Detailed results of PSR293_NMR_em_bcr3 by PSVS

Output from PDBStat

Constraints analysis

table of NOE constraints


# -------------- SUMMARY OF RESTRAINTS  --------------- 
# TOTAL NUMBER OF NOE RESTRAINTS            :  1823
#      INTRA-RESIDUE RESTRAINTS   (I=J)     :   419
#      SEQUENTIAL    RESTRAINTS   (I-J)=1   :   481
#          BACKBONE-BACKBONE                :       117
#          BACKBONE-SIDE CHAIN              :        72
#          SIDE CHAIN-SIDE CHAIN            :       292
#      MEDIUM RANGE  RESTRAINTS  1<(I-J)<5  :   370
#          BACKBONE-BACKBONE                :        73
#          BACKBONE-SIDE CHAIN              :        86
#          SIDE CHAIN-SIDE CHAIN            :       211
#      LONG  RANGE   RESTRAINTS   (I-J)>=5  :   553
# TOTAL HYDROGEN BOND RESTRAINTS            :     0
#      LONG RANGE H-BOND RESTR.   (I-J)>=5  :     0
# DISULFIDE RESTRAINTS                      :     0
# INTRA-CHAIN RESTRAINTS                    :  1823
# INTER-CHAIN RESTRAINTS                    :     0
# AMBIGUOUS RESTRAINTS                      :     0
# ----------------------------------------------------- 
# ----------------------------------------------------- 
# ----------------------------------------------------- 


# RES   #    INTRA  INTER   seq    med    lng   InterChain
 MET     1      4   20.5    2.0    3.5   15.0    0.0
 ASN     2      0    7.0    3.0    2.0    2.0    0.0
 ARG     3      6   13.0    2.5    3.5    7.0    0.0
 GLN     4      6    9.5    4.0    5.5    0.0    0.0
 GLN     5      4   11.0    4.5    6.5    0.0    0.0
 PHE     6      4   26.0    4.5    4.0   17.5    0.0
 ILE     7      8   24.5    6.0    9.0    9.5    0.0
 ASP     8      2   10.0    4.5    5.5    0.0    0.0
 TYR     9      4   11.5    3.0    3.5    5.0    0.0
 ALA    10      1   16.0    4.5    8.0    3.5    0.0
 GLN    11      7   14.0    5.5    7.5    1.0    0.0
 LYS    12      9    8.0    5.0    3.0    0.0    0.0
 LYS    13     10    7.5    4.5    3.0    0.0    0.0
 TYR    14      4    7.5    3.0    3.5    1.0    0.0
 ASP    15      1    5.5    2.0    3.5    0.0    0.0
 THR    16      3   11.5    4.5    1.5    5.5    0.0
 LYS    17      1    6.5    5.5    0.0    1.0    0.0
 PRO    18      0   12.0    6.0    1.0    5.0    0.0
 ASP    19      0    8.5    4.5    0.0    4.0    0.0
 HIS    20      0    3.5    2.5    0.0    1.0    0.0
 PRO    21      0    5.5    3.0    0.0    2.5    0.0
 TRP    22      2    7.5    4.5    2.5    0.5    0.0
 GLU    23      5   13.0   13.0    0.0    0.0    0.0
 LYS    24      5   14.5   13.5    1.0    0.0    0.0
 PHE    25      4    9.0    6.0    3.0    0.0    0.0
 PRO    26      0    4.5    3.5    1.0    0.0    0.0
 ASP    27      1    3.5    3.0    0.5    0.0    0.0
 TYR    28      2    8.5    3.5    1.0    4.0    0.0
 ALA    29      0   11.5    3.5    1.5    6.5    0.0
 VAL    30      5   20.0    4.0    2.0   14.0    0.0
 PHE    31      2   22.0    3.5    1.5   17.0    0.0
 ARG    32      3    6.5    2.5    2.0    2.0    0.0
 HIS    33      0    4.5    3.0    1.0    0.5    0.0
 SER    34      1    4.5    4.0    0.5    0.0    0.0
 ASP    35      1    5.0    3.0    1.0    1.0    0.0
 ASN    36      0   11.0    1.5    0.5    9.0    0.0
 ASP    37      1    2.0    1.0    1.0    0.0    0.0
 LYS    38      4    1.5    1.0    0.0    0.5    0.0
 TRP    39      2    1.0    0.5    0.0    0.5    0.0
 TYR    40      0    1.5    0.5    0.0    1.0    0.0
 ALA    41      0    8.0    1.5    0.0    6.5    0.0
 LEU    42      8   12.5    2.5    4.0    6.0    0.0
 LEU    43      7   31.0    4.0    0.0   27.0    0.0
 MET    44      4   16.5    4.0    5.5    7.0    0.0
 ASP    45      0    7.0    3.0    0.0    4.0    0.0
 ILE    46      6   19.5    6.0    3.0   10.5    0.0
 PRO    47      0   14.0    6.5    5.5    2.0    0.0
 ALA    48      1   24.0    3.5    3.5   17.0    0.0
 GLU    49      2    9.5    3.5    5.5    0.5    0.0
 LYS    50      3   12.5    6.0    5.0    1.5    0.0
 ILE    51     10   26.5    7.0    7.0   12.5    0.0
 GLY    52      0    5.0    3.5    1.5    0.0    0.0
 ILE    53     12   24.5    5.0   10.0    9.5    0.0
 ASN    54      3    6.5    5.5    0.0    1.0    0.0
 GLY    55      1    6.0    2.0    3.0    1.0    0.0
 ASP    56      1    5.5    3.0    0.5    2.0    0.0
 LYS    57      4   10.5    4.5    2.5    3.5    0.0
 ARG    58      4   10.0    6.0    0.0    4.0    0.0
 VAL    59      4   21.0    6.5    2.0   12.5    0.0
 ASP    60      2   14.0    6.0    0.5    7.5    0.0
 VAL    61      3   22.5    5.5    0.5   16.5    0.0
 ILE    62      5   21.5    2.5    1.5   17.5    0.0
 ASP    63      0    0.0    0.0    0.0    0.0    0.0
 LEU    64      4   13.5    1.0    3.0    9.5    0.0
 LYS    65      5   15.0    5.5    0.0    9.5    0.0
 VAL    66      4   26.0    7.5    5.0   13.5    0.0
 GLN    67     11   20.5    4.5   10.0    6.0    0.0
 PRO    68      0    5.5    3.0    2.5    0.0    0.0
 GLU    69      3    7.5    4.5    3.0    0.0    0.0
 LEU    70      8   19.0    6.0   13.0    0.0    0.0
 VAL    71      5   24.5    5.5   11.5    7.5    0.0
 GLY    72      0    7.0    3.0    4.0    0.0    0.0
 SER    73      1    8.5    1.5    7.0    0.0    0.0
 LEU    74      8   18.0    3.5    6.5    8.0    0.0
 ARG    75     12   24.5    3.5    7.0   14.0    0.0
 LYS    76     17   11.5    5.5    6.0    0.0    0.0
 LYS    77      6   10.0    4.5    4.5    1.0    0.0
 PRO    78      0    3.5    1.5    1.0    1.0    0.0
 GLY    79      0    6.5    2.5    1.0    3.0    0.0
 ILE    80      9   18.0    4.0    4.0   10.0    0.0
 TYR    81      2   17.5    6.0    1.0   10.5    0.0
 PRO    82      0   15.0    3.0    1.0   11.0    0.0
 ALA    83      0    0.0    0.0    0.0    0.0    0.0
 TYR    84      1    5.0    0.0    0.0    5.0    0.0
 HIS    85      0    0.0    0.0    0.0    0.0    0.0
 MET    86      0    0.0    0.0    0.0    0.0    0.0
 ASN    87      0    2.0    0.5    1.5    0.0    0.0
 LYS    88      2    8.0    1.0    2.0    5.0    0.0
 GLU    89      3    8.0    5.0    0.5    2.5    0.0
 HIS    90      0    8.0    7.0    0.0    1.0    0.0
 TRP    91      1    7.5    4.0    1.5    2.0    0.0
 ILE    92      6   18.0    4.5    1.5   12.0    0.0
 THR    93      3    6.0    3.0    0.0    3.0    0.0
 VAL    94      1    7.0    2.0    0.5    4.5    0.0
 LEU    95     10   22.5    3.5    6.0   13.0    0.0
 LEU    96      5   25.5    3.0    0.5   22.0    0.0
 ASN    97      3    5.0    2.5    2.0    0.5    0.0
 GLY    98      0    4.0    1.5    2.5    0.0    0.0
 PRO    99      0    6.0    2.5    1.5    2.0    0.0
 LEU   100      9   18.5    7.0    3.5    8.0    0.0
 GLY   101      0   11.5    8.0    3.5    0.0    0.0
 ALA   102      1   13.0    5.5    5.5    2.0    0.0
 LYS   103      6    6.5    4.0    2.5    0.0    0.0
 GLU   104      4   12.0    3.5    8.5    0.0    0.0
 ILE   105     10   29.0    4.5   13.0   11.5    0.0
 HIS   106      3   11.5    3.5    6.5    1.5    0.0
 SER   107      1    9.5    3.5    6.0    0.0    0.0
 LEU   108      7   14.5    6.0    5.5    3.0    0.0
 ILE   109     10   33.5    6.5   12.5   14.5    0.0
 GLU   110      3   12.0    5.0    7.0    0.0    0.0
 ASP   111      1    7.5    3.5    4.0    0.0    0.0
 SER   112      2   13.5    2.0    6.5    5.0    0.0
 PHE   113      2    7.5    3.0    4.5    0.0    0.0
 GLN   114      3    7.5    3.5    4.0    0.0    0.0
 LEU   115     11   21.0    5.0    4.0   12.0    0.0
 THR   116      3   10.5    6.0    2.5    2.0    0.0
 ARG   117      8    8.5    4.5    3.5    0.5    0.0
 LEU   118      8   15.0    5.5    0.5    9.0    0.0
 GLU   119      5    7.5    7.0    0.0    0.5    0.0
 HIS   120      0    5.5    5.0    0.5    0.0    0.0
 HIS   121      0    2.0    2.0    0.0    0.0    0.0
 HIS   122      0    2.0    2.0    0.0    0.0    0.0
 HIS   123      0    1.5    1.5    0.0    0.0    0.0
 HIS   124      0    0.5    0.5    0.0    0.0    0.0
 HIS   125      0    0.0    0.0    0.0    0.0    0.0
# TOTAL        419 1404.0  481.0  370.0  553.0    0.0

# TOTAL NUMBER OF RESTRAINTS  (CHECKING): 1823.0

List of conformationally-resticting NOE constraints

 assign ((resid   1 and name HA   ))   ( (resid   1 and name HE*  )) assign ((resid   1 and name HA   ))   ( (resid   1 and name HG*  )) assign ((resid   1 and name HA   ))   ( (resid   2 and name HN   )) assign ((resid   1 and name HA   ))   ( (resid   5 and name HB*  )) assign ((resid   1 and name HB*  ))   ( (resid   1 and name HE*  )) assign ((resid   1 and name HB*  ))   ( (resid   2 and name HN   )) assign ((resid   1 and name HB*  ))   ( (resid  96 and name HB*  )) assign ((resid   1 and name HB*  ))   ( (resid  96 and name HD2* )) assign ((resid   1 and name HB*  ))   ( (resid 102 and name HB*  )) assign ((resid   1 and name HB1  ))   ( (resid 105 and name HD1* )) assign ((resid   1 and name HB2  ))   ( (resid 105 and name HD1* )) assign ((resid   1 and name HE*  ))   ( (resid   5 and name HB*  )) assign ((resid   1 and name HE*  ))   ( (resid   6 and name HA   )) assign ((resid   1 and name HE*  ))   ( (resid   6 and name HB*  )) assign ((resid   1 and name HE*  ))   ( (resid   6 and name HD*  )) assign ((resid   1 and name HE*  ))   ( (resid   6 and name HN   )) assign ((resid   1 and name HE*  ))   ( (resid   9 and name HB*  )) assign ((resid   1 and name HE*  ))   ( (resid   9 and name HD*  )) assign ((resid   1 and name HE*  ))   ( (resid  62 and name HD1* )) assign ((resid   1 and name HE*  ))   ( (resid  96 and name HD2* )) assign ((resid   1 and name HE*  ))   ( (resid 102 and name HA   )) assign ((resid   1 and name HE*  ))   ( (resid 102 and name HB*  )) assign ((resid   1 and name HE*  ))   ( (resid 105 and name HD1* )) assign ((resid   1 and name HE*  ))   ( (resid 105 and name HG1* )) assign ((resid   1 and name HE*  ))   ( (resid 105 and name HG2* )) assign ((resid   1 and name HE*  ))   ( (resid 106 and name HD2  )) assign ((resid   1 and name HE*  ))   ( (resid 106 and name HN   )) assign ((resid   1 and name HE*  ))   ( (resid 109 and name HD1* )) assign ((resid   1 and name HE*  ))   ( (resid 109 and name HG1* )) assign ((resid   1 and name HG*  ))   ( (resid   1 and name HE*  )) assign ((resid   1 and name HG*  ))   ( (resid   5 and name HB*  )) assign ((resid   1 and name HG*  ))   ( (resid   6 and name HN   )) assign ((resid   1 and name HG*  ))   ( (resid  96 and name HB*  )) assign ((resid   1 and name HG*  ))   ( (resid  96 and name HD1* )) assign ((resid   1 and name HG*  ))   ( (resid  96 and name HD2* )) assign ((resid   1 and name HG*  ))   ( (resid 102 and name HB*  )) assign ((resid   1 and name HG*  ))   ( (resid 105 and name HG2* )) assign ((resid   1 and name HG1  ))   ( (resid   2 and name HN   )) assign ((resid   1 and name HG1  ))   ( (resid   5 and name HB1  )) assign ((resid   1 and name HG1  ))   ( (resid   5 and name HB2  )) assign ((resid   1 and name HG1  ))   ( (resid 105 and name HD1* )) assign ((resid   1 and name HG2  ))   ( (resid   2 and name HN   )) assign ((resid   1 and name HG2  ))   ( (resid   5 and name HB1  )) assign ((resid   1 and name HG2  ))   ( (resid   5 and name HB2  )) assign ((resid   1 and name HG2  ))   ( (resid 105 and name HD1* )) assign ((resid   2 and name HA   ))   ( (resid   3 and name HN   )) assign ((resid   2 and name HA   ))   ( (resid  96 and name HB*  )) assign ((resid   2 and name HA   ))   ( (resid  96 and name HD1* )) assign ((resid   2 and name HA   ))   ( (resid  96 and name HD2* )) assign ((resid   2 and name HB*  ))   ( (resid   3 and name HN   )) assign ((resid   2 and name HD2* ))   ( (resid   5 and name HG*  )) assign ((resid   2 and name HN   ))   ( (resid   5 and name HB*  )) assign ((resid   2 and name HN   ))   ( (resid   5 and name HG1  )) assign ((resid   2 and name HN   ))   ( (resid   5 and name HG2  )) assign ((resid   2 and name HN   ))   ( (resid  96 and name HD2* )) assign ((resid   3 and name HA   ))   ( (resid   3 and name HD*  )) assign ((resid   3 and name HA   ))   ( (resid   6 and name HB1  )) assign ((resid   3 and name HA   ))   ( (resid   6 and name HB2  )) assign ((resid   3 and name HA   ))   ( (resid  43 and name HD1* )) assign ((resid   3 and name HA   ))   ( (resid  43 and name HD2* )) assign ((resid   3 and name HA   ))   ( (resid  96 and name HD1* )) assign ((resid   3 and name HA   ))   ( (resid  96 and name HD2* )) assign ((resid   3 and name HB*  ))   ( (resid   3 and name HD*  )) assign ((resid   3 and name HB*  ))   ( (resid   3 and name HE   )) assign ((resid   3 and name HB*  ))   ( (resid   4 and name HN   )) assign ((resid   3 and name HB*  ))   ( (resid  96 and name HD1* )) assign ((resid   3 and name HB2  ))   ( (resid  43 and name HD1* )) assign ((resid   3 and name HD*  ))   ( (resid  43 and name HD1* )) assign ((resid   3 and name HD*  ))   ( (resid  43 and name HD2* )) assign ((resid   3 and name HD1  ))   ( (resid   7 and name HD1* )) assign ((resid   3 and name HD2  ))   ( (resid   7 and name HD1* )) assign ((resid   3 and name HE   ))   ( (resid   7 and name HD1* )) assign ((resid   3 and name HE   ))   ( (resid  43 and name HD1* )) assign ((resid   3 and name HE   ))   ( (resid  43 and name HD2* )) assign ((resid   3 and name HG*  ))   ( (resid   4 and