552   HG22  THR  74          1HG2      THR  74 -14.758   1.102 -10.110
  553   HG23  THR  74          2HG2      THR  74 -15.251   2.487  -9.143
  554    H    ARG  75           H        ARG  75 -17.203   4.220 -11.228
  555    HA   ARG  75           HA       ARG  75 -19.074   4.970 -10.160
  556    HB2  ARG  75           1HB      ARG  75 -17.301   4.797  -7.694
  557    HB3  ARG  75           2HB      ARG  75 -19.055   4.920  -7.668
  558    HG2  ARG  75           1HG      ARG  75 -17.725   2.618  -9.169
  559    HG3  ARG  75           2HG      ARG  75 -17.931   2.523  -7.425
  560    HD2  ARG  75           1HD      ARG  75 -20.371   2.786  -7.665
  561    HD3  ARG  75           2HD      ARG  75 -20.198   2.991  -9.399
  562    HE   ARG  75           HE       ARG  75 -20.077   0.702  -9.608
  563   HH11  ARG  75          1HH2      ARG  75 -19.243   1.574  -6.340
  564   HH12  ARG  75          2HH2      ARG  75 -19.101  -0.068  -5.807
  565   HH21  ARG  75          1HH1      ARG  75 -19.901  -1.429  -8.887
  566   HH22  ARG  75          2HH1      ARG  75 -19.471  -1.759  -7.242
  567    H    LYS  76           H        LYS  76 -16.703   6.866 -10.880
  568    HA   LYS  76           HA       LYS  76 -17.978   9.319  -9.804
  569    HB2  LYS  76           1HB      LYS  76 -14.985   8.731  -9.692
  570    HB3  LYS  76           2HB      LYS  76 -15.718  10.302  -9.357
  571    HG2  LYS  76           1HG      LYS  76 -17.039   9.274  -7.510
  572    HG3  LYS  76           2HG      LYS  76 -16.241   7.733  -7.815
  573    HD2  LYS  76           1HD      LYS  76 -14.038   8.774  -7.313
  574    HD3  LYS  76           2HD      LYS  76 -14.852  10.302  -6.971
  575    HE2  LYS  76           1HE      LYS  76 -15.268   7.682  -5.471
  576    HE3  LYS  76           2HE      LYS  76 -14.413   9.100  -4.863
  577    HZ1  LYS  76           3HZ      LYS  76 -16.705  10.219  -5.519
  578    HZ2  LYS  76           1HZ      LYS  76 -16.447   9.514  -3.999
  579    HZ3  LYS  76           2HZ      LYS  76 -17.274   8.649  -5.205
  580    H    LEU  77           H        LEU  77 -17.891  11.055 -11.134
  581    HA   LEU  77           HA       LEU  77 -16.235  11.260 -13.438
  582    HB2  LEU  77           1HB      LEU  77 -17.744   9.488 -14.301
  583    HB3  LEU  77           2HB      LEU  77 -19.136  10.494 -13.929
  584    HG   LEU  77           HG       LEU  77 -18.344  12.182 -15.615
  585   HD11  LEU  77          1HD1      LEU  77 -15.975  11.961 -15.721
  586   HD12  LEU  77          2HD1      LEU  77 -16.517  11.331 -17.265
  587   HD13  LEU  77          3HD1      LEU  77 -16.050  10.217 -15.979
  588   HD21  LEU  77          3HD2      LEU  77 -18.853  10.824 -17.625
  589   HD22  LEU  77          1HD2      LEU  77 -19.930  10.411 -16.291
  590   HD23  LEU  77          2HD2      LEU  77 -18.581   9.347 -16.699
  591    H    ALA  78           H        ALA  78 -19.650  12.166 -13.215
  592    HA   ALA  78           HA       ALA  78 -19.137  14.909 -13.792
  593    HB1  ALA  78           3HB      ALA  78 -21.520  15.230 -13.325
  594    HB2  ALA  78           1HB      ALA  78 -21.598  13.653 -12.531
  595    HB3  ALA  78           2HB      ALA  78 -21.286  13.755 -14.261
  596    H    GLY  79           H        GLY  79 -19.970  13.239 -10.746
  597    HA2  GLY  79           1HA      GLY  79 -19.587  13.801  -8.547
  598    HA3  GLY  79           2HA      GLY  79 -18.390  14.963  -9.111