name HN   )) assign ((resid   3 and name HG*  ))   ( (resid  43 and name HD2* )) assign ((resid   3 and name HG1  ))   ( (resid   7 and name HD1* )) assign ((resid   3 and name HG1  ))   ( (resid  43 and name HD1* )) assign ((resid   3 and name HG2  ))   ( (resid   7 and name HD1* )) assign ((resid   3 and name HG2  ))   ( (resid  43 and name HD1* )) assign ((resid   3 and name HN   ))   ( (resid   3 and name HB*  )) assign ((resid   3 and name HN   ))   ( (resid   3 and name HG1  )) assign ((resid   3 and name HN   ))   ( (resid   3 and name HG2  )) assign ((resid   3 and name HN   ))   ( (resid   4 and name HN   )) assign ((resid   3 and name HN   ))   ( (resid  96 and name HD1* )) assign ((resid   4 and name HA   ))   ( (resid   4 and name HE2* )) assign ((resid   4 and name HA   ))   ( (resid   7 and name HB   )) assign ((resid   4 and name HA   ))   ( (resid   7 and name HD1* )) assign ((resid   4 and name HA   ))   ( (resid   7 and name HG2* )) assign ((resid   4 and name HA   ))   ( (resid   7 and name HN   )) assign ((resid   4 and name HA   ))   ( (resid   8 and name HN   )) assign ((resid   4 and name HB*  ))   ( (resid   4 and name HE2* )) assign ((resid   4 and name HB*  ))   ( (resid   5 and name HG*  )) assign ((resid   4 and name HB*  ))   ( (resid   5 and name HN   )) assign ((resid   4 and name HE2* ))   ( (resid   7 and name HG1* )) assign ((resid   4 and name HE2* ))   ( (resid   7 and name HG2* )) assign ((resid   4 and name HE2* ))   ( (resid   8 and name HN   )) assign ((resid   4 and name HE21 ))   ( (resid   7 and name HB   )) assign ((resid   4 and name HE22 ))   ( (resid   7 and name HB   )) assign ((resid   4 and name HG*  ))   ( (resid   4 and name HE2* )) assign ((resid   4 and name HG*  ))   ( (resid   8 and name HN   )) assign ((resid   4 and name HG1  ))   ( (resid   5 and name HN   )) assign ((resid   4 and name HG2  ))   ( (resid   5 and name HN   )) assign ((resid   4 and name HN   ))   ( (resid   4 and name HB*  )) assign ((resid   4 and name HN   ))   ( (resid   4 and name HG1  )) assign ((resid   4 and name HN   ))   ( (resid   4 and name HG2  )) assign ((resid   4 and name HN   ))   ( (resid   5 and name HN   )) assign ((resid   5 and name HA   ))   ( (resid   5 and name HG*  )) assign ((resid   5 and name HA   ))   ( (resid   8 and name HB*  )) assign ((resid   5 and name HA   ))   ( (resid   8 and name HN   )) assign ((resid   5 and name HB1  ))   ( (resid   6 and name HN   )) assign ((resid   5 and name HB2  ))   ( (resid   6 and name HN   )) assign ((resid   5 and name HG*  ))   ( (resid   5 and name HE2* )) assign ((resid   5 and name HG*  ))   ( (resid   6 and name HN   )) assign ((resid   5 and name HN   ))   ( (resid   5 and name HB*  )) assign ((resid   5 and name HN   ))   ( (resid   5 and name HG*  )) assign ((resid   5 and name HN   ))   ( (resid   6 and name HN   )) assign ((resid   6 and name HA   ))   ( (resid   6 and name HD*  )) assign ((resid   6 and name HA   ))   ( (resid   9 and name HB*  )) assign ((resid   6 and name HA   ))   ( (resid   9 and name HN   )) assign ((resid   6 and name HA   ))   ( (resid  10 and name HB*  )) assign ((resid   6 and name HA   ))   ( (resid  10 and name HN   )) assign ((resid   6 and name HA   ))   ( (resid  43 and name HD1* )) assign ((resid   6 and name HA   ))   ( (resid 109 and name HD1* )) assign ((resid   6 and name HB*  ))   ( (resid   7 and name HN   )) assign ((resid   6 and name HB*  ))   ( (resid  96 and name HD2* )) assign ((resid   6 and name HB*  ))   ( (resid 109 and name HD1* )) assign ((resid   6 and name HB1  ))   ( (resid  96 and name HD1* )) assign ((resid   6 and name HB2  ))   ( (resid  96 and name HD1* )) assign ((resid   6 and name HD*  ))   ( (resid   7 and name HA   )) assign ((resid   6 and name HD*  ))   ( (resid   7 and name HD1* )) assign ((resid   6 and name HD*  ))   ( (resid   7 and name HN   )) assign ((resid   6 and name HD*  ))   ( (resid  10 and name HB*  )) assign ((resid   6 and name HD*  ))   ( (resid  29 and name HB*  )) assign ((resid   6 and name HD*  ))   ( (resid  43 and name HB*  )) assign ((resid   6 and name HD*  ))   ( (resid  43 and name HD1* )) assign ((resid   6 and name HD*  ))   ( (resid  43 and name HD2* )) assign ((resid   6 and name HD*  ))   ( (resid  62 and name HD1* )) assign ((resid   6 and name HD*  ))   ( (resid  62 and name HG2* )) assign ((resid   6 and name HD*  ))   ( (resid  96 and name HD2* )) assign ((resid   6 and name HD*  ))   ( (resid 105 and name HG2* )) assign ((resid   6 and name HD*  ))   ( (resid 109 and name HG2* )) assign ((resid   6 and name HE*  ))   ( (resid  41 and name HB*  )) assign ((resid   6 and name HE*  ))   ( (resid  43 and name HD1* )) assign ((resid   6 and name HE*  ))   ( (resid  43 and name HD2* )) assign ((resid   6 and name HE*  ))   ( (resid  62 and name HD1* )) assign ((resid   6 and name HE*  ))   ( (resid  62 and name HG2* )) assign ((resid   6 and name HE*  ))   ( (resid 105 and name HG2* )) assign ((resid   6 and name HE*  ))   ( (resid 109 and name HD1* )) assign ((resid   6 and name HE*  ))   ( (resid 109 and name HG1* )) assign ((resid   6 and name HN   ))   ( (resid   6 and name HB1  )) assign ((resid   6 and name HN   ))   ( (resid   6 and name HB2  )) assign ((resid   6 and name HN   ))   ( (resid   6 and name HD*  )) assign ((resid   6 and name HN   ))   ( (resid   7 and name HN   )) assign ((resid   6 and name HN   ))   ( (resid  43 and name HD1* )) assign ((resid   6 and name HN   ))   ( (resid  96 and name HD1* )) assign ((resid   6 and name HZ   ))   ( (resid  10 and name HB*  )) assign ((resid   6 and name HZ   ))   ( (resid  41 and name HB*  )) assign ((resid   6 and name HZ   ))   ( (resid  62 and name HG2* )) assign ((resid   6 and name HZ   ))   ( (resid  64 and name HD2* )) assign ((resid   6 and name HZ   ))   ( (resid 109 and name HD1* )) assign ((resid   6 and name HZ   ))   ( (resid 109 and name HG2* )) assign ((resid   7 and name HA   ))   ( (resid   7 and name HD1* )) assign ((resid   7 and name HA   ))   ( (resid   7 and name HG1* )) assign ((resid   7 and name HA   ))   ( (resid   7 and name HG2* )) assign ((resid   7 and name HA   ))   ( (resid  10 and name HB*  )) assign ((resid   7 and name HA   ))   ( (resid  10 and name HN   )) assign ((resid   7 and name HA   ))   ( (resid  31 and name HE*  )) assign ((resid   7 and name HA   ))   ( (resid  31 and name HZ   )) assign ((resid   7 and name HA   ))   ( (resid  43 and name HD1* )) assign ((resid   7 and name HB   ))   ( (resid   7 and name HD1* )) assign ((resid   7 and name HB   ))   ( (resid   8 and name HB*  )) assign ((resid   7 and name HB   ))   ( (resid   8 and name HN   )) assign ((resid   7 and name HD1* ))   ( (resid   8 and name HN   )) assign ((resid   7 and name HD1* ))   ( (resid  18 and name HD*  )) assign ((resid   7 and name HD1* ))   ( (resid  31 and name HD*  )) assign ((resid   7 and name HD1* ))   ( (resid  31 and name HE*  )) assign ((resid   7 and name HD1* ))   ( (resid  31 and name HZ   )) assign ((resid   7 and name HD1* ))   ( (resid  43 and name HB*  )) assign ((resid   7 and name HD1* ))   ( (resid  43 and name HD1* )) assign ((resid   7 and name HD1* ))   ( (resid  43 and name HD2* )) assign ((resid   7 and name HD1* ))   ( (resid  43 and name HG   )) assign ((resid   7 and name HG1* ))   ( (resid   8 and name HN   )) assign ((resid   7 and name HG1* ))   ( (resid  31 and name HZ   )) assign ((resid   7 and name HG1* ))   ( (resid  43 and name HD1* )) assign ((resid   7 and name HG2* ))   ( (resid   7 and name HD1* )) assign ((resid   7 and name HG2* ))   ( (resid   8 and name HA   )) assign ((resid   7 and name HG2* ))   ( (resid   8 and name HN   )) assign ((resid   7 and name HG2* ))   ( (resid  11 and name HE21 )) assign ((resid   7 and name HG2* ))   ( (resid  11 and name HE22 )) assign ((resid   7 and name HG2* ))   ( (resid  11 and name HG*  )) assign ((resid   7 and name HG2* ))   ( (resid  17 and name HA   )) assign ((resid   7 and name HG2* ))   ( (resid  18 and name HD*  )) assign ((resid   7 and name HG2* ))   ( (resid  18 and name HG*  )) assign ((resid   7 and name HG2* ))   ( (resid  31 and name HZ   )) assign ((resid   7 and name HN   ))   ( (resid   7 and name HB   )) assign ((resid   7 and name HN   ))   ( (resid   7 and name HD1* )) assign ((resid   7 and name HN   ))   ( (resid   7 and name HG1* )) assign ((resid   7 and name HN   ))   ( (resid   8 and name HN   )) assign ((resid   7 and name HN   ))   ( (resid  43 and name HD1* )) assign ((resid   7 and name HN   ))   ( (resid  96 and name HD1* )) assign ((resid   8 and name HA   ))   ( (resid  11 and name HB1  )) assign ((resid   8 and name HA   ))   ( (resid  11 and name HB2  )) assign ((resid   8 and name HA   ))   ( (resid  11 and name HG*  )) assign ((resid   8 and name HA   ))   ( (resid  11 and name HN   )) assign ((resid   8 and name HA   ))   ( (resid  12 and name HN   )) assign ((resid   8 and name HB*  ))   ( (resid   9 and name HN   )) assign ((resid   8 and name HN   ))   ( (resid   8 and name HB1  )) assign ((resid   8 and name HN   ))   ( (resid   8 and name HB2  )) assign ((resid   8 and name HN   ))   ( (resid   9 and name HN   )) assign ((resid   8 and name HN   ))   ( (resid  11 and name HN   )) assign ((resid   9 and name HA   ))   ( (resid   9 and name HD*  )) assign ((resid   9 and name HA   ))   ( (resid  12 and name HB*  )) assign ((resid   9 and name HA   ))   ( (resid  12 and name HN   )) assign ((resid   9 and name HB*  ))   ( (resid  10 and name HN   )) assign ((resid   9 and name HB*  ))   ( (resid 109 and name HD1* )) assign ((resid   9 and name HD*  ))   ( (resid  10 and name HN   )) assign ((resid   9 and name HD*  ))   ( (resid 109 and name HD1* )) assign ((resid   9 and name HD*  ))   ( (resid 109 and name HG2* )) assign ((resid   9 and name HE*  ))   ( (resid  13 and name HD*  )) assign ((resid   9 and name HE*  ))   ( (resid  13 and name HG*  )) assign ((resid   9 and name HE*  ))   ( (resid  14 and name HE*  )) assign ((resid   9 and name HE*  ))   ( (resid 106 and name HA   )) assign ((resid   9 and name HE*  ))   ( (resid 109 and name HD1* )) assign ((resid   9 and name HE*  ))   ( (resid 109 and name HG1* )) assign ((resid   9 and name HE*  ))   ( (resid 109 and name HG2* )) assign ((resid   9 and name HN   ))   ( (resid   9 and name HB1  )) assign ((resid   9 and name HN   ))   ( (resid   9 and name HB2  )) assign ((resid   9 and name HN   ))   ( (resid   9 and name HD*  )) assign ((resid   9 and name HN   ))   ( (resid  10 and name HB*  )) assign ((resid   9 and name HN   ))   ( (resid  10 and name HN   )) assign ((resid   9 and name HN   ))   ( (resid  11 and name HN   )) assign ((resid  10 and name HA   ))   ( (resid  13 and name HB*  )) assign ((resid  10 and name HA   ))   ( (resid  13 and name HN   )) assign ((resid  10 and name HA   ))   ( (resid  14 and name HD*  )) assign ((resid  10 and name HA   ))   ( (resid  14 and name HE*  )) assign ((resid  10 and name HA   ))   ( (resid  14 and name HN   )) assign ((resid  10 and name HB*  ))   ( (resid  11 and name HB*  )) assign ((resid  10 and name HB*  ))   ( (resid  11 and name HE21 )) assign ((resid  10 and name HB*  ))   ( (resid  11 and name HG*  )) assign ((resid  10 and name HB*  ))   ( (resid  11 and name HN   )) assign ((resid  10 and name HB*  ))   ( (resid  12 and name HN   )) assign ((resid  10 and name HB*  ))   ( (resid  13 and name HB*  )) assign ((resid  10 and name HB*  ))   ( (resid  13 and name HN   )) assign ((resid  10 and name HB*  ))   ( (resid  14 and name HD*  )) assign ((resid  10 and name HB*  ))   ( (resid  14 and name HE*  )) assign ((resid  10 and name HB*  ))   ( (resid  16 and name HG2* )) assign ((resid  10 and name HB*  ))   ( (resid  16 and name HN   )) assign ((resid  10 and name HB*  ))   ( (resid  17 and name HA   )) assign ((resid  10 and name HB*  ))   ( (resid  31 and name HD*  )) assign ((resid  10 and name HB*  ))   ( (resid  31 and name HE*  )) assign ((resid  10 and name HB*  ))   ( (resid  31 and name HZ   )) assign ((resid  10 and name HB*  ))   ( (resid  41 and name HB*  )) assign ((resid  10 and name HN   ))   ( (resid  10 and name HB*  )) assign ((resid  10 and name HN   ))   ( (resid  11 and name HN   )) assign ((resid  11 and name HA   ))   ( (resid  11 and name HE21 )) assign ((resid  11 and name HA   ))   ( (resid  11 and name HG*  )) assign ((resid  11 and name HA   ))   ( (resid  14 and name HN   )) assign ((resid  11 and name HA   ))   ( (resid  16 and name HN   )) assign ((resid  11 and name HB*  ))   ( (resid  11 and name HE21 )) assign ((resid  11 and name HB*  ))   ( (resid  12 and name HB*  )) assign ((resid  11 and name HB*  ))   ( (resid  15 and name HN   )) assign ((resid  11 and name HB*  ))   ( (resid  16 and name HN   )) assign ((resid  11 and name HB1  ))   ( (resid  11 and name HE22 )) assign ((resid  11 and name HB1  ))   ( (resid  12 and name HN   )) assign ((resid  11 and name HB1  ))   ( (resid  15 and name HA   )) assign ((resid  11 and name HB2  ))   ( (resid  11 and name HE22 )) assign ((resid  11 and name HB2  ))   ( (resid  12 and name HN   )) assign ((resid  11 and name HB2  ))   ( (resid  15 and name HA   )) assign ((resid  11 and name HE21 ))   ( (resid  15 and name HA   )) assign ((resid  11 and name HG*  ))   ( (resid  12 and name HN   )) assign ((resid  11 and name HG*  ))   ( (resid  15 and name HA   )) assign ((resid  11 and name HN   ))   ( (resid  11 and name HB1  )) assign ((resid  11 and name HN   ))   ( (resid  11 and name HB2  )) assign ((resid  11 and name HN   ))   ( (resid  12 and name HB2  )) assign ((resid  11 and name HN   ))   ( (resid  12 and name HN   )) assign ((resid  12 and name HA   ))   ( (resid  12 and name HD*  )) assign ((resid  12 and name HA   ))   ( (resid  12 and name HG*  )) assign ((resid  12 and name HA   ))   ( (resid  15 and name HN   )) assign ((resid  12 and name HB*  ))   ( (resid  12 and name HE*  )) assign ((resid  12 and name HB*  ))   ( (resid  12 and name HE1  )) assign ((resid  12 and name HB*  ))   ( (resid  12 and name HE2  )) assign ((resid  12 and name HB*  ))   ( (resid  13 and name HA   )) assign ((resid  12 and name HB1  ))   ( (resid  13 and name HN   )) assign ((resid  12 and name HB2  ))   ( (resid  13 and name HN   )) assign ((resid  12 and name HG*  ))   ( (resid  12 and name HE*  )) assign ((resid  12 and name HN   ))   ( (resid  12 and name HB1  )) assign ((resid  12 and name HN   ))   ( (resid  12 and name HB2  )) assign ((resid  12 and name HN   ))   ( (resid  12 and name HG*  )) assign ((resid  12 and name HN   ))   ( (resid  13 and name HN   )) assign ((resid  12 and name HN   ))   ( (resid  15 and name HN   )) assign ((resid  13 and name HA   ))   ( (resid  13 and name HD*  )) assign ((resid  13 and name HA   ))   ( (resid  13 and name HG*  )) assign ((resid  13 and name HB*  ))   ( (resid  14 and name HN   )) assign ((resid  13 and name HD*  ))   ( (resid  14 and name HE*  )) assign ((resid  13 and name HG*  ))   ( (resid  13 and name HE*  )) assign ((resid  13 and name HG1  ))   ( (resid  13 and name HE1  )) assign ((resid  13 and name HG1  ))   ( (resid  13 and name HE2  )) assign ((resid  13 and name HG1  ))   ( (resid  14 and name HE*  )) assign ((resid  13 and name HG2  ))   ( (resid  13 and name HE1  )) assign ((resid  13 and name HG2  ))   ( (resid  13 and name HE2  )) assign ((resid  13 and name HG2  ))   ( (resid  14 and name HE*  )) assign ((resid  13 and name HN   ))   ( (resid  13 and name HB1  )) assign ((resid  13 and name HN   ))   ( (resid  13 and name HB2  )) assign ((resid  13 and name HN   ))   ( (resid  13 and name HG*  )) assign ((resid  13 and name HN   ))   ( (resid  14 and name HN   )) assign ((resid  14 and name HA   ))   ( (resid  14 and name HD*  )) assign ((resid  14 and name HA   ))   ( (resid  14 and name HE*  )) assign ((resid  14 and name HB*  ))   ( (resid  16 and name HN   )) assign ((resid  14 and name HE*  ))   ( (resid 109 and name HG2* )) assign ((resid  14 and name HN   ))   ( (resid  14 and name HB*  )) assign ((resid  14 and name HN   ))   ( (resid  14 and name HD*  )) assign ((resid  14 and name HN   ))   ( (resid  15 and name HN   )) assign ((resid  15 and name HA   ))   ( (resid  16 and name HN   )) assign ((resid  15 and name HB*  ))   ( (resid  16 and name HN   )) assign ((resid  15 and name HN   ))   ( (resid  15 and name HB*  )) assign ((resid  15 and name HN   ))   ( (resid  16 and name HB   )) assign ((resid  16 and name HA   ))   ( (resid  16 and name HG2* )) assign ((resid  16 and name HA   ))   ( (resid  17 and name HB*  )) assign ((resid  16 and name HA   ))   ( (resid  17 and name HN   )) assign ((resid  16 and name HB   ))   ( (resid  17 and name HN   )) assign ((resid  16 and name HB   ))   ( (resid  31 and name HB*  )) assign ((resid  16 and name HB   ))   ( (resid  31 and name HD*  )) assign ((resid  16 and name HG2* ))   ( (resid  17 and name HA   )) assign ((resid  16 and name HG2* ))   ( (resid  17 and name HN   )) assign ((resid  16 and name HG2* ))   ( (resid  18 and name HA   )) assign ((resid  16 and name HG2* ))   ( (resid  18 and name HD*  )) assign ((resid  16 and name HG2* ))   ( (resid  31 and name HA   )) assign ((resid  16 and name HG2* ))   ( (resid  31 and name HB*  )) assign ((resid  16 and name HG2* ))   ( (resid  31 and name HD*  )) assign ((resid  16 and name HG2* ))   ( (resid  31 and name HE*  )) assign ((resid  16 and name HG2* ))   ( (resid  32 and name HN   )) assign ((resid  16 and name HN   ))   ( (resid  16 and name HB   )) assign ((resid  16 and name HN   ))   ( (resid  16 and name HG2* )) assign ((resid  16 and name HN   ))   ( (resid  17 and name HN   )) assign ((resid  17 and name HA   ))   ( (resid  18 and name HB*  )) assign ((resid  17 and name HA   ))   ( (resid  18 and name HD*  )) assign ((resid  17 and name HA   ))   ( (resid  18 and name HG*  )) assign ((resid  17 and name HB*  ))   ( (resid  18 and name HD*  )) assign ((resid  17 and name HN   ))   ( (resid  17 and name HB*  )) assign ((resid  17 and name HN   ))   ( (resid  18 and name HD*  )) assign ((resid  18 and name HA   ))   ( (resid  19 and name HA   )) assign ((resid  18 and name HA   ))   ( (resid  19 and name HB*  )) assign ((resid  18 and name HA   ))   ( (resid  19 and name HN   )) assign ((resid  18 and name HA   ))   ( (resid  29 and name HB*  )) assign ((resid  18 and name HA   ))   ( (resid  31 and name HA   )) assign ((resid  18 and name HA   ))   ( (resid  31 and name HE*  )) assign ((resid  18 and name HB*  ))   ( (resid  19 and name HA   )) assign ((resid  18 and name HB*  ))   ( (resid  19 and name HB1  )) assign ((resid  18 and name HB*  ))   ( (resid  19 and name HB2  )) assign ((resid  18 and name HB*  ))   ( (resid  19 and name HN   )) assign ((resid  18 and name HB*  ))   ( (resid  31 and name HE*  )) assign ((resid  18 and name HB*  ))   ( (resid  31 and name HZ   )) assign ((resid  18 and name HB1  ))   ( (resid  30 and name HN   )) assign ((resid  18 and name HB2  ))   ( (resid  30 and name HN   )) assign ((resid  19 and name HA   ))   ( (resid  20 and name HN   )) assign ((resid  19 and name HB*  ))   ( (resid  20 and name HN   )) assign ((resid  19 and name HB*  ))   ( (resid  30 and name HB   )) assign ((resid  19 and name HB*  ))   ( (resid  30 and name HG2* )) assign ((resid  19 and name HB1  ))   ( (resid  30 and name HG1* )) assign ((resid  19 and name HB2  ))   ( (resid  30 and name HG1* )) assign ((resid  19 and name HN   ))   ( (resid  29 and name HB*  )) assign ((resid  19 and name HN   ))   ( (resid  30 and name HG1* )) assign ((resid  19 and name HN   ))   ( (resid  30 and name HG2* )) assign ((resid  19 and name HN   ))   ( (resid  30 and name HN   )) assign ((resid  20 and name HA   ))   ( (resid  21 and name HD1  )) assign ((resid  20 and name HA   ))   ( (resid  21 and name HD2  )) assign ((resid  20 and name HA   ))   ( (resid  30 and name HG2* )) assign ((resid  20 and name HB*  ))   ( (resid  30 and name HG2* )) assign ((resid  20 and name HN   ))   ( (resid  21 and name HD*  )) assign ((resid  21 and name HB*  ))   ( (resid  22 and name HN   )) assign ((resid  21 and name HB*  ))   ( (resid  30 and name HG2* )) assign ((resid  21 and name HD*  ))   ( (resid  22 and name HN   )) assign ((resid  21 and name HD*  ))   ( (resid  30 and name HB   )) assign ((resid  21 and name HD*  ))   ( (resid  30 and name HG1* )) assign ((resid  21 and name HD*  ))   ( (resid  30 and name HG2* )) assign ((resid  21 and name HG*  ))   ( (resid  22 and name HN   )) assign ((resid  21 and name HG*  ))   ( (resid  30 and name HG2* )) assign ((resid  22 and name HA   ))   ( (resid  22 and name HD1  )) assign ((resid  22 and name HA   ))   ( (resid  23 and name HA   )) assign ((resid  22 and name HA   ))   ( (resid  23 and name HB*  )) assign ((resid  22 and name HA   ))   ( (resid  23 and name HN   )) assign ((resid  22 and name HB*  ))   ( (resid  23 and name HN   )) assign ((resid  22 and name HB*  ))   ( (resid  24 and name HN   )) assign ((resid  22 and name HB*  ))   ( (resid  25 and name HB*  )) assign ((resid  22 and name HB*  ))   ( (resid  25 and name HD*  )) assign ((resid  22 and name HB*  ))   ( (resid  25 and name HE*  )) assign ((resid  22 and name HB*  ))   ( (resid  25 and name HN   )) assign ((resid  22 and name HD1  ))   ( (resid  23 and name HN   )) assign ((resid  22 and name HN   ))   ( (resid  22 and name HB*  )) assign ((resid  22 and name HN   ))   ( (resid  23 and name HN   )) assign ((resid  22 and name HZ3  ))   ( (resid  42 and name HD1* )) assign ((resid  23 and name HA   ))   ( (resid  23 and name HG1  )) assign ((resid  23 and name HA   ))   ( (resid  23 and name HG2  )) assign ((resid  23 and name HB*  ))   ( (resid  24 and name HA   )) assign ((resid  23 and name HB1  ))   ( (resid  24 and name HG*  )) assign ((resid  23 and name HB1  ))   ( (resid  24 and name HN   )) assign ((resid  23 and name HB2  ))   ( (resid  24 and name HG*  )) assign ((resid  23 and name HB2  ))   ( (resid  24 and name HN   )) assign ((resid  23 and name HG*  ))   ( (resid  24 and name HA   )) assign ((resid  23 and name HG*  ))   ( (resid  24 and name HB*  )) assign ((resid  23 and name HG*  ))   ( (resid  24 and name HG*  )) assign ((resid  23 and name HG*  ))   ( (resid  24 and name HN   )) assign ((resid  23 and name HG1  ))   ( (resid  24 and name HD1  )) assign ((resid  23 and name HG1  ))   ( (resid  24 and name HD2  )) assign ((resid  23 and name HG1  ))   ( (resid  24 and name HG1  )) assign ((resid  23 and name HG1  ))   ( (resid  24 and name HG2  )) assign ((resid  23 and name HG2  ))   ( (resid  24 and name HD1  )) assign ((resid  23 and name HG2  ))   ( (resid  24 and name HD2  )) assign ((resid  23 and name HG2  ))   ( (resid  24 and name HG1  )) assign ((resid  23 and name HG2  ))   ( (resid  24 and name HG2  )) assign ((resid  23 and name HN   ))   ( (resid  23 and name HB1  )) assign ((resid  23 and name HN   ))   ( (resid  23 and name HB2  )) assign ((resid  23 and name HN   ))   ( (resid  23 and name HG*  )) assign ((resid  23 and name HN   ))   ( (resid  24 and name HB*  )) assign ((resid  23 and name HN   ))   ( (resid  24 and name HG*  )) assign ((resid  23 and name HN   ))   ( (resid  24 and name HN   )) assign ((resid  24 and name HA   ))   ( (resid  24 and name HG*  )) assign ((resid  24 and name HA   ))   ( (resid  26 and name HD*  )) assign ((resid  24 and name HB1  ))   ( (resid  25 and name HN   )) assign ((resid  24 and name HB2  ))   ( (resid  25 and name HD*  )) assign ((resid  24 and name HB2  ))   ( (resid  25 and name HN   )) assign ((resid  24 and name HE*  ))   ( (resid  25 and name HE*  )) assign ((resid  24 and name HE1  ))   ( (resid  25 and name HE*  )) assign ((resid  24 and name HE2  ))   ( (resid  25 and name HE*  )) assign ((resid  24 and name HG*  ))   ( (resid  24 and name HE*  )) assign ((resid  24 and name HN   ))   ( (resid  24 and name HB1  )) assign ((resid  24 and name HN   ))   ( (resid  24 and name HB2  )) assign ((resid  24 and name HN   ))   ( (resid  24 and name HG*  )) assign ((resid  24 and name HN   ))   ( (resid  25 and name HN   )) assign ((resid  25 and name HA   ))   ( (resid  25 and name HD*  )) assign ((resid  25 and name HA   ))   ( (resid  26 and name HD*  )) assign ((resid  25 and name HA   ))   ( (resid  26 and name HG*  )) assign ((resid  25 and name HB*  ))   ( (resid  27 and name HN   )) assign ((resid  25 and name HB*  ))   ( (resid  28 and name HN   )) assign ((resid  25 and name HD*  ))   ( (resid  25 and name HZ   )) assign ((resid  25 and name HN   ))   ( (resid  25 and name HB*  )) assign ((resid  25 and name HN   ))   ( (resid  25 and name HD*  )) assign ((resid  25 and name HN   ))   ( (resid  26 and name HD1  )) assign ((resid  25 and name HN   ))   ( (resid  26 and name HD2  )) assign ((resid  25 and name HN   ))   ( (resid  26 and name HG*  )) assign ((resid  26 and name HB*  ))   ( (resid  28 and name HN   )) assign ((resid  26 and name HD*  ))   ( (resid  27 and name HN   )) assign ((resid  26 and name HG*  ))   ( (resid  27 and name HN   )) assign ((resid  27 and name HA   ))   ( (resid  28 and name HD*  )) assign ((resid  27 and name HA   ))   ( (resid  28 and name HN   )) assign ((resid  27 and name HN   ))   ( (resid  27 and name HB*  )) assign ((resid  27 and name HN   ))   ( (resid  28 and name HD*  )) assign ((resid  27 and name HN   ))   ( (resid  28 and name HN   )) assign ((resid  28 and name HA   ))   ( (resid  28 and name HD*  )) assign ((resid  28 and name HA   ))   ( (resid  29 and name HB*  )) assign ((resid  28 and name HA   ))   ( (resid  29 and name HN   )) assign ((resid  28 and name HA   ))   ( (resid  43 and name HD2* )) assign ((resid  28 and name HA   ))   ( (resid  44 and name HA   )) assign ((resid  28 and name HA   ))   ( (resid  44 and name HB*  )) assign ((resid  28 and name HA   ))   ( (resid  45 and name HN   )) assign ((resid  28 and name HB*  ))   ( (resid  43 and name HD2* )) assign ((resid  28 and name HD*  ))   ( (resid  29 and name HN   )) assign ((resid  28 and name HD*  ))   ( (resid  44 and name HA   )) assign ((resid  28 and name HD*  ))   ( (resid  45 and name HN   )) assign ((resid  28 and name HE*  ))   ( (resid  45 and name HN   )) assign ((resid  28 and name HN   ))   ( (resid  28 and name HD*  )) assign ((resid  29 and name HA   ))   ( (resid  30 and name HG1* )) assign ((resid  29 and name HA   ))   ( (resid  30 and name HG2* )) assign ((resid  29 and name HA   ))   ( (resid  30 and name HN   )) assign ((resid  29 and name HB*  ))   ( (resid  30 and name HN   )) assign ((resid  29 and name HB*  ))   ( (resid  31 and name HD*  )) assign ((resid  29 and name HB*  ))   ( (resid  31 and name HE*  )) assign ((resid  29 and name HB*  ))   ( (resid  31 and name HZ   )) assign ((resid  29 and name HB*  ))   ( (resid  43 and name HA   )) assign ((resid  29 and name HB*  ))   ( (resid  43 and name HB1  )) assign ((resid  29 and name HB*  ))   ( (resid  43 and name HB2  )) assign ((resid  29 and name HB*  ))   ( (resid  43 and name HG   )) assign ((resid  29 and name HB*  ))   ( (resid  43 and name HN   )) assign ((resid  29 and name HN   ))   ( (resid  43 and name HB1  )) assign ((resid  29 and name HN   ))   ( (resid  43 and name HB2  )) assign ((resid  29 and name HN   ))   ( (resid  43 and name HD2* )) assign ((resid  29 and name HN   ))   ( (resid  43 and name HN   )) assign ((resid  29 and name HN   ))   ( (resid  44 and name HA   )) assign ((resid  30 and name HA   ))   ( (resid  30 and name HG1* )) assign ((resid  30 and name HA   ))   ( (resid  30 and name HG2* )) assign ((resid  30 and name HA   ))   ( (resid  31 and name HN   )) assign ((resid  30 and name HA   ))   ( (resid  42 and name HA   )) assign ((resid  30 and name HA   ))   ( (resid  42 and name HD2* )) assign ((resid  30 and name HA   ))   ( (resid  43 and name HN   )) assign ((resid  30 and name HB   ))   ( (resid  31 and name HN   )) assign ((resid  30 and name HG1* ))   ( (resid  31 and name HD*  )) assign ((resid  30 and name HG1* ))   ( (resid  31 and name HN   )) assign ((resid  30 and name HG1* ))   ( (resid  32 and name HB*  )) assign ((resid  30 and name HG1* ))   ( (resid  32 and name HD*  )) assign ((resid  30 and name HG1* ))   ( (resid  32 and name HG*  )) assign ((resid  30 and name HG1* ))   ( (resid  32 and name HN   )) assign ((resid  30 and name HG1* ))   ( (resid  41 and name HN   )) assign ((resid  30 and name HG1* ))   ( (resid  42 and name HA   )) assign ((resid  30 and name HG1* ))   ( (resid  42 and name HB*  )) assign ((resid  30 and name HG1* ))   ( (resid  42 and name HD1* )) assign ((resid  30 and name HG1* ))   ( (resid  42 and name HD2* )) assign ((resid  30 and name HG2* ))   ( (resid  42 and name HA   )) assign ((resid  30 and name HG2* ))   ( (resid  42 and name HB*  )) assign ((resid  30 and name HG2* ))   ( (resid  42 and name HD1* )) assign ((resid  30 and name HG2* ))   ( (resid  42 and name HD2* )) assign ((resid  30 and name HN   ))   ( (resid  30 and name HB   )) assign ((resid  30 and name HN   ))   ( (resid  30 and name HG1* )) assign ((resid  30 and name HN   ))   ( (resid  30 and name HG2* )) assign ((resid  31 and name HA   ))   ( (resid  31 and name HD*  )) assign ((resid  31 and name HA   ))   ( (resid  32 and name HN   )) assign ((resid  31 and name HA   ))   ( (resid  41 and name HB*  )) assign ((resid  31 and name HB*  ))   ( (resid  41 and name HB*  )) assign ((resid  31 and name HB*  ))   ( (resid  41 and name HN   )) assign ((resid  31 and name HB1  ))   ( (resid  32 and name HN   )) assign ((resid  31 and name HB2  ))   ( (resid  32 and name HN   )) assign ((resid  31 and name HD*  ))   ( (resid  41 and name HB*  )) assign ((resid  31 and name HD*  ))   ( (resid  41 and name HN   )) assign ((resid  31 and name HE*  ))   ( (resid  43 and name HB1  )) assign ((resid  31 and name HE*  ))   ( (resid  43 and name HB2  )) assign ((resid  31 and name HE*  ))   ( (resid  43 and name HD1* )) assign ((resid  31 and name HE*  ))   ( (resid  43 and name HN   )) assign ((resid  31 and name HN   ))   ( (resid  31 and name HD*  )) assign ((resid  31 and name HN   ))   ( (resid  41 and name HB*  )) assign ((resid  31 and name HN   ))   ( (resid  41 and name HN   )) assign ((resid  31 and name HN   ))   ( (resid  42 and name HA   )) assign ((resid  31 and name HZ   ))   ( (resid  43 and name HB*  )) assign ((resid  31 and name HZ   ))   ( (resid  43 and name HD1* )) assign ((resid  32 and name HA   ))   ( (resid  40 and name HN   )) assign ((resid  32 and name HB*  ))   ( (resid  32 and name HD*  )) assign ((resid  32 and name HB*  ))   ( (resid  32 and name HE   )) assign ((resid  32 and name HB*  ))   ( (resid  33 and name HN   )) assign ((resid  32 and name HB*  ))   ( (resid  39 and name HD1  )) assign ((resid  32 and name HN   ))   ( (resid  32 and name HB*  )) assign ((resid  32 and name HN   ))   ( (resid  33 and name HN   )) assign ((resid  32 and name HN   ))   ( (resid  41 and name HB*  )) assign ((resid  33 and name HA   ))   ( (resid  34 and name HA   )) assign ((resid  33 and name HA   ))   ( (resid  34 and name HN   )) assign ((resid  33 and name HB*  ))   ( (resid  34 and name HN   )) assign ((resid  33 and name HB*  ))   ( (resid  35 and name HN   )) assign ((resid  33 and name HB*  ))   ( (resid  36 and name HN   )) assign ((resid  33 and name HB*  ))   ( (resid  38 and name HN   )) assign ((resid  33 and name HN   ))   ( (resid  34 and name HN   )) assign ((resid  34 and name HA   ))   ( (resid  37 and name HN   )) assign ((resid  34 and name HB*  ))   ( (resid  35 and name HA   )) assign ((resid  34 and name HB*  ))   ( (resid  35 and name HB*  )) assign ((resid  34 and name HB*  ))   ( (resid  35 and name HN   )) assign ((resid  34 and name HN   ))   ( (resid  34 and name HB*  )) assign ((resid  34 and name HN   ))   ( (resid  35 and name HN   )) assign ((resid  35 and name HB*  ))   ( (resid  36 and name HN   )) assign ((resid  35 and name HB*  ))   ( (resid 118 and name HD1* )) assign ((resid  35 and name HB*  ))   ( (resid 118 and name HD2* )) assign ((resid  35 and name HN   ))   ( (resid  35 and name HB*  )) assign ((resid  35 and name HN   ))   ( (resid  36 and name HN   )) assign ((resid  35 and name HN   ))   ( (resid  37 and name HN   )) assign ((resid  36 and name HA   ))   ( (resid 118 and name HD2* )) assign ((resid  36 and name HB*  ))   ( (resid  37 and name HN   )) assign ((resid  36 and name HB*  ))   ( (resid 118 and name HA   )) assign ((resid  36 and name HB*  ))   ( (resid 118 and name HB*  )) assign ((resid  36 and name HB*  ))   ( (resid 118 and name HD1* )) assign ((resid  36 and name HB*  ))   ( (resid 118 and name HD2* )) assign ((resid  36 and name HB*  ))   ( (resid 118 and name HG   )) assign ((resid  36 and name HD2* ))   ( (resid 117 and name HA   )) assign ((resid  36 and name HD2* ))   ( (resid 118 and name HA   )) assign ((resid  36 and name HD2* ))   ( (resid 118 and name HB*  )) assign ((resid  36 and name HD2* ))   ( (resid 118 and name HD1* )) assign ((resid  36 and name HD2* ))   ( (resid 118 and name HD2* )) assign ((resid  36 and name HD2* ))   ( (resid 118 and name HG   )) assign ((resid  36 and name HD2* ))   ( (resid 118 and name HN   )) assign ((resid  36 and name HD2* ))   ( (resid 119 and name HN   )) assign ((resid  36 and name HD21 ))   ( (resid 118 and name HA   )) assign ((resid  36 and name HD21 ))   ( (resid 118 and name HG   )) assign ((resid  36 and name HD22 ))   ( (resid 118 and name HA   )) assign ((resid  36 and name HD22 ))   ( (resid 118 and name HG   )) assign ((resid  37 and name HN   ))   ( (resid  37 and name HB*  )) assign ((resid  37 and name HN   ))   ( (resid  38 and name HN   )) assign ((resid  38 and name HB*  ))   ( (resid  38 and name HD*  )) assign ((resid  38 and name HB*  ))   ( (resid  38 and name HE*  )) assign ((resid  38 and name HN   ))   ( (resid  38 and name HB*  )) assign ((resid  38 and name HN   ))   ( (resid  38 and name HD*  )) assign ((resid  38 and name HN   ))   ( (resid  39 and name HB*  )) assign ((resid  39 and name HA   ))   ( (resid  39 and name HD1  )) assign ((resid  39 and name HA   ))   ( (resid  39 and name HE3  )) assign ((resid  40 and name HB*  ))   ( (resid  91 and name HD1  )) assign ((resid  40 and name HN   ))   ( (resid  41 and name HN   )) assign ((resid  41 and name HA   ))   ( (resid  42 and name HN   )) assign ((resid  41 and name HA   ))   ( (resid  64 and name HA   )) assign ((resid  41 and name HB*  ))   ( (resid  42 and name HN   )) assign ((resid  42 and name HA   ))   ( (resid  42 and name HD1* )) assign ((resid  42 and name HA   ))   ( (resid  42 and name HD2* )) assign ((resid  42 and name HA   ))   ( (resid  43 and name HN   )) assign ((resid  42 and name HA   ))   ( (resid  44 and name HE*  )) assign ((resid  42 and name HB1  ))   ( (resid  42 and name HD1* )) assign ((resid  42 and name HB1  ))   ( (resid  42 and name HD2* )) assign ((resid  42 and name HB1  ))   ( (resid  43 and name HN   )) assign ((resid  42 and name HB2  ))   ( (resid  42 and name HD1* )) assign ((resid  42 and name HB2  ))   ( (resid  42 and name HD2* )) assign ((resid  42 and name HB2  ))   ( (resid  43 and name HN   )) assign ((resid  42 and name HD1* ))   ( (resid  44 and name HB*  )) assign ((resid  42 and name HD1* ))   ( (resid  44 and name HE*  )) assign ((resid  42 and name HD1* ))   ( (resid  44 and name HG1  )) assign ((resid  42 and name HD1* ))   ( (resid  44 and name HG2  )) assign ((resid  42 and name HD2* ))   ( (resid  44 and name HE*  )) assign ((resid  42 and name HD2* ))   ( (resid  44 and name HG2  )) assign ((resid  42 and name HG   ))   ( (resid  44 and name HE*  )) assign ((resid  42 and name HN   ))   ( (resid  42 and name HD1* )) assign ((resid  42 and name HN   ))   ( (resid  42 and name HD2* )) assign ((resid  43 and name HA   ))   ( (resid  43 and name HD1* )) assign ((resid  43 and name HA   ))   ( (resid  43 and name HD2* )) assign ((resid  43 and name HA   ))   ( (resid  44 and name HN   )) assign ((resid  43 and name HA   ))   ( (resid  61 and name HG2* )) assign ((resid  43 and name HA   ))   ( (resid  62 and name HA   )) assign ((resid  43 and name HA   ))   ( (resid  62 and name HG2* )) assign ((resid  43 and name HB*  ))   ( (resid  44 and name HG*  )) assign ((resid  43 and name HB1  ))   ( (resid  43 and name HD1* )) assign ((resid  43 and name HB1  ))   ( (resid  43 and name HD2* )) assign ((resid  43 and name HB1  ))   ( (resid  62 and name HG2* )) assign ((resid  43 and name HB2  ))   ( (resid  43 and name HD1* )) assign ((resid  43 and name HB2  ))   ( (resid  43 and name HD2* )) assign ((resid  43 and name HB2  ))   ( (resid  62 and name HG2* )) assign ((resid  43 and name HD1* ))   ( (resid  62 and name HG2* )) assign ((resid  43 and name HD2* ))   ( (resid  44 and name HG*  )) assign ((resid  43 and name HD2* ))   ( (resid  44 and name HN   )) assign ((resid  43 and name HD2* ))   ( (resid  60 and name HB1  )) assign ((resid  43 and name HD2* ))   ( (resid  60 and name HB2  )) assign ((resid  43 and name HD2* ))   ( (resid  61 and name HG2* )) assign ((resid  43 and name HD2* ))   ( (resid  61 and name HN   )) assign ((resid  43 and name HD2* ))   ( (resid  62 and name HD1* )) assign ((resid  43 and name HD2* ))   ( (resid  62 and name HG2* )) assign ((resid  43 and name HG   ))   ( (resid  44 and name HN   )) assign ((resid  43 and name HN   ))   ( (resid  43 and name HD2* )) assign ((resid  44 and name HA   ))   ( (resid  45 and name HN   )) assign ((resid  44 and name HA   ))   ( (resid  61 and name HG2* )) assign ((resid  44 and name HB*  ))   ( (resid  44 and name HE*  )) assign ((resid  44 and name HB*  ))   ( (resid  45 and name HN   )) assign ((resid  44 and name HE*  ))   ( (resid  46 and name HB   )) assign ((resid  44 and name HE*  ))   ( (resid  46 and name HD1* )) assign ((resid  44 and name HE*  ))   ( (resid  46 and name HG2* )) assign ((resid  44 and name HE*  ))   ( (resid  61 and name HG1* )) assign ((resid  44 and name HE*  ))   ( (resid  61 and name HG2* )) assign ((resid  44 and name HE*  ))   ( (resid  62 and name HA   )) assign ((resid  44 and name HE*  ))   ( (resid  84 and name HE*  )) assign ((resid  44 and name HG*  ))   ( (resid  44 and name HE*  )) assign ((resid  44 and name HG*  ))   ( (resid  61 and name HG2* )) assign ((resid  44 and name HN   ))   ( (resid  44 and name HE*  )) assign ((resid  44 and name HN   ))   ( (resid  44 and name HG*  )) assign ((resid  44 and name HN   ))   ( (resid  45 and name HN   )) assign ((resid  44 and name HN   ))   ( (resid  61 and name HG2* )) assign ((resid  44 and name HN   ))   ( (resid  61 and name HN   )) assign ((resid  44 and name HN   ))   ( (resid  62 and name HA   )) assign ((resid  44 and name HN   ))   ( (resid  62 and name HG2* )) assign ((resid  45 and name HA   ))   ( (resid  46 and name HN   )) assign ((resid  45 and name HA   ))   ( (resid  59 and name HN   )) assign ((resid  45 and name HA   ))   ( (resid  60 and name HA   )) assign ((resid  45 and name HA   ))   ( (resid  61 and name HG2* )) assign ((resid  45 and name HA   ))   ( (resid  61 and name HN   )) assign ((resid  45 and name HB*  ))   ( (resid  58 and name HB*  )) assign ((resid  45 and name HN   ))   ( (resid  46 and name HG2* )) assign ((resid  45 and name HN   ))   ( (resid  46 and name HN   )) assign ((resid  46 and name HA   ))   ( (resid  46 and name HD1* )) assign ((resid  46 and name HA   ))   ( (resid  47 and name HD*  )) assign ((resid  46 and name