  599    H    ARG  80           H        ARG  80 -21.891  14.786  -9.754
  600    HA   ARG  80           HA       ARG  80 -22.319  17.583  -9.445
  601    HB2  ARG  80           1HB      ARG  80 -24.320  15.288  -9.298
  602    HB3  ARG  80           2HB      ARG  80 -24.733  16.993  -9.502
  603    HG2  ARG  80           1HG      ARG  80 -23.412  17.038 -11.626
  604    HG3  ARG  80           2HG      ARG  80 -23.076  15.318 -11.427
  605    HD2  ARG  80           1HD      ARG  80 -25.850  16.532 -11.693
  606    HD3  ARG  80           2HD      ARG  80 -24.981  15.707 -12.986
  607    HE   ARG  80           HE       ARG  80 -26.390  14.472 -10.792
  608   HH11  ARG  80          1HH2      ARG  80 -23.739  14.096 -13.013
  609   HH12  ARG  80          2HH2      ARG  80 -23.703  12.370 -12.877
  610   HH21  ARG  80          1HH1      ARG  80 -26.335  12.221 -10.630
  611   HH22  ARG  80          2HH1      ARG  80 -25.169  11.312 -11.531
  612    H    ALA  81           H        ALA  81 -22.678  14.839  -7.240
  613    HA   ALA  81           HA       ALA  81 -22.409  16.491  -4.898
  614    HB1  ALA  81           3HB      ALA  81 -24.673  16.093  -3.968
  615    HB2  ALA  81           1HB      ALA  81 -25.152  15.307  -5.475
  616    HB3  ALA  81           2HB      ALA  81 -24.762  17.026  -5.463
  617    H    ALA  82           H        ALA  82 -21.131  14.191  -5.989
  618    HA   ALA  82           HA       ALA  82 -21.947  11.752  -4.820
  619    HB1  ALA  82           3HB      ALA  82 -19.135  12.690  -5.510
  620    HB2  ALA  82           1HB      ALA  82 -20.269  11.956  -6.642
  621    HB3  ALA  82           2HB      ALA  82 -19.643  11.016  -5.286
  622    H    ASN  83           H        ASN  83 -19.626  10.918  -3.402
  623    HA   ASN  83           HA       ASN  83 -19.678  12.554  -0.899
  624    HB2  ASN  83           1HB      ASN  83 -21.193  10.555  -0.756
  625    HB3  ASN  83           2HB      ASN  83 -19.804   9.511  -1.039
  626   HD21  ASN  83          2HD2      ASN  83 -18.568   8.954   0.817
  627   HD22  ASN  83          1HD2      ASN  83 -18.752   9.687   2.336
  628    HA   PRO  84           HA       PRO  84 -15.267  11.920  -2.347
  629    HB2  PRO  84           1HB      PRO  84 -15.127  14.170  -0.295
  630    HB3  PRO  84           2HB      PRO  84 -14.186  13.982  -1.799
  631    HG2  PRO  84           1HG      PRO  84 -16.223  15.639  -1.825
  632    HG3  PRO  84           2HG      PRO  84 -16.080  14.470  -3.161
  633    HD2  PRO  84           1HD      PRO  84 -17.898  14.303  -0.722
  634    HD3  PRO  84           2HD      PRO  84 -18.295  13.968  -2.423
  635    H    GLY  85           H        GLY  85 -13.232  11.964  -0.681
  636    HA2  GLY  85           1HA      GLY  85 -12.310  11.208   1.351
  637    HA3  GLY  85           2HA      GLY  85 -13.894  10.664   1.896
  638    H    VAL  86           H        VAL  86 -11.194   9.954  -0.258
  639    HA   VAL  86           HA       VAL  86 -11.910   7.043  -0.264
  640    HB   VAL  86           HB       VAL  86 -10.660   7.023  -2.512
  641   HG11  VAL  86          1HG1      VAL  86 -12.631   7.729  -3.812
  642   HG12  VAL  86          2HG1      VAL  86 -13.264   8.605  -2.417
  643   HG13  VAL  86          3HG1      VAL  86 -13.137   6.848  -2.371
  644   HG21  VAL  86          3HG2      VAL  86  -9.590   9.278  -2.265
  645   HG22  VAL  86          1HG2      VAL  86 -11.177  10.033  -2.364
  646   HG23  VAL  86          2HG2      VAL  86 -10.527   9.159  -3.748