HA   ))   ( (resid  47 and name HG*  )) assign ((resid  46 and name HB   ))   ( (resid  46 and name HD1* )) assign ((resid  46 and name HB   ))   ( (resid  47 and name HB*  )) assign ((resid  46 and name HB   ))   ( (resid  47 and name HD1  )) assign ((resid  46 and name HB   ))   ( (resid  47 and name HD2  )) assign ((resid  46 and name HD1* ))   ( (resid  47 and name HB*  )) assign ((resid  46 and name HD1* ))   ( (resid  47 and name HD*  )) assign ((resid  46 and name HD1* ))   ( (resid  47 and name HG*  )) assign ((resid  46 and name HD1* ))   ( (resid  50 and name HB*  )) assign ((resid  46 and name HD1* ))   ( (resid  50 and name HN   )) assign ((resid  46 and name HD1* ))   ( (resid  51 and name HA   )) assign ((resid  46 and name HD1* ))   ( (resid  51 and name HG2* )) assign ((resid  46 and name HD1* ))   ( (resid  59 and name HG2* )) assign ((resid  46 and name HD1* ))   ( (resid  61 and name HB   )) assign ((resid  46 and name HD1* ))   ( (resid  61 and name HG1* )) assign ((resid  46 and name HD1* ))   ( (resid  61 and name HG2* )) assign ((resid  46 and name HD1* ))   ( (resid  84 and name HB*  )) assign ((resid  46 and name HD1* ))   ( (resid  84 and name HD*  )) assign ((resid  46 and name HD1* ))   ( (resid  84 and name HE*  )) assign ((resid  46 and name HG1* ))   ( (resid  48 and name HN   )) assign ((resid  46 and name HG1* ))   ( (resid  59 and name HN   )) assign ((resid  46 and name HG1* ))   ( (resid  61 and name HA   )) assign ((resid  46 and name HG1* ))   ( (resid  61 and name HB   )) assign ((resid  46 and name HG1* ))   ( (resid  61 and name HG1* )) assign ((resid  46 and name HG1* ))   ( (resid  61 and name HG2* )) assign ((resid  46 and name HG2* ))   ( (resid  46 and name HD1* )) assign ((resid  46 and name HG2* ))   ( (resid  47 and name HD*  )) assign ((resid  46 and name HG2* ))   ( (resid  84 and name HD*  )) assign ((resid  46 and name HG2* ))   ( (resid  84 and name HE*  )) assign ((resid  46 and name HN   ))   ( (resid  46 and name HD1* )) assign ((resid  46 and name HN   ))   ( (resid  46 and name HG11 )) assign ((resid  46 and name HN   ))   ( (resid  46 and name HG12 )) assign ((resid  46 and name HN   ))   ( (resid  58 and name HB*  )) assign ((resid  46 and name HN   ))   ( (resid  58 and name HG*  )) assign ((resid  46 and name HN   ))   ( (resid  59 and name HN   )) assign ((resid  46 and name HN   ))   ( (resid  60 and name HA   )) assign ((resid  46 and name HN   ))   ( (resid  61 and name HG2* )) assign ((resid  47 and name HA   ))   ( (resid  48 and name HB*  )) assign ((resid  47 and name HA   ))   ( (resid  48 and name HN   )) assign ((resid  47 and name HA   ))   ( (resid  58 and name HA   )) assign ((resid  47 and name HA   ))   ( (resid  58 and name HG*  )) assign ((resid  47 and name HA   ))   ( (resid  59 and name HN   )) assign ((resid  47 and name HB*  ))   ( (resid  49 and name HB*  )) assign ((resid  47 and name HB*  ))   ( (resid  50 and name HG*  )) assign ((resid  47 and name HB*  ))   ( (resid  50 and name HN   )) assign ((resid  47 and name HB*  ))   ( (resid  58 and name HA   )) assign ((resid  47 and name HB1  ))   ( (resid  48 and name HN   )) assign ((resid  47 and name HB1  ))   ( (resid  49 and name HG*  )) assign ((resid  47 and name HB1  ))   ( (resid  49 and name HN   )) assign ((resid  47 and name HB2  ))   ( (resid  48 and name HN   )) assign ((resid  47 and name HB2  ))   ( (resid  49 and name HG*  )) assign ((resid  47 and name HB2  ))   ( (resid  49 and name HN   )) assign ((resid  47 and name HD*  ))   ( (resid  50 and name HE*  )) assign ((resid  47 and name HG*  ))   ( (resid  49 and name HN   )) assign ((resid  47 and name HG*  ))   ( (resid  50 and name HG*  )) assign ((resid  47 and name HG*  ))   ( (resid  50 and name HN   )) assign ((resid  48 and name HA   ))   ( (resid  51 and name HD1* )) assign ((resid  48 and name HA   ))   ( (resid  51 and name HG1* )) assign ((resid  48 and name HA   ))   ( (resid  51 and name HN   )) assign ((resid  48 and name HA   ))   ( (resid  53 and name HB   )) assign ((resid  48 and name HA   ))   ( (resid  53 and name HD1* )) assign ((resid  48 and name HA   ))   ( (resid  53 and name HG2* )) assign ((resid  48 and name HA   ))   ( (resid  59 and name HG1* )) assign ((resid  48 and name HA   ))   ( (resid  59 and name HG2* )) assign ((resid  48 and name HB*  ))   ( (resid  49 and name HA   )) assign ((resid  48 and name HB*  ))   ( (resid  49 and name HN   )) assign ((resid  48 and name HB*  ))   ( (resid  50 and name HN   )) assign ((resid  48 and name HB*  ))   ( (resid  51 and name HD1* )) assign ((resid  48 and name HB*  ))   ( (resid  53 and name HA   )) assign ((resid  48 and name HB*  ))   ( (resid  53 and name HB   )) assign ((resid  48 and name HB*  ))   ( (resid  53 and name HD1* )) assign ((resid  48 and name HB*  ))   ( (resid  53 and name HG11 )) assign ((resid  48 and name HB*  ))   ( (resid  53 and name HG12 )) assign ((resid  48 and name HB*  ))   ( (resid  53 and name HG2* )) assign ((resid  48 and name HB*  ))   ( (resid  53 and name HN   )) assign ((resid  48 and name HB*  ))   ( (resid  54 and name HA   )) assign ((resid  48 and name HB*  ))   ( (resid  54 and name HB*  )) assign ((resid  48 and name HB*  ))   ( (resid  55 and name HA*  )) assign ((resid  48 and name HB*  ))   ( (resid  55 and name HN   )) assign ((resid  48 and name HB*  ))   ( (resid  56 and name HA   )) assign ((resid  48 and name HB*  ))   ( (resid  56 and name HB*  )) assign ((resid  48 and name HB*  ))   ( (resid  56 and name HN   )) assign ((resid  48 and name HB*  ))   ( (resid  57 and name HA   )) assign ((resid  48 and name HB*  ))   ( (resid  57 and name HD1  )) assign ((resid  48 and name HB*  ))   ( (resid  57 and name HD2  )) assign ((resid  48 and name HB*  ))   ( (resid  57 and name HG*  )) assign ((resid  48 and name HB*  ))   ( (resid  57 and name HN   )) assign ((resid  48 and name HB*  ))   ( (resid  58 and name HA   )) assign ((resid  48 and name HB*  ))   ( (resid  59 and name HG1* )) assign ((resid  48 and name HB*  ))   ( (resid  59 and name HG2* )) assign ((resid  48 and name HB*  ))   ( (resid  59 and name HN   )) assign ((resid  48 and name HN   ))   ( (resid  48 and name HB*  )) assign ((resid  48 and name HN   ))   ( (resid  49 and name HN   )) assign ((resid  48 and name HN   ))   ( (resid  50 and name HN   )) assign ((resid  48 and name HN   ))   ( (resid  57 and name HG*  )) assign ((resid  48 and name HN   ))   ( (resid  57 and name HN   )) assign ((resid  48 and name HN   ))   ( (resid  58 and name HG*  )) assign ((resid  48 and name HN   ))   ( (resid  59 and name HG1* )) assign ((resid  48 and name HN   ))   ( (resid  59 and name HG2* )) assign ((resid  48 and name HN   ))   ( (resid  59 and name HN   )) assign ((resid  49 and name HA   ))   ( (resid  52 and name HN   )) assign ((resid  49 and name HA   ))   ( (resid  53 and name HG2* )) assign ((resid  49 and name HA   ))   ( (resid  53 and name HN   )) assign ((resid  49 and name HA   ))   ( (resid  56 and name HA   )) assign ((resid  49 and name HB*  ))   ( (resid  52 and name HN   )) assign ((resid  49 and name HB1  ))   ( (resid  50 and name HN   )) assign ((resid  49 and name HB2  ))   ( (resid  50 and name HN   )) assign ((resid  49 and name HG*  ))   ( (resid  50 and name HN   )) assign ((resid  49 and name HN   ))   ( (resid  49 and name HB*  )) assign ((resid  49 and name HN   ))   ( (resid  49 and name HG*  )) assign ((resid  49 and name HN   ))   ( (resid  50 and name HN   )) assign ((resid  49 and name HN   ))   ( (resid  53 and name HB   )) assign ((resid  50 and name HA   ))   ( (resid  50 and name HD*  )) assign ((resid  50 and name HA   ))   ( (resid  51 and name HG2* )) assign ((resid  50 and name HB*  ))   ( (resid  51 and name HN   )) assign ((resid  50 and name HB*  ))   ( (resid  84 and name HB*  )) assign ((resid  50 and name HB*  ))   ( (resid  84 and name HD*  )) assign ((resid  50 and name HB*  ))   ( (resid  84 and name HE*  )) assign ((resid  50 and name HG1  ))   ( (resid  51 and name HN   )) assign ((resid  50 and name HG2  ))   ( (resid  51 and name HN   )) assign ((resid  50 and name HN   ))   ( (resid  50 and name HB*  )) assign ((resid  50 and name HN   ))   ( (resid  50 and name HG*  )) assign ((resid  50 and name HN   ))   ( (resid  51 and name HG11 )) assign ((resid  50 and name HN   ))   ( (resid  51 and name HG12 )) assign ((resid  50 and name HN   ))   ( (resid  51 and name HG2* )) assign ((resid  50 and name HN   ))   ( (resid  51 and name HN   )) assign ((resid  50 and name HN   ))   ( (resid  52 and name HN   )) assign ((resid  51 and name HA   ))   ( (resid  51 and name HD1* )) assign ((resid  51 and name HA   ))   ( (resid  51 and name HG2* )) assign ((resid  51 and name HA   ))   ( (resid  52 and name HN   )) assign ((resid  51 and name HB   ))   ( (resid  51 and name HD1* )) assign ((resid  51 and name HB   ))   ( (resid  52 and name HN   )) assign ((resid  51 and name HB   ))   ( (resid  53 and name HD1* )) assign ((resid  51 and name HB   ))   ( (resid  81 and name HA   )) assign ((resid  51 and name HB   ))   ( (resid  81 and name HD*  )) assign ((resid  51 and name HD1* ))   ( (resid  53 and name HB   )) assign ((resid  51 and name HD1* ))   ( (resid  53 and name HD1* )) assign ((resid  51 and name HD1* ))   ( (resid  53 and name HG1* )) assign ((resid  51 and name HD1* ))   ( (resid  53 and name HG2* )) assign ((resid  51 and name HD1* ))   ( (resid  59 and name HB   )) assign ((resid  51 and name HD1* ))   ( (resid  59 and name HG1* )) assign ((resid  51 and name HD1* ))   ( (resid  59 and name HG2* )) assign ((resid  51 and name HD1* ))   ( (resid  61 and name HB   )) assign ((resid  51 and name HD1* ))   ( (resid  61 and name HG1* )) assign ((resid  51 and name HD1* ))   ( (resid  81 and name HB*  )) assign ((resid  51 and name HD1* ))   ( (resid  81 and name HD*  )) assign ((resid  51 and name HD1* ))   ( (resid  81 and name HE*  )) assign ((resid  51 and name HD1* ))   ( (resid  95 and name HB*  )) assign ((resid  51 and name HD1* ))   ( (resid  95 and name HD1* )) assign ((resid  51 and name HG1* ))   ( (resid  53 and name HG1* )) assign ((resid  51 and name HG1* ))   ( (resid  81 and name HB*  )) assign ((resid  51 and name HG1* ))   ( (resid  81 and name HD*  )) assign ((resid  51 and name HG1* ))   ( (resid  81 and name HE*  )) assign ((resid  51 and name HG11 ))   ( (resid  52 and name HN   )) assign ((resid  51 and name HG11 ))   ( (resid  53 and name HN   )) assign ((resid  51 and name HG12 ))   ( (resid  52 and name HN   )) assign ((resid  51 and name HG12 ))   ( (resid  53 and name HN   )) assign ((resid  51 and name HG2* ))   ( (resid  51 and name HD1* )) assign ((resid  51 and name HG2* ))   ( (resid  51 and name HG11 )) assign ((resid  51 and name HG2* ))   ( (resid  51 and name HG12 )) assign ((resid  51 and name HG2* ))   ( (resid  52 and name HN   )) assign ((resid  51 and name HG2* ))   ( (resid  53 and name HB   )) assign ((resid  51 and name HG2* ))   ( (resid  61 and name HG1* )) assign ((resid  51 and name HG2* ))   ( (resid  81 and name HA   )) assign ((resid  51 and name HG2* ))   ( (resid  81 and name HB*  )) assign ((resid  51 and name HG2* ))   ( (resid  81 and name HD*  )) assign ((resid  51 and name HG2* ))   ( (resid  82 and name HD*  )) assign ((resid  51 and name HG2* ))   ( (resid  84 and name HD*  )) assign ((resid  51 and name HG2* ))   ( (resid  93 and name HB   )) assign ((resid  51 and name HG2* ))   ( (resid  93 and name HG*  )) assign ((resid  51 and name HN   ))   ( (resid  51 and name HD1* )) assign ((resid  51 and name HN   ))   ( (resid  51 and name HG11 )) assign ((resid  51 and name HN   ))   ( (resid  51 and name HG12 )) assign ((resid  51 and name HN   ))   ( (resid  51 and name HG2* )) assign ((resid  51 and name HN   ))   ( (resid  52 and name HN   )) assign ((resid  51 and name HN   ))   ( (resid  53 and name HB   )) assign ((resid  52 and name HN   ))   ( (resid  53 and name HB   )) assign ((resid  53 and name HA   ))   ( (resid  53 and name HD1* )) assign ((resid  53 and name HA   ))   ( (resid  53 and name HG11 )) assign ((resid  53 and name HA   ))   ( (resid  53 and name HG12 )) assign ((resid  53 and name HA   ))   ( (resid  53 and name HG2* )) assign ((resid  53 and name HA   ))   ( (resid  54 and name HB*  )) assign ((resid  53 and name HA   ))   ( (resid  54 and name HN   )) assign ((resid  53 and name HA   ))   ( (resid  55 and name HN   )) assign ((resid  53 and name HB   ))   ( (resid  53 and name HD1* )) assign ((resid  53 and name HB   ))   ( (resid  54 and name HN   )) assign ((resid  53 and name HB   ))   ( (resid  55 and name HN   )) assign ((resid  53 and name HB   ))   ( (resid  59 and name HG1* )) assign ((resid  53 and name HD1* ))   ( (resid  54 and name HN   )) assign ((resid  53 and name HD1* ))   ( (resid  55 and name HN   )) assign ((resid  53 and name HD1* ))   ( (resid  59 and name HG1* )) assign ((resid  53 and name HD1* ))   ( (resid  59 and name HG2* )) assign ((resid  53 and name HD1* ))   ( (resid  81 and name HE*  )) assign ((resid  53 and name HD1* ))   ( (resid  95 and name HB*  )) assign ((resid  53 and