  647    HA   PRO  87           HA       PRO  87  -7.676   7.967   1.632
  648    HB2  PRO  87           1HB      PRO  87  -8.058   6.595   4.007
  649    HB3  PRO  87           2HB      PRO  87  -8.579   8.288   3.801
  650    HG2  PRO  87           1HG      PRO  87 -10.228   5.778   3.370
  651    HG3  PRO  87           2HG      PRO  87 -10.592   7.161   4.438
  652    HD2  PRO  87           1HD      PRO  87 -11.704   7.119   2.038
  653    HD3  PRO  87           2HD      PRO  87 -10.946   8.641   2.561
  654    H    VAL  88           H        VAL  88  -5.971   6.496   1.647
  655    HA   VAL  88           HA       VAL  88  -6.571   3.770   0.582
  656    HB   VAL  88           HB       VAL  88  -3.934   5.308   0.521
  657   HG11  VAL  88          1HG1      VAL  88  -3.345   3.624  -1.223
  658   HG12  VAL  88          2HG1      VAL  88  -4.894   2.821  -0.971
  659   HG13  VAL  88          3HG1      VAL  88  -3.689   2.840   0.316
  660   HG21  VAL  88          3HG2      VAL  88  -6.082   5.001  -1.627
  661   HG22  VAL  88          1HG2      VAL  88  -4.501   5.743  -1.868
  662   HG23  VAL  88          2HG2      VAL  88  -5.669   6.499  -0.792
  663    H    TYR  89           H        TYR  89  -6.574   2.243   2.093
  664    HA   TYR  89           HA       TYR  89  -4.734   2.405   4.442
  665    HB2  TYR  89           1HB      TYR  89  -7.431   1.062   4.010
  666    HB3  TYR  89           2HB      TYR  89  -6.375   0.573   5.336
  667    HD1  TYR  89           HD1      TYR  89  -5.628   2.291   7.054
  668    HD2  TYR  89           HD2      TYR  89  -8.733   3.159   4.193
  669    HE1  TYR  89           HE1      TYR  89  -6.373   4.210   8.431
  670    HE2  TYR  89           HE2      TYR  89  -9.471   5.067   5.598
  671    HH   TYR  89           HH       TYR  89  -7.858   6.592   7.610
  672    H    ALA  90           H        ALA  90  -3.475   0.683   4.974
  673    HA   ALA  90           HA       ALA  90  -3.362  -1.690   3.217
  674    HB1  ALA  90           3HB      ALA  90  -0.943  -1.368   2.826
  675    HB2  ALA  90           1HB      ALA  90  -0.999   0.174   3.689
  676    HB3  ALA  90           2HB      ALA  90  -1.867  -0.016   2.167
  677    H    VAL  91           H        VAL  91  -2.583  -3.475   4.228
  678    HA   VAL  91           HA       VAL  91  -1.540  -3.235   7.019
  679    HB   VAL  91           HB       VAL  91  -3.666  -5.208   6.061
  680   HG11  VAL  91          1HG1      VAL  91  -3.823  -5.764   8.505
  681   HG12  VAL  91          2HG1      VAL  91  -2.457  -4.695   8.819
  682   HG13  VAL  91          3HG1      VAL  91  -2.235  -6.151   7.849
  683   HG21  VAL  91          3HG2      VAL  91  -3.898  -2.754   7.864
  684   HG22  VAL  91          1HG2      VAL  91  -5.188  -3.922   7.570
  685   HG23  VAL  91          2HG2      VAL  91  -4.593  -2.921   6.252
  686    H    VAL  92           H        VAL  92   0.082  -4.598   7.507
  687    HA   VAL  92           HA       VAL  92   1.327  -6.139   5.359
  688    HB   VAL  92           HB       VAL  92   3.185  -6.364   6.966
  689   HG11  VAL  92          1HG1      VAL  92   3.715  -3.955   7.199
  690   HG12  VAL  92          2HG1      VAL  92   2.020  -3.543   6.939
  691   HG13  VAL  92          3HG1      VAL  92   2.958  -4.271   5.641
  692   HG21  VAL  92          3HG2      VAL  92   1.280  -5.018   8.946
  693   HG22  VAL  92          1HG2      VAL  92   3.011  -5.209   9.223