name HD1* ))   ( (resid  95 and name HD1* )) assign ((resid  53 and name HD1* ))   ( (resid  95 and name HD2* )) assign ((resid  53 and name HG1* ))   ( (resid  54 and name HN   )) assign ((resid  53 and name HG1* ))   ( (resid  95 and name HD2* )) assign ((resid  53 and name HG2* ))   ( (resid  53 and name HD1* )) assign ((resid  53 and name HG2* ))   ( (resid  53 and name HG11 )) assign ((resid  53 and name HG2* ))   ( (resid  53 and name HG12 )) assign ((resid  53 and name HG2* ))   ( (resid  54 and name HA   )) assign ((resid  53 and name HG2* ))   ( (resid  54 and name HB*  )) assign ((resid  53 and name HG2* ))   ( (resid  54 and name HN   )) assign ((resid  53 and name HG2* ))   ( (resid  55 and name HA*  )) assign ((resid  53 and name HG2* ))   ( (resid  55 and name HN   )) assign ((resid  53 and name HG2* ))   ( (resid  56 and name HN   )) assign ((resid  53 and name HG2* ))   ( (resid  57 and name HN   )) assign ((resid  53 and name HN   ))   ( (resid  53 and name HB   )) assign ((resid  53 and name HN   ))   ( (resid  53 and name HD1* )) assign ((resid  53 and name HN   ))   ( (resid  53 and name HG1* )) assign ((resid  53 and name HN   ))   ( (resid  53 and name HG2* )) assign ((resid  53 and name HN   ))   ( (resid  54 and name HN   )) assign ((resid  53 and name HN   ))   ( (resid  59 and name HG2* )) assign ((resid  54 and name HB*  ))   ( (resid  54 and name HD2* )) assign ((resid  54 and name HB*  ))   ( (resid  55 and name HA*  )) assign ((resid  54 and name HB*  ))   ( (resid  55 and name HN   )) assign ((resid  54 and name HN   ))   ( (resid  54 and name HB*  )) assign ((resid  54 and name HN   ))   ( (resid  54 and name HD2* )) assign ((resid  55 and name HA*  ))   ( (resid  56 and name HB*  )) assign ((resid  55 and name HA*  ))   ( (resid  56 and name HN   )) assign ((resid  55 and name HA*  ))   ( (resid  57 and name HN   )) assign ((resid  55 and name HN   ))   ( (resid  55 and name HA*  )) assign ((resid  56 and name HA   ))   ( (resid  57 and name HG*  )) assign ((resid  56 and name HA   ))   ( (resid  57 and name HN   )) assign ((resid  56 and name HB*  ))   ( (resid  57 and name HN   )) assign ((resid  56 and name HN   ))   ( (resid  56 and name HB*  )) assign ((resid  56 and name HN   ))   ( (resid  57 and name HN   )) assign ((resid  57 and name HA   ))   ( (resid  57 and name HD*  )) assign ((resid  57 and name HB*  ))   ( (resid  59 and name HG1* )) assign ((resid  57 and name HB1  ))   ( (resid  58 and name HN   )) assign ((resid  57 and name HB2  ))   ( (resid  58 and name HN   )) assign ((resid  57 and name HD*  ))   ( (resid  58 and name HN   )) assign ((resid  57 and name HG*  ))   ( (resid  58 and name HN   )) assign ((resid  57 and name HG*  ))   ( (resid  59 and name HG1* )) assign ((resid  57 and name HN   ))   ( (resid  57 and name HB1  )) assign ((resid  57 and name HN   ))   ( (resid  57 and name HB2  )) assign ((resid  57 and name HN   ))   ( (resid  57 and name HG*  )) assign ((resid  57 and name HN   ))   ( (resid  58 and name HN   )) assign ((resid  57 and name HN   ))   ( (resid  59 and name HG1* )) assign ((resid  58 and name HA   ))   ( (resid  59 and name HG2* )) assign ((resid  58 and name HA   ))   ( (resid  59 and name HN   )) assign ((resid  58 and name HB*  ))   ( (resid  58 and name HD*  )) assign ((resid  58 and name HB*  ))   ( (resid  58 and name HE   )) assign ((resid  58 and name HB*  ))   ( (resid  59 and name HN   )) assign ((resid  58 and name HG*  ))   ( (resid  59 and name HN   )) assign ((resid  58 and name HN   ))   ( (resid  58 and name HB*  )) assign ((resid  58 and name HN   ))   ( (resid  58 and name HE   )) assign ((resid  58 and name HN   ))   ( (resid  59 and name HG1* )) assign ((resid  58 and name HN   ))   ( (resid  59 and name HG2* )) assign ((resid  58 and name HN   ))   ( (resid  59 and name HN   )) assign ((resid  59 and name HA   ))   ( (resid  59 and name HG1* )) assign ((resid  59 and name HA   ))   ( (resid  59 and name HG2* )) assign ((resid  59 and name HA   ))   ( (resid  60 and name HN   )) assign ((resid  59 and name HA   ))   ( (resid  95 and name HD1* )) assign ((resid  59 and name HB   ))   ( (resid  60 and name HN   )) assign ((resid  59 and name HB   ))   ( (resid  95 and name HD1* )) assign ((resid  59 and name HG1* ))   ( (resid  60 and name HB*  )) assign ((resid  59 and name HG1* ))   ( (resid  60 and name HN   )) assign ((resid  59 and name HG1* ))   ( (resid  61 and name HG1* )) assign ((resid  59 and name HG2* ))   ( (resid  60 and name HN   )) assign ((resid  59 and name HG2* ))   ( (resid  95 and name HB*  )) assign ((resid  59 and name HG2* ))   ( (resid  95 and name HD1* )) assign ((resid  59 and name HG2* ))   ( (resid  95 and name HD2* )) assign ((resid  59 and name HN   ))   ( (resid  59 and name HG1* )) assign ((resid  59 and name HN   ))   ( (resid  59 and name HG2* )) assign ((resid  59 and name HN   ))   ( (resid  60 and name HN   )) assign ((resid  60 and name HA   ))   ( (resid  61 and name HG1* )) assign ((resid  60 and name HA   ))   ( (resid  61 and name HG2* )) assign ((resid  60 and name HA   ))   ( (resid  61 and name HN   )) assign ((resid  60 and name HA   ))   ( (resid  96 and name HD1* )) assign ((resid  60 and name HB*  ))   ( (resid  62 and name HG2* )) assign ((resid  60 and name HB*  ))   ( (resid  96 and name HB1  )) assign ((resid  60 and name HB*  ))   ( (resid  96 and name HB2  )) assign ((resid  60 and name HB*  ))   ( (resid  96 and name HD2* )) assign ((resid  60 and name HB1  ))   ( (resid  61 and name HN   )) assign ((resid  60 and name HB1  ))   ( (resid  96 and name HB*  )) assign ((resid  60 and name HB1  ))   ( (resid  96 and name HD1* )) assign ((resid  60 and name HB2  ))   ( (resid  61 and name HN   )) assign ((resid  60 and name HB2  ))   ( (resid  96 and name HB*  )) assign ((resid  60 and name HB2  ))   ( (resid  96 and name HD1* )) assign ((resid  60 and name HN   ))   ( (resid  60 and name HB1  )) assign ((resid  60 and name HN   ))   ( (resid  60 and name HB2  )) assign ((resid  60 and name HN   ))   ( (resid  61 and name HN   )) assign ((resid  60 and name HN   ))   ( (resid  95 and name HD1* )) assign ((resid  60 and name HN   ))   ( (resid  96 and name HN   )) assign ((resid  60 and name HN   ))   ( (resid  97 and name HA   )) assign ((resid  61 and name HA   ))   ( (resid  61 and name HG1* )) assign ((resid  61 and name HA   ))   ( (resid  62 and name HN   )) assign ((resid  61 and name HA   ))   ( (resid  95 and name HA   )) assign ((resid  61 and name HA   ))   ( (resid  95 and name HD1* )) assign ((resid  61 and name HA   ))   ( (resid  96 and name HD2* )) assign ((resid  61 and name HA   ))   ( (resid  96 and name HG   )) assign ((resid  61 and name HA   ))   ( (resid  96 and name HN   )) assign ((resid  61 and name HB   ))   ( (resid  62 and name HN   )) assign ((resid  61 and name HG1* ))   ( (resid  62 and name HN   )) assign ((resid  61 and name HG1* ))   ( (resid  95 and name HA   )) assign ((resid  61 and name HG1* ))   ( (resid  95 and name HB*  )) assign ((resid  61 and name HG1* ))   ( (resid  95 and name HD1* )) assign ((resid  61 and name HG1* ))   ( (resid  95 and name HD2* )) assign ((resid  61 and name HG1* ))   ( (resid  95 and name HG   )) assign ((resid  61 and name HG1* ))   ( (resid  96 and name HN   )) assign ((resid  61 and name HG2* ))   ( (resid  62 and name HA   )) assign ((resid  61 and name HG2* ))   ( (resid  62 and name HN   )) assign ((resid  61 and name HN   ))   ( (resid  61 and name HG1* )) assign ((resid  61 and name HN   ))   ( (resid  61 and name HG2* )) assign ((resid  62 and name HA   ))   ( (resid  62 and name HD1* )) assign ((resid  62 and name HB   ))   ( (resid  62 and name HD1* )) assign ((resid  62 and name HD1* ))   ( (resid  64 and name HD2* )) assign ((resid  62 and name HD1* ))   ( (resid  94 and name HB   )) assign ((resid  62 and name HD1* ))   ( (resid  94 and name HG1* )) assign ((resid  62 and name HD1* ))   ( (resid  96 and name HD1* )) assign ((resid  62 and name HD1* ))   ( (resid  96 and name HD2* )) assign ((resid  62 and name HD1* ))   ( (resid 105 and name HD1* )) assign ((resid  62 and name HD1* ))   ( (resid 105 and name HG2* )) assign ((resid  62 and name HD1* ))   ( (resid 109 and name HD1* )) assign ((resid  62 and name HD1* ))   ( (resid 109 and name HG11 )) assign ((resid  62 and name HD1* ))   ( (resid 109 and name HG12 )) assign ((resid  62 and name HD1* ))   ( (resid 109 and name HG2* )) assign ((resid  62 and name HG1* ))   ( (resid  94 and name HB   )) assign ((resid  62 and name HG1* ))   ( (resid  96 and name HD2* )) assign ((resid  62 and name HG2* ))   ( (resid  62 and name HD1* )) assign ((resid  62 and name HG2* ))   ( (resid  64 and name HB*  )) assign ((resid  62 and name HG2* ))   ( (resid  94 and name HB   )) assign ((resid  62 and name HG2* ))   ( (resid  94 and name HG1* )) assign ((resid  62 and name HG2* ))   ( (resid  96 and name HD1* )) assign ((resid  62 and name HG2* ))   ( (resid  96 and name HD2* )) assign ((resid  62 and name HG2* ))   ( (resid 109 and name HD1* )) assign ((resid  62 and name HN   ))   ( (resid  62 and name HG1* )) assign ((resid  62 and name HN   ))   ( (resid  62 and name HG2* )) assign ((resid  62 and name HN   ))   ( (resid  94 and name HB   )) assign ((resid  62 and name HN   ))   ( (resid  96 and name HD2* )) assign ((resid  64 and name HA   ))   ( (resid  64 and name HD1* )) assign ((resid  64 and name HA   ))   ( (resid  64 and name HD2* )) assign ((resid  64 and name HA   ))   ( (resid  74 and name HD1* )) assign ((resid  64 and name HB*  ))   ( (resid  74 and name HD1* )) assign ((resid  64 and name HB1  ))   ( (resid  64 and name HD1* )) assign ((resid  64 and name HB1  ))   ( (resid 112 and name HB*  )) assign ((resid  64 and name HB2  ))   ( (resid  64 and name HD1* )) assign ((resid  64 and name HB2  ))   ( (resid 112 and name HB*  )) assign ((resid  64 and name HD1* ))   ( (resid  65 and name HN   )) assign ((resid  64 and name HD1* ))   ( (resid  66 and name HA   )) assign ((resid  64 and name HD1* ))   ( (resid  66 and name HB   )) assign ((resid  64 and name HD1* ))   ( (resid  66 and name HG1* )) assign ((resid  64 and name HD1* ))   ( (resid  66 and name HG2* )) assign ((resid  64 and name HD1* ))   ( (resid  92 and name HG2* )) assign ((resid  64 and name HD1* ))   ( (resid 109 and name HA   )) assign ((resid  64 and name HD1* ))   ( (resid 109 and name HN   )) assign ((resid  64 and name HD1* ))   ( (resid 112 and name HN   )) assign ((resid  64 and name HD2* ))   ( (resid  65 and name HN   )) assign ((resid  64 and name HD2* ))   ( (resid 109 and name HA   )) assign ((resid  64 and name HD2* ))   ( (resid 109 and name HD1* )) assign ((resid  64 and name HD2* ))   ( (resid 109 and name HG11 )) assign ((resid  64 and name HD2* ))   ( (resid 109 and name HG12 )) assign ((resid  64 and name HD2* ))   ( (resid 109 and name HG2* )) assign ((resid  64 and name HD2* ))   ( (resid 112 and name HA   )) assign ((resid  64 and name HD2* ))   ( (resid 112 and name HB1  )) assign ((resid  64 and name HD2* ))   ( (resid 112 and name HB2  )) assign ((resid  64 and name HD2* ))   ( (resid 112 and name HN   )) assign ((resid  65 and name HA   ))   ( (resid  66 and name HA   )) assign ((resid  65 and name HA   ))   ( (resid  66 and name HG1* )) assign ((resid  65 and name HA   ))   ( (resid  66 and name HG2* )) assign ((resid  65 and name HA   ))   ( (resid  66 and name HN   )) assign ((resid  65 and name HA   ))   ( (resid  91 and name HA   )) assign ((resid  65 and name HA   ))   ( (resid  92 and name HN   )) assign ((resid  65 and name HB*  ))   ( (resid  66 and name HG1* )) assign ((resid  65 and name HB*  ))   ( (resid 112 and name HA   )) assign ((resid  65 and name HB*  ))   ( (resid 115 and name HB*  )) assign ((resid  65 and name HB*  ))   ( (resid 115 and name HD*  )) assign ((resid  65 and name HB1  ))   ( (resid  66 and name HN   )) assign ((resid  65 and name HB2  ))   ( (resid  66 and name HN   )) assign ((resid  65 and name HD*  ))   ( (resid  66 and name HN   )) assign ((resid  65 and name HD*  ))   ( (resid 115 and name HB1  )) assign ((resid  65 and name HD*  ))   ( (resid 115 and name HB2  )) assign ((resid  65 and name HD*  ))   ( (resid 116 and name HG2* )) assign ((resid  65 and name HE*  ))   ( (resid 115 and name HB*  )) assign ((resid  65 and name HE*  ))   ( (resid 115 and name HD*  )) assign ((resid  65 and name HE*  ))   ( (resid 116 and name HB   )) assign ((resid  65 and name HE*  ))   ( (resid 116 and name HG2* )) assign ((resid  65 and name HE1  ))   ( (resid 115 and name HB*  )) assign ((resid  65 and name HE2  ))   ( (resid 115 and name HB*  )) assign ((resid  65 and name HG*  ))   ( (resid  65 and name HE*  )) assign ((resid  65 and name HG*  ))   ( (resid  66 and name HN   )) assign ((resid  65 and name HG*  ))   ( (resid 115 and name HD*  )) assign ((resid  65 and name HG1  ))   ( (resid  65 and name HE1  )) assign ((resid  65 and name HG1  ))   ( (resid  65 and name HE2  )) assign ((resid  65 and name HG2  ))   ( (resid  65 and name HE1  )) assign ((resid  65 and name HG2  ))   ( (resid  65 and name HE2  )) assign ((resid  