  694   HG23  VAL  92          2HG2      VAL  92   1.983  -6.628   9.102
  695    H    ASP  93           H        ASP  93   1.343  -8.341   5.205
  696    HA   ASP  93           HA       ASP  93  -0.578  -9.944   6.222
  697    HB2  ASP  93           1HB      ASP  93   0.541 -11.738   5.177
  698    HB3  ASP  93           2HB      ASP  93   1.389 -10.379   4.453
  699    HA   PRO  94           HA       PRO  94   0.112 -10.949  10.510
  700    HB2  PRO  94           1HB      PRO  94   0.483 -13.875   9.738
  701    HB3  PRO  94           2HB      PRO  94  -0.535 -13.185  11.031
  702    HG2  PRO  94           1HG      PRO  94  -1.700 -13.962   8.799
  703    HG3  PRO  94           2HG      PRO  94  -2.138 -12.376   9.481
  704    HD2  PRO  94           1HD      PRO  94  -0.257 -12.955   7.159
  705    HD3  PRO  94           2HD      PRO  94  -1.529 -11.720   7.290
  706    H    ASP  95           H        ASP  95   1.941 -10.612  11.699
  707    HA   ASP  95           HA       ASP  95   4.586 -11.295  10.633
  708    HB2  ASP  95           1HB      ASP  95   5.392  -9.855  12.485
  709    HB3  ASP  95           2HB      ASP  95   4.197  -9.027  11.492
  710    H    ASN  96           H        ASN  96   2.697 -13.363  11.698
  711    HA   ASN  96           HA       ASN  96   2.854 -15.317  12.817
  712    HB2  ASN  96           1HB      ASN  96   5.335 -15.150  12.102
  713    HB3  ASN  96           2HB      ASN  96   5.667 -14.600  13.735
  714   HD21  ASN  96          2HD2      ASN  96   4.290 -17.373  11.923
  715   HD22  ASN  96          1HD2      ASN  96   4.645 -18.522  13.122
  716    H    ARG  97           H        ARG  97   2.901 -12.358  14.161
  717    HA   ARG  97           HA       ARG  97   2.170 -13.386  16.857
  718    HB2  ARG  97           1HB      ARG  97   3.969 -11.053  16.147
  719    HB3  ARG  97           2HB      ARG  97   3.306 -11.280  17.764
  720    HG2  ARG  97           1HG      ARG  97   4.969 -13.463  16.407
  721    HG3  ARG  97           2HG      ARG  97   5.735 -12.167  17.316
  722    HD2  ARG  97           1HD      ARG  97   4.522 -12.823  19.351
  723    HD3  ARG  97           2HD      ARG  97   3.653 -14.071  18.480
  724    HE   ARG  97           HE       ARG  97   6.341 -14.241  19.479
  725   HH11  ARG  97          1HH2      ARG  97   4.198 -15.322  16.964
  726   HH12  ARG  97          2HH2      ARG  97   5.073 -16.787  16.666
  727   HH21  ARG  97          1HH1      ARG  97   7.470 -16.167  19.091
  728   HH22  ARG  97          2HH1      ARG  97   6.921 -17.263  17.868
  729    H    VAL  98           H        VAL  98   0.017 -13.255  15.996
  730    HA   VAL  98           HA       VAL  98  -1.183 -10.876  15.070
  731    HB   VAL  98           HB       VAL  98  -2.534 -13.115  16.646
  732   HG11  VAL  98          1HG1      VAL  98  -3.619 -11.134  14.596
  733   HG12  VAL  98          2HG1      VAL  98  -3.968 -11.112  16.323
  734   HG13  VAL  98          3HG1      VAL  98  -4.544 -12.445  15.329
  735   HG21  VAL  98          3HG2      VAL  98  -2.957 -14.151  14.424
  736   HG22  VAL  98          1HG2      VAL  98  -1.228 -14.033  14.742
  737   HG23  VAL  98          2HG2      VAL  98  -2.003 -12.886  13.651
  738    H    ALA  99           H        ALA  99  -1.479  -9.017  16.121
  739    HA   ALA  99           HA       ALA  99  -2.579  -8.804  18.750
  740    HB1  ALA  99           3HB      ALA  99  -0.349  -9.444  19.528
  741    HB2  ALA  99           1HB      ALA  99  -0.562  -7.722  19.838
  742    HB3  ALA  99           2HB      ALA  99   0.398  -8.264  18.462
  743    H    GLU 100           H        GLU 100  -3.367  -6.782  19.095
  744    HA   GLU 100           HA       GLU 100  -3.498  -4.942  16.900
  745    HB2  GLU 100           1HB      GLU 100  -4.299  -4.614  19.820
  746    HB3  GLU 100           2HB      GLU 100  -4.756  -3.517  18.514
  747    HG2  GLU 100           1HG      GLU 100  -5.928  -5.376  17.360
  748    HG3  GLU 100           2HG      GLU 100  -5.471  -6.474  18.657
  749    H    SER 101           H        SER 101  -2.175  -4.510  20.196
  750    HA   SER 101           HA       SER 101  -0.947  -2.073  19.973
  751    HB2  SER 101           1HB      SER 101   0.313  -4.502  21.295
  752    HB3  SER 101           2HB      SER 101   0.673  -2.817  21.666
  753    HG   SER 101           HG       SER 101  -1.836  -2.857  21.914
  754    H    ASP 102           H        ASP 102   0.599  -5.162  18.969
  755    HA   ASP 102           HA       ASP 102   2.967  -3.974  17.903
  756    HB2  ASP 102           1HB      ASP 102   1.656  -6.613  17.152
  757    HB3  ASP 102           2HB      ASP 102   3.316  -6.150  16.790
  758    H    LYS 103           H        LYS 103   0.228  -5.443  16.108
  759    HA   LYS 103           HA       LYS 103   0.843  -4.601  13.551
  760    HB2  LYS 103           1HB      LYS 103  -1.075  -6.076  14.143
  761    HB3  LYS 103           2HB      LYS 103  -1.945  -4.674  14.757
  762    HG2  LYS 103           1HG      LYS 103  -1.987  -3.661  12.506
  763    HG3  LYS 103           2HG      LYS 103  -0.964  -4.951  11.879
  764    HD2  LYS 103           1HD      LYS 103  -3.285  -5.389  11.234
  765    HD3  LYS 103           2HD      LYS 103  -2.780  -6.606  12.402
  766    HE2  LYS 103           1HE      LYS 103  -4.097  -5.590  14.157
  767    HE3  LYS 103           2HE      LYS 103  -4.294  -4.092  13.246
  768    HZ1  LYS 103           3HZ      LYS 103  -5.956  -4.942  12.048
  769    HZ2  LYS 103           1HZ      LYS 103  -6.092  -6.057  13.319
  770    HZ3  LYS 103           2HZ      LYS 103  -5.241  -6.476  11.909
  771    H    ALA 104           H        ALA 104  -1.079  -2.755  15.925
  772    HA   ALA 104           HA       ALA 104  -1.631  -0.447  14.481
  773    HB1  ALA 104           3HB      ALA 104  -0.861  -0.607  17.414
  774    HB2  ALA 104           1HB      ALA 104  -2.475  -0.883  16.765
  775    HB3  ALA 104           2HB      ALA 104  -1.745   0.720  16.653
  776    H    ASN 105           H        ASN 105   1.434  -1.636  15.264
  777    HA   ASN 105           HA       ASN 105   2.793   1.015  15.000
  778    HB2  ASN 105           1HB      ASN 105   4.132  -1.630  15.714
  779    HB3  ASN 105           2HB      ASN 105   4.766  -0.002  15.903
  780   HD21  ASN 105          2HD2      ASN 105   4.159  -2.193  17.957
  781   HD22  ASN 105          1HD2      ASN 105   3.185  -1.418  19.112
  782    H    ASN 106           H        ASN 106   1.461  -0.541  12.804
  783    HA   ASN 106           HA       ASN 106   3.630  -0.322  10.844
  784    HB2  ASN 106           1HB      ASN 106   2.134  -2.936  11.293
  785    HB3  ASN 106           2HB      ASN 106   3.233  -2.612   9.952
  786   HD21  ASN 106          2HD2      ASN 106   5.473  -1.576  10.967
  787   HD22  ASN 106          1HD2      ASN 106   6.127  -2.528  12.211
  788    H    VAL 107           H        VAL 107   0.977   0.922  11.532
  789    HA   VAL 107           HA       VAL 107  -0.601   0.312   9.075
  790    HB   VAL 107           HB       VAL 107  -1.376   1.972  11.517
  791   HG11  VAL 107          1HG1      VAL 107  -3.016   0.928   9.158
  792   HG12  VAL 107          2HG1      VAL 107  -2.634   2.620   9.471
  793   HG13  VAL 107          3HG1      VAL 107  -3.689   1.742  10.570
  794   HG21  VAL 107          3HG2      VAL 107  -2.766   0.006  12.124
  795   HG22  VAL 107          1HG2      VAL 107  -1.060  -0.433  12.071
  796   HG23  VAL 107          2HG2      VAL 107  -2.126  -0.881  10.741
  797    H    PHE 108           H        PHE 108  -0.813   1.779   7.482
  798    HA   PHE 108           HA       PHE 108   0.136   4.564   7.849
  799    HB2  PHE 108           1HB      PHE 108   1.046   2.788   5.542
  800    HB3  PHE 108           2HB      PHE 108   1.541   4.447   5.868
  801    HD1  PHE 108           HD1      PHE 108   2.512   4.888   8.332
  802    HD2  PHE 108           HD2      PHE 108   2.516   1.039   6.365
  803    HE1  PHE 108           HE1      PHE 108   4.327   4.115   9.822
  804    HE2  PHE 108           HE2      PHE 108   4.336   0.288   7.869
  805    HZ   PHE 108           HZ       PHE 108   5.243   1.823   9.595
  806    H    SER 109           H        SER 109  -1.009   6.025   6.728
  807    HA   SER 109           HA       SER 109  -2.571   5.406   4.375
  808    HB2  SER 109           1HB      SER 109  -4.029   5.960   6.988
  809    HB3  SER 109           2HB      SER 109  -4.783   5.865   5.396
  810    HG   SER 109           HG       SER 109  -3.704   3.868   7.019
  811    H    ARG 110           H        ARG 110  -3.044   7.257   3.269
  812    HA   ARG 110           HA       ARG 110  -2.751   9.899   4.621
  813    HB2  ARG 110           1HB      ARG 110  -1.371  10.721   2.792
  814    HB3  ARG 110           2HB      ARG 110  -0.618   9.274   3.462
  815    HG2  ARG 110           1HG      ARG 110  -1.639   7.925   1.605
  816    HG3  ARG 110           2HG      ARG 110  -2.298   9.411   0.917
  817    HD2  ARG 110           1HD      ARG 110   0.655   8.847   1.343
  818    HD3  ARG 110           2HD      ARG 110  -0.195   8.778  -0.203
  819    HE   ARG 110           HE       ARG 110  -0.670  11.306   0.920
  820   HH11  ARG 110          1HH2      ARG 110   1.989   9.444  -0.355
  821   HH12  ARG 110          2HH2      ARG 110   2.873  10.839  -0.877
  822   HH21  ARG 110          1HH1      ARG 110   0.499  13.102   0.236
  823   HH22  ARG 110          2HH1      ARG 110   2.033  12.901  -0.542
  824    H    ILE 111           H        ILE 111  -3.921  11.571   3.712
  825    HA   ILE 111           HA       ILE 111  -6.276  10.745   2.161
  826    HB   ILE 111           HB       ILE 111  -5.507  13.272   3.679
  827   HG12  ILE 111          1HG1      ILE 111  -7.488  12.688   5.074
  828   HG13  ILE 111          2HG1      ILE 111  -7.804  11.291   4.052
  829   HG21  ILE 111          1HG2      ILE 111  -7.899  14.082   3.129
  830   HG22  ILE 111          2HG2      ILE 111  -7.946  12.831   1.887
  831   HG23  ILE 111          3HG2      ILE 111  -6.773  14.141   1.774
  832   HD11  ILE 111          3HD1      ILE 111  -6.553  10.937   6.305
  833   HD12  ILE 111          1HD1      ILE 111  -5.138  11.575   5.470
  834   HD13  ILE 111          2HD1      ILE 111  -5.940  10.115   4.876
  835    H    VAL 112           H        VAL 112  -6.578  11.198   0.080
  836    HA   VAL 112           HA       VAL 112  -4.927  13.240  -1.302
  837    HB   VAL 112           HB       VAL 112  -3.753  11.055  -1.520
  838   HG11  VAL 112          1HG1      VAL 112  -6.233  10.079  -3.012
  839   HG12  VAL 112          2HG1      VAL 112  -5.797   9.587  -1.376
  840   HG13  VAL 112          3HG1      VAL 112  -4.751   9.180  -2.728
  841   HG21  VAL 112          3HG2      VAL 112  -5.029  11.982  -4.137
  842   HG22  VAL 112          1HG2      VAL 112  -3.516  11.096  -3.979
  843   HG23  VAL 112          2HG2      VAL 112  -3.638  12.739  -3.363
  844    H    LYS 113           H        LYS 113  -5.999  14.292  -2.866
  845    HA   LYS 113           HA       LYS 113  -8.610  13.264  -3.846
  846    HB2  LYS 113           1HB      LYS 113  -8.111  16.049  -2.706
  847    HB3  LYS 113           2HB      LYS 113  -9.592  15.524  -3.512
  848    HG2  LYS 113           1HG      LYS 113  -9.890  13.756  -1.758
  849    HG3  LYS 113           2HG      LYS 113  -8.451  14.360  -0.936
  850    HD2  LYS 113           1HD      LYS 113  -9.545  16.573  -0.638
  851    HD3  LYS 113           2HD      LYS 113 -10.990  15.959  -1.443
  852    HE2  LYS 113           1HE      LYS 113 -11.248  14.236   0.329
  853    HE3  LYS 113           2HE      LYS 113  -9.804  14.851   1.135
  854    HZ1  LYS 113           3HZ      LYS 113 -12.261  16.432   0.603
  855    HZ2  LYS 113           1HZ      LYS 113 -10.891  16.959   1.455
  856    HZ3  LYS 113           2HZ      LYS 113 -11.862  15.718   2.093
  857    H    VAL 114           H        VAL 114  -9.272  14.195  -5.804
  858    HA   VAL 114           HA       VAL 114  -7.136  15.543  -7.408
  859    HB   VAL 114           HB       VAL 114  -7.905  14.148  -9.340
  860   HG11  VAL 114          1HG1      VAL 114  -6.960  12.555  -6.917
  861   HG12  VAL 114          2HG1      VAL 114  -5.923  13.464  -8.016
  862   HG13  VAL 114          3HG1      VAL 114  -6.798  12.050  -8.601
  863   HG21  VAL 114          3HG2      VAL 114  -9.532  12.683  -7.204
  864   HG22  VAL 114          1HG2      VAL 114  -9.269  12.096  -8.842
  865   HG23  VAL 114          2HG2      VAL 114 -10.185  13.570  -8.580
  866    H    LEU 115           H        LEU 115  -7.756  17.269  -8.515
  867    HA   LEU 115           HA       LEU 115 -10.547  18.199  -8.307
  868    HB2  LEU 115           1HB      LEU 115  -8.089  19.616  -9.433
  869    HB3  LEU 115           2HB      LEU 115  -9.637  20.354  -9.012
  870    HG   LEU 115           HG       LEU 115  -7.694  19.038  -7.055
  871   HD11  LEU 115          1HD1      LEU 115  -8.427  21.962  -7.446
  872   HD12  LEU 115          2HD1      LEU 115  -6.898  21.215  -7.909
  873   HD13  LEU 115          3HD1      LEU 115  -7.341  21.332  -6.207
  874   HD21  LEU 115          3HD2      LEU 115  -9.275  20.179  -5.312
  875   HD22  LEU 115          1HD2      LEU 115  -9.849  18.704  -6.078
  876   HD23  LEU 115          2HD2      LEU 115 -10.453  20.268  -6.625
  877    H    GLU 116           H        GLU 116 -11.909  17.644  -9.854
  878    HA   GLU 116           HA       GLU 116 -11.046  16.716 -12.464
  879    HB2  GLU 116           1HB      GLU 116 -13.042  15.794 -11.273
  880    HB3  GLU 116           2HB      GLU 116 -13.861  17.342 -11.471
  881    HG2  GLU 116           1HG      GLU 116 -13.683  17.114 -13.949
  882    HG3  GLU 116           2HG      GLU 116 -12.854  15.576 -13.745
  883    H    HIS 117           H        HIS 117 -13.304  19.330 -11.537
  884    HA   HIS 117           HA       HIS 117 -12.972  20.697 -14.068
  885    HB2  HIS 117           1HB      HIS 117 -14.385  21.543 -11.500
  886    HB3  HIS 117           2HB      HIS 117 -14.555  22.317 -13.078
  887    HD1  HIS 117           HD1      HIS 117 -15.437  20.585 -15.046
  888    HD2  HIS 117           HD2      HIS 117 -16.193  19.495 -11.092
  889    HE1  HIS 117           HE1      HIS 117 -17.263  18.832 -15.121
  890    HE2  HIS 117           HE2      HIS 117 -17.735  18.158 -12.720
  891    H    HIS 118           H        HIS 118 -12.113  22.795 -14.326
  892    HA   HIS 118           HA       HIS 118  -9.643  23.275 -13.006
  893    HB2  HIS 118           1HB      HIS 118 -11.326  25.165 -14.705
  894    HB3  HIS 118           2HB      HIS 118  -9.618  25.376 -14.314
  895    HD1  HIS 118           HD1      HIS 118  -8.126  23.091 -15.023
  896    HD2  HIS 118           HD2      HIS 118 -11.656  23.850 -17.106
  897    HE1  HIS 118           HE1      HIS 118  -7.992  21.754 -17.171
  898    HE2  HIS 118           HE2      HIS 118 -10.138  22.206 -18.452
  899    H    HIS 119           H        HIS 119  -9.159  24.456 -11.224
  900    HA   HIS 119           HA       HIS 119 -11.199  25.289  -9.416
  901    HB2  HIS 119           1HB      HIS 119  -8.922  24.559  -8.699
  902    HB3  HIS 119           2HB      HIS 119  -8.237  26.023  -9.397
  903    HD1  HIS 119           HD1      HIS 119 -10.610  24.902  -6.648
  904    HD2  HIS 119           HD2      HIS 119  -8.475  28.304  -7.765
  905    HE1  HIS 119           HE1      HIS 119 -10.883  26.571  -4.762
  906    HE2  HIS 119           HE2      HIS 119  -9.588  28.651  -5.428
  907    H    HIS 120           H        HIS 120  -9.065  27.063 -11.633
  908    HA   HIS 120           HA       HIS 120  -9.830  29.687 -10.892
  909    HB2  HIS 120           1HB      HIS 120  -8.864  28.648 -13.587
  910    HB3  HIS 120           2HB      HIS 120  -8.864  30.336 -13.075
  911    HD1  HIS 120           HD1      HIS 120  -7.427  30.755 -10.744
  912    HD2  HIS 120           HD2      HIS 120  -6.523  27.328 -12.939
  913    HE1  HIS 120           HE1      HIS 120  -5.150  29.975  -9.951
  914    HE2  HIS 120           HE2      HIS 120  -4.586  27.887 -11.280
  915    H    HIS 121           H        HIS 121 -12.023  30.004 -10.729
  916    HA   HIS 121           HA       HIS 121 -13.976  29.057 -12.579
  917    HB2  HIS 121           1HB      HIS 121 -14.526  29.738 -10.254
  918    HB3  HIS 121           2HB      HIS 121 -14.140  31.409 -10.648
  919    HD1  HIS 121           HD1      HIS 121 -16.556  28.662 -11.742
  920    HD2  HIS 121           HD2      HIS 121 -16.274  32.822 -11.749
  921    HE1  HIS 121           HE1      HIS 121 -18.766  29.530 -12.627
  922    HE2  HIS 121           HE2      HIS 121 -18.608  32.063 -12.639
  923    H    HIS 122           H        HIS 122 -12.264  32.160 -12.257
  924    HA   HIS 122           HA       HIS 122 -13.610  33.543 -14.337
  925    HB2  HIS 122           1HB      HIS 122 -11.630  35.069 -14.249
  926    HB3  HIS 122           2HB      HIS 122 -12.279  34.718 -12.648
  927    HD1  HIS 122           HD1      HIS 122 -10.844  33.308 -11.045
  928    HD2  HIS 122           HD2      HIS 122  -9.086  33.836 -14.788
  929    HE1  HIS 122           HE1      HIS 122  -8.448  32.517 -10.828
  930    HE2  HIS 122           HE2      HIS 122  -7.362  32.832 -13.103