65 and name HN   ))   ( (resid  74 and name HD1* )) assign ((resid  65 and name HN   ))   ( (resid 112 and name HB1  )) assign ((resid  65 and name HN   ))   ( (resid 112 and name HB2  )) assign ((resid  65 and name HN   ))   ( (resid 116 and name HG2* )) assign ((resid  66 and name HA   ))   ( (resid  66 and name HG1* )) assign ((resid  66 and name HA   ))   ( (resid  66 and name HG2* )) assign ((resid  66 and name HA   ))   ( (resid  67 and name HG*  )) assign ((resid  66 and name HA   ))   ( (resid  67 and name HN   )) assign ((resid  66 and name HA   ))   ( (resid  70 and name HD1* )) assign ((resid  66 and name HA   ))   ( (resid 115 and name HD1* )) assign ((resid  66 and name HA   ))   ( (resid 115 and name HD2* )) assign ((resid  66 and name HB   ))   ( (resid  67 and name HN   )) assign ((resid  66 and name HB   ))   ( (resid  70 and name HD1* )) assign ((resid  66 and name HB   ))   ( (resid  74 and name HD2* )) assign ((resid  66 and name HB   ))   ( (resid 115 and name HD*  )) assign ((resid  66 and name HG1* ))   ( (resid  67 and name HN   )) assign ((resid  66 and name HG1* ))   ( (resid  71 and name HA   )) assign ((resid  66 and name HG1* ))   ( (resid  74 and name HB*  )) assign ((resid  66 and name HG1* ))   ( (resid  74 and name HD1* )) assign ((resid  66 and name HG1* ))   ( (resid  92 and name HD1* )) assign ((resid  66 and name HG1* ))   ( (resid  92 and name HG1* )) assign ((resid  66 and name HG1* ))   ( (resid  92 and name HG2* )) assign ((resid  66 and name HG1* ))   ( (resid  92 and name HN   )) assign ((resid  66 and name HG2* ))   ( (resid  67 and name HN   )) assign ((resid  66 and name HG2* ))   ( (resid  68 and name HA   )) assign ((resid  66 and name HG2* ))   ( (resid  70 and name HB*  )) assign ((resid  66 and name HG2* ))   ( (resid  70 and name HD1* )) assign ((resid  66 and name HG2* ))   ( (resid  70 and name HN   )) assign ((resid  66 and name HG2* ))   ( (resid  71 and name HA   )) assign ((resid  66 and name HG2* ))   ( (resid  71 and name HB   )) assign ((resid  66 and name HG2* ))   ( (resid  71 and name HG1* )) assign ((resid  66 and name HG2* ))   ( (resid  71 and name HG2* )) assign ((resid  66 and name HG2* ))   ( (resid  71 and name HN   )) assign ((resid  66 and name HG2* ))   ( (resid  74 and name HD2* )) assign ((resid  66 and name HG2* ))   ( (resid  88 and name HG*  )) assign ((resid  66 and name HG2* ))   ( (resid  90 and name HA   )) assign ((resid  66 and name HG2* ))   ( (resid  91 and name HA   )) assign ((resid  66 and name HG2* ))   ( (resid  92 and name HD1* )) assign ((resid  66 and name HG2* ))   ( (resid  92 and name HG1* )) assign ((resid  66 and name HG2* ))   ( (resid  92 and name HG2* )) assign ((resid  66 and name HG2* ))   ( (resid  92 and name HN   )) assign ((resid  66 and name HN   ))   ( (resid  66 and name HG1* )) assign ((resid  66 and name HN   ))   ( (resid  66 and name HG2* )) assign ((resid  66 and name HN   ))   ( (resid  67 and name HN   )) assign ((resid  66 and name HN   ))   ( (resid  90 and name HN   )) assign ((resid  66 and name HN   ))   ( (resid  91 and name HA   )) assign ((resid  66 and name HN   ))   ( (resid  92 and name HG1* )) assign ((resid  67 and name HA   ))   ( (resid  67 and name HG*  )) assign ((resid  67 and name HA   ))   ( (resid  68 and name HD*  )) assign ((resid  67 and name HA   ))   ( (resid 115 and name HD*  )) assign ((resid  67 and name HB*  ))   ( (resid  67 and name HE2* )) assign ((resid  67 and name HB*  ))   ( (resid  69 and name HN   )) assign ((resid  67 and name HB*  ))   ( (resid  70 and name HA   )) assign ((resid  67 and name HB*  ))   ( (resid  70 and name HB*  )) assign ((resid  67 and name HB*  ))   ( (resid  70 and name HD1* )) assign ((resid  67 and name HB*  ))   ( (resid  70 and name HD2* )) assign ((resid  67 and name HB*  ))   ( (resid  70 and name HG   )) assign ((resid  67 and name HB*  ))   ( (resid  70 and name HN   )) assign ((resid  67 and name HB*  ))   ( (resid  71 and name HN   )) assign ((resid  67 and name HB*  ))   ( (resid 115 and name HD*  )) assign ((resid  67 and name HB1  ))   ( (resid  67 and name HE21 )) assign ((resid  67 and name HB1  ))   ( (resid  67 and name HE22 )) assign ((resid  67 and name HB2  ))   ( (resid  67 and name HE21 )) assign ((resid  67 and name HB2  ))   ( (resid  67 and name HE22 )) assign ((resid  67 and name HE2* ))   ( (resid  69 and name HG*  )) assign ((resid  67 and name HE2* ))   ( (resid  70 and name HG   )) assign ((resid  67 and name HE2* ))   ( (resid 115 and name HD*  )) assign ((resid  67 and name HE2* ))   ( (resid 115 and name HG   )) assign ((resid  67 and name HE21 ))   ( (resid  70 and name HD1* )) assign ((resid  67 and name HE21 ))   ( (resid 115 and name HD1* )) assign ((resid  67 and name HE21 ))   ( (resid 115 and name HD2* )) assign ((resid  67 and name HE22 ))   ( (resid  70 and name HD1* )) assign ((resid  67 and name HE22 ))   ( (resid 115 and name HD1* )) assign ((resid  67 and name HE22 ))   ( (resid 115 and name HD2* )) assign ((resid  67 and name HG*  ))   ( (resid  67 and name HE2* )) assign ((resid  67 and name HG*  ))   ( (resid  68 and name HD*  )) assign ((resid  67 and name HG*  ))   ( (resid  69 and name HN   )) assign ((resid  67 and name HG*  ))   ( (resid  70 and name HD1* )) assign ((resid  67 and name HG*  ))   ( (resid 115 and name HD*  )) assign ((resid  67 and name HG1  ))   ( (resid  70 and name HG   )) assign ((resid  67 and name HG1  ))   ( (resid  70 and name HN   )) assign ((resid  67 and name HG2  ))   ( (resid  70 and name HG   )) assign ((resid  67 and name HG2  ))   ( (resid  70 and name HN   )) assign ((resid  67 and name HN   ))   ( (resid  67 and name HB1  )) assign ((resid  67 and name HN   ))   ( (resid  67 and name HB2  )) assign ((resid  67 and name HN   ))   ( (resid  67 and name HE2* )) assign ((resid  67 and name HN   ))   ( (resid  67 and name HG*  )) assign ((resid  67 and name HN   ))   ( (resid  68 and name HD*  )) assign ((resid  67 and name HN   ))   ( (resid  70 and name HB*  )) assign ((resid  67 and name HN   ))   ( (resid  70 and name HD1* )) assign ((resid  67 and name HN   ))   ( (resid 115 and name HD*  )) assign ((resid  67 and name HN   ))   ( (resid 115 and name HD1* )) assign ((resid  67 and name HN   ))   ( (resid 115 and name HD2* )) assign ((resid  68 and name HA   ))   ( (resid  71 and name HG1* )) assign ((resid  68 and name HA   ))   ( (resid  71 and name HG2* )) assign ((resid  68 and name HA   ))   ( (resid  71 and name HN   )) assign ((resid  68 and name HB*  ))   ( (resid  69 and name HN   )) assign ((resid  68 and name HB*  ))   ( (resid  71 and name HG1* )) assign ((resid  68 and name HD*  ))   ( (resid  69 and name HN   )) assign ((resid  68 and name HG*  ))   ( (resid  69 and name HN   )) assign ((resid  69 and name HA   ))   ( (resid  69 and name HG1  )) assign ((resid  69 and name HA   ))   ( (resid  69 and name HG2  )) assign ((resid  69 and name HA   ))   ( (resid  72 and name HN   )) assign ((resid  69 and name HB*  ))   ( (resid  70 and name HA   )) assign ((resid  69 and name HG*  ))   ( (resid  70 and name HA   )) assign ((resid  69 and name HG*  ))   ( (resid  70 and name HD2* )) assign ((resid  69 and name HG*  ))   ( (resid  70 and name HN   )) assign ((resid  69 and name HN   ))   ( (resid  69 and name HG*  )) assign ((resid  69 and name HN   ))   ( (resid  70 and name HD1* )) assign ((resid  69 and name HN   ))   ( (resid  70 and name HN   )) assign ((resid  69 and name HN   ))   ( (resid  71 and name HG1* )) assign ((resid  69 and name HN   ))   ( (resid  71 and name HN   )) assign ((resid  70 and name HA   ))   ( (resid  70 and name HD1* )) assign ((resid  70 and name HA   ))   ( (resid  70 and name HD2* )) assign ((resid  70 and name HA   ))   ( (resid  73 and name HB*  )) assign ((resid  70 and name HA   ))   ( (resid  73 and name HN   )) assign ((resid  70 and name HA   ))   ( (resid  74 and name HN   )) assign ((resid  70 and name HB*  ))   ( (resid  70 and name HD1* )) assign ((resid  70 and name HB*  ))   ( (resid  70 and name HD2* )) assign ((resid  70 and name HB*  ))   ( (resid  71 and name HN   )) assign ((resid  70 and name HD1* ))   ( (resid  71 and name HN   )) assign ((resid  70 and name HD2* ))   ( (resid  73 and name HB*  )) assign ((resid  70 and name HG   ))   ( (resid  71 and name HN   )) assign ((resid  70 and name HN   ))   ( (resid  70 and name HB*  )) assign ((resid  70 and name HN   ))   ( (resid  70 and name HD1* )) assign ((resid  70 and name HN   ))   ( (resid  70 and name HD2* )) assign ((resid  70 and name HN   ))   ( (resid  70 and name HG   )) assign ((resid  70 and name HN   ))   ( (resid  71 and name HB   )) assign ((resid  70 and name HN   ))   ( (resid  71 and name HG1* )) assign ((resid  70 and name HN   ))   ( (resid  71 and name HN   )) assign ((resid  70 and name HN   ))   ( (resid  72 and name HN   )) assign ((resid  71 and name HA   ))   ( (resid  71 and name HG1* )) assign ((resid  71 and name HA   ))   ( (resid  71 and name HG2* )) assign ((resid  71 and name HA   ))   ( (resid  73 and name HN   )) assign ((resid  71 and name HA   ))   ( (resid  74 and name HD1* )) assign ((resid  71 and name HA   ))   ( (resid  74 and name HD2* )) assign ((resid  71 and name HA   ))   ( (resid  74 and name HN   )) assign ((resid  71 and name HA   ))   ( (resid  75 and name HN   )) assign ((resid  71 and name HA   ))   ( (resid  92 and name HG2* )) assign ((resid  71 and name HB   ))   ( (resid  72 and name HN   )) assign ((resid  71 and name HB   ))   ( (resid  92 and name HG2* )) assign ((resid  71 and name HG1* ))   ( (resid  72 and name HN   )) assign ((resid  71 and name HG1* ))   ( (resid  89 and name HA   )) assign ((resid  71 and name HG2* ))   ( (resid  72 and name HA*  )) assign ((resid  71 and name HG2* ))   ( (resid  72 and name HN   )) assign ((resid  71 and name HG2* ))   ( (resid  73 and name HN   )) assign ((resid  71 and name HG2* ))   ( (resid  74 and name HN   )) assign ((resid  71 and name HG2* ))   ( (resid  75 and name HA   )) assign ((resid  71 and name HG2* ))   ( (resid  75 and name HB*  )) assign ((resid  71 and name HG2* ))   ( (resid  75 and name HD1  )) assign ((resid  71 and name HG2* ))   ( (resid  75 and name HD2  )) assign ((resid  71 and name HG2* ))   ( (resid  75 and name HE   )) assign ((resid  71 and name HG2* ))   ( (resid  75 and name HG1  )) assign ((resid  71 and name HG2* ))   ( (resid  75 and name HG2  )) assign ((resid  71 and name HG2* ))   ( (resid  75 and name HN   )) assign ((resid  71 and name HG2* ))   ( (resid  82 and name HA   )) assign ((resid  71 and name HG2* ))   ( (resid  89 and name HA   )) assign ((resid  71 and name HG2* ))   ( (resid  89 and name HG1  )) assign ((resid  71 and name HG2* ))   ( (resid  89 and name HG2  )) assign ((resid  71 and name HG2* ))   ( (resid  89 and name HN   )) assign ((resid  71 and name HG2* ))   ( (resid  92 and name HA   )) assign ((resid  71 and name HN   ))   ( (resid  71 and name HB   )) assign ((resid  71 and name HN   ))   ( (resid  71 and name HG1* )) assign ((resid  71 and name HN   ))   ( (resid  71 and name HG2* )) assign ((resid  71 and name HN   ))   ( (resid  72 and name HN   )) assign ((resid  71 and name HN   ))   ( (resid  73 and name HN   )) assign ((resid  72 and name HA*  ))   ( (resid  75 and name HB*  )) assign ((resid  72 and name HA*  ))   ( (resid  75 and name HD1  )) assign ((resid  72 and name HA*  ))   ( (resid  75 and name HD2  )) assign ((resid  72 and name HA*  ))   ( (resid  75 and name HN   )) assign ((resid  72 and name HA*  ))   ( (resid  76 and name HN   )) assign ((resid  72 and name HN   ))   ( (resid  73 and name HN   )) assign ((resid  72 and name HN   ))   ( (resid  74 and name HN   )) assign ((resid  73 and name HA   ))   ( (resid  76 and name HB*  )) assign ((resid  73 and name HA   ))   ( (resid  76 and name HD*  )) assign ((resid  73 and name HA   ))   ( (resid  76 and name HE*  )) assign ((resid  73 and name HA   ))   ( (resid  76 and name HG1  )) assign ((resid  73 and name HA   ))   ( (resid  76 and name HG2  )) assign ((resid  73 and name HA   ))   ( (resid  76 and name HN   )) assign ((resid  73 and name HA   ))   ( (resid  77 and name HG*  )) assign ((resid  73 and name HB*  ))   ( (resid  74 and name HN   )) assign ((resid  73 and name HB*  ))   ( (resid  76 and name HE*  )) assign ((resid  73 and name HN   ))   ( (resid  73 and name HB*  )) assign ((resid  73 and name HN   ))   ( (resid  74 and name HN   )) assign ((resid  74 and name HA   ))   ( (resid  74 and name HD1* )) assign ((resid  74 and name HA   ))   ( (resid  76 and name HE*  )) assign ((resid  74 and name HA   ))   ( (resid  76 and name HN   )) assign ((resid  74 and name HA   ))   ( (resid  77 and name HB*  )) assign ((resid  74 and name HA   ))   ( (resid  77 and name HG*  )) assign ((resid  74 and name HA   ))   ( (resid  77 and name HN   )) assign ((resid  74 and name HA   ))   ( (resid  80 and name HD1* )) assign ((resid  74 and name HA   ))   ( (resid  80 and name HG2* )) assign ((resid  74 and name HA   ))   ( (resid 108 and name HD2* )) assign ((resid  74 and name HB*  ))   ( (resid  74 and name HD2* )) assign ((resid  74 and name HB*  ))   ( (resid  80 and name HG2* )) assign ((resid  74 and name HB*  ))   ( (resid 108 and name HD1* )) assign ((resid  74 and name HB*  ))   ( (resid 108 and name HD2* )) assign ((resid  74 and name HB1  ))   ( (resid  74 and name HD1* )) assign ((resid  74 and name HB1  ))   ( (resid  75 and name HN   )) assign ((resid  74 and name HB2  ))   ( (resid  74 and name HD1* )) assign ((resid  74 and name HB2  ))   ( (resid  75 and name HN   )) assign ((resid  74 and name HD1* ))   ( (resid  75 and name HN   )) assign ((resid  74 and name HD1* ))   ( (resid  80 and name HG2* )) assign ((resid  74 and name HD1* ))   ( (resid 108 and name HA   )) assign ((resid  74 and name HD1* ))   ( (resid 108 and name HB*  )) assign ((resid  74 and name HD2* ))   ( (resid  75 and name HN   )) assign ((resid  74 and name HD2* ))   ( (resid  76 and name HN   )) assign ((resid  74 and name HN   ))   ( (resid  74 and name HB1  )) assign ((resid  74 and name HN   ))   ( (resid  74 and name HB2  )) assign ((resid  74 and name HN   ))   ( (resid  74 and name HD1* )) assign ((resid  74 and name HN   ))   ( (resid  74 and name HD2* )) assign ((resid  74 and name HN   ))   ( (resid  75 and name HN   )) assign ((resid  74 and name HN   ))   ( (resid  76 and name HN   )) assign ((resid  75 and name HA   ))   ( (resid  75 and name HD1  )) assign ((resid  75 and name HA   ))   ( (resid  75 and name HD2  )) assign ((resid  75 and name HA   ))   ( (resid  75 and name HE   )) assign ((resid  75 and name HA   ))   ( (resid  75 and name HG1  )) assign ((resid  75 and name HA   ))   ( (resid  75 and name HG2  )) assign ((resid  75 and name HA   ))   ( (resid  76 and name HA   )) assign ((resid  75 and name HA   ))   ( (resid  80 and name HB   )) assign ((resid  75 and name HA   ))   ( (resid  80 and name HD1* )) assign ((resid  75 and name HA   ))   ( (resid  80 and name HG2* )) assign ((resid  75 and name HA   ))   ( (resid  92 and name HG2* )) assign ((resid  75 and name HB*  ))   ( (resid  75 and name HD*  )) assign ((resid  75 and name HB*  ))   ( (resid  80 and name HG2* )) assign ((resid  75 and name HD*  ))   ( (resid  82 and name HA   )) assign ((resid  75 and name HD*  ))   ( (resid  82 and name HB*  )) assign ((resid  75 and name HD*  ))   ( (resid  82 and name HG*  )) assign ((resid  75 and name HD*  ))   ( (resid  88 and name HD*  )) assign ((resid  75 and name HD1  ))   ( (resid  92 and name HD1* )) assign ((resid  75 and name HD2  ))   ( (resid  92 and name HD1* )) assign ((resid  75 and name HE   ))   ( (resid  82 and name HA   )) assign ((resid  75 and name HE   ))   ( (resid  82 and name HD*  )) assign ((resid  75 and name HE   ))   ( (resid  82 and name HG*  )) assign ((resid  75 and name HE   ))   ( (resid  88 and name HD*  )) assign ((resid  75 and name HG*  ))   ( (resid  81 and name HA   )) assign ((resid  75 and name HG*  ))   ( (resid  82 and name HB*  )) assign ((resid  75 and name HG*  ))   ( (resid  82 and name HD*  )) assign ((resid  75 and name HG*  ))   ( (resid  93 and name HN   )) assign ((resid  75 and name HG1  ))   ( (resid  75 and name HE   )) assign ((resid  75 and name HG1  ))   ( (resid  80 and name HG2* )) assign ((resid  75 and name HG1  ))   ( (resid  82 and name HA   )) assign ((resid  75 and name HG1  ))   ( (resid  82 and name HD*  )) assign ((resid  75 and name HG1  ))   ( (resid  92 and name HG2* )) assign ((resid  75 and name HG2  ))   ( (resid  75 and name HE   )) assign ((resid  75 and name HG2  ))   ( (resid  80 and name HG2* )) assign ((resid  75 and name HG2  ))   ( (resid  82 and name HA   )) assign ((resid  75 and name HG2  ))   ( (resid  82 and name HD*  )) assign ((resid  75 and name HG2  ))   ( (resid  92 and name HG2* )) assign ((resid  75 and name HN   ))   ( (resid  75 and name HB*  )) assign ((resid  75 and name HN   ))   ( (resid  75 and name HD*  )) assign ((resid  75 and name HN   ))   ( (resid  75 and name HG1  )) assign ((resid  75 and name HN   ))   ( (resid  75 and name HG2  )) assign ((resid  75 and name HN   ))   ( (resid  76 and name HN   )) assign ((resid  75 and name HN   ))   ( (resid  77 and name HN   )) assign ((resid  75 and name HN   ))   ( (resid  92 and name HG2* )) assign ((resid  76 and name HA   ))   ( (resid  76 and name HD*  )) assign ((resid  76 and name HA   ))   ( (resid  76 and name HG*  )) assign ((resid  76 and name HA   ))   ( (resid  77 and name HN   )) assign ((resid  76 and name HB*  ))   ( (resid  76 and name HD1  )) assign ((resid  76 and name HB*  ))   ( (resid  76 and name HD2  )) assign ((resid  76 and name HB*  ))   ( (resid  76 and name HE*  )) assign ((resid  76 and name HB*  ))   ( (resid  76 and name HE1  )) assign ((resid  76 and name HB*  ))   ( (resid  76 and name HE2  )) assign ((resid  76 and name HD*  ))   ( (resid  77 and name HA   )) assign ((resid  76 and name HD*  ))   ( (resid  77 and name HN   )) assign ((resid  76 and name HE*  ))   ( (resid  77 and name HG*  )) assign ((resid  76 and name HE*  ))   ( (resid  77 and name HN   )) assign ((resid  76 and name HE1  ))   ( (resid  77 and name HN   )) assign ((resid  76 and name HE2  ))   ( (resid  77 and name HN   )) assign ((resid  76 and name HG*  ))   ( (resid  77 and name HN   )) assign ((resid  76 and name HG1  ))   ( (resid  76 and name HE*  )) assign ((resid  76 and name HG2  ))   ( (resid  76 and name HE*  )) assign ((resid  76 and name HN   ))   ( (resid  76 and name HB1  )) assign ((resid  76 and name HN   ))   ( (resid  76 and name HB2  )) assign ((resid  76 and name HN   ))   ( (resid  76 and name HD1  )) assign ((resid  76 and name HN   ))   ( (resid  76 and name HE*  )) assign ((resid  76 and name HN   ))   ( (resid  76 and name HE1  )) assign ((resid  76 and name HN   ))   ( (resid  76 and name HE2  )) assign ((resid  76 and name HN   ))   ( (resid  76 and name HG1  )) assign ((resid  76 and name HN   ))   ( (resid  76 and name HG2  )) assign ((resid  76 and name HN   ))   ( (resid  77 and name HN   )) assign ((resid  77 and name HA   ))   ( (resid  77 and name HD*  )) assign ((resid  77 and name HA   ))   ( (resid  77 and name HG1  )) assign ((resid  77 and name HA   ))   ( (resid  77 and name HG2  )) assign ((resid  77 and name HB*  ))   ( (resid  80 and name HD1* )) assign ((resid  77 and name HB*  ))   ( (resid 100 and name HD2* )) assign ((resid  77 and name HB1  ))   ( (resid  80 and name HN   )) assign ((resid  77 and name HB2  ))   ( (resid  80 and name HN   )) assign ((resid  77 and name HG*  ))   ( (resid  77 and name HE*  )) assign ((resid  77 and name HG*  ))   ( (resid 108 and name HD2* )) assign ((resid  77 and name HN   ))   ( (resid  77 and name HB*  )) assign ((resid  77 and name HN   ))   ( (resid  77 and name HG*  )) assign ((resid  77 and name HN   ))   ( (resid  80 and name HD1* )) assign ((resid  78 and name HA   ))   ( (resid  79 and name HA*  )) assign ((resid  78 and name HA   ))   ( (resid  79 and name HN   )) assign ((resid  78 and name HA   ))   ( (resid  80 and name HN   )) assign ((resid  78 and name HA   ))   ( (resid  99 and name HG1  )) assign ((resid  78 and name HA   ))   ( (resid  99 and name HG2  )) assign ((resid  78 and name HB*  ))   ( (resid  79 and name HN   )) assign ((resid  78 and name HB*  ))   ( (resid  80 and name HN   )) assign ((resid  79 and name HA*  ))   ( (resid  80 and name HA   )) assign ((resid  79 and name HA*  ))   ( (resid  81 and name HE*  )) assign ((resid  79 and name HA*  ))   ( (resid  99 and name HG*  )) assign ((resid  79 and name HA*  ))   ( (resid 100 and name HG   )) assign ((resid  79 and name HA1  ))   ( (resid 100 and name HD2* )) assign ((resid  79 and name HA2  ))   ( (resid 100 and name HD2* )) assign ((resid  79 and name HN   ))   ( (resid  80 and name HN   )) assign ((resid  79 and name HN   ))   ( (resid  81 and name HE*  )) assign ((resid  79 and name HN   ))   ( (resid  99 and name HG*  )) assign ((resid  79 and name HN   ))   ( (resid 100 and name HD2* )) assign ((resid  80 and name HA   ))   ( (resid  80 and name HD1* )) assign ((resid  80 and name HA   ))   ( (resid  80 and name HG2* )) assign ((resid  80 and name HA   ))   ( (resid  81 and name HD*  )) assign ((resid  80 and name HA   ))   ( (resid  81 and name HN   )) assign ((resid  80 and name HA   ))   ( (resid  92 and name HG2* )) assign ((resid  80 and name HA   ))   ( (resid  94 and name HG2* )) assign ((resid  80 and name HA   ))   ( (resid  95 and name HB*  )) assign ((resid  80 and name HA   ))   ( (resid  95 and name HN   )) assign ((resid  80 and name HA   ))   ( (resid 100 and name HD1* )) assign ((resid  80 and name HA   ))   ( (resid 100 and name HD2* )) assign ((resid  80 and name HB   ))   ( (resid  80 and name HD1* )) assign ((resid  80 and name HB   ))   ( (resid  81 and name HN   )) assign ((resid  80 and name HD1* ))   ( (resid 100 and name HB*  )) assign ((resid  80 and name HG1* ))   ( (resid 100 and name HD1* )) assign ((resid  80 and name HG1* ))   ( (resid 100 and name HD2* )) assign ((resid  80 and name HG2* ))   ( (resid  80 and name HD1* )) assign ((resid  80 and name HG2* ))   ( (resid  80 and name HG1* )) assign ((resid  80 and name HG2* ))   ( (resid  81 and name HN   )) assign ((resid  80 and name HG2* ))   ( (resid  82 and name HB*  )) assign ((resid  80 and name HG2* ))   ( (resid  82 and name HD*  )) assign ((resid  80 and name HN   ))   ( (resid  80 and name HB   )) assign ((resid  80 and name HN   ))   ( (resid  80 and name HD1* )) assign ((resid  80 and name HN   ))   ( (resid  80 and name HG1* )) assign ((resid  80 and name HN   ))   ( (resid  80 and name HG2* )) assign ((resid  80 and name HN   ))   ( (resid  81 and name HD*  )) assign ((resid  80 and name HN   ))   ( (resid  81 and name HN   )) assign ((resid  80 and name HN   ))   ( (resid 100 and name HD2* )) assign ((resid  81 and name HA   ))   ( (resid  81 and name HD*  )) assign ((resid  81 and name HA   ))   ( (resid  82 and name HD1  )) assign ((resid  81 and name HA   ))   ( (resid  82 and name HD2  )) assign ((resid  81 and name HA   ))   ( (resid  82 and name HG*  )) assign ((resid  81 and name HB*  ))   ( (resid  82 and name HD*  )) assign ((resid  81 and name HB*  ))   ( (resid  95 and name HD1* )) assign ((resid  81 and name HD*  ))   ( (resid  82 and name HD1  )) assign ((resid  81 and name HD*  ))   ( (resid  82 and name HD2  )) assign ((resid  81 and name HD*  ))   ( (resid  95 and name HD2* )) assign ((resid  81 and name HE*  ))   ( (resid  95 and name HB*  )) assign ((resid  81 and name HE*  ))   ( (resid  95 and name HD1* )) assign ((resid  81 and name HE*  ))   ( (resid  95 and name HD2* )) assign ((resid  81 and name HN   ))   ( (resid  81 and name HD*  )) assign ((resid  81 and name HN   ))   ( (resid  92 and name HG2* )) assign ((resid  81 and name HN   ))   ( (resid  93 and name HB   )) assign ((resid  81 and name HN   ))   ( (resid  93 and name HN   )) assign ((resid  82 and name HA   ))   ( (resid  88 and name HE*  )) assign ((resid  82 and name HA   ))   ( (resid  92 and name HG2* )) assign ((resid  82 and name HB*  ))   ( (resid  88 and name HE1  )) assign ((resid  82 and name HB*  ))   ( (resid  88 and name HE2  )) assign ((resid  82 and name HB*  ))   ( (resid  92 and name HG2* )) assign ((resid  82 and name HB1  ))   ( (resid  88 and name HE*  )) assign ((resid  82 and name HB2  ))   ( (resid  88 and name HE*  )) assign ((resid  82 and name HG*  ))   ( (resid  88 and name HE*  )) assign ((resid  84 and name HA   ))   ( (resid  84 and name HD*  )) assign ((resid  87 and name HA   ))   ( (resid  88 and name HN   )) assign ((resid  87 and name HB*  ))   ( (resid  89 and name HN   )) assign ((resid  87 and name HB*  ))   ( (resid  91 and name HD1  )) assign ((resid  87 and name HB*  ))   ( (resid  91 and name HE1  )) assign ((resid  88 and name HA   ))   ( (resid  91 and name HN   )) assign ((resid  88 and name HB*  ))   ( (resid  88 and name HE*  )) assign ((resid  88 and name HG*  ))   ( (resid  89 and name HN   )) assign ((resid  88 and name HG*  ))   ( (resid  92 and name HA   )) assign ((resid  88 and name HG*  ))   ( (resid  92 and name HD1* )) assign ((resid  88 and name HG*  ))   ( (resid  92 and name HG2* )) assign ((resid  88 and name HG*  ))   ( (resid  93 and name HN   )) assign ((resid  88 and name HN   ))   ( (resid  88 and name HG*  )) assign ((resid  89 and name HA   ))   ( (resid  89 and name HG*  )) assign ((resid  89 and name HB*  ))   ( (resid  90 and name HD*  )) assign ((resid  89 and name HB1  ))   ( (resid  90 and name HN   )) assign ((resid  89 and name HB2  ))   ( (resid  90 and name HN   )) assign ((resid  89 and name HG1  ))   ( (resid  90 and name HD*  )) assign ((resid  89 and name HG1  ))   ( (resid  90 and name HN   )) assign ((resid  89 and name HG2  ))   ( (resid  90 and name HD*  )) assign ((resid  89 and name HG2  ))   ( (resid  90 and name HN   )) assign ((resid  89 and name HN   ))   ( (resid  89 and name HB*  )) assign ((resid  89 and name HN   ))   ( (resid  89 and name HG*  )) assign ((resid  89 and name HN   ))   ( (resid  90 and name HD*  )) assign ((resid  89 and name HN   ))   ( (resid  90 and name HN   )) assign ((resid  90 and name HB*  ))   ( (resid  91 and name HD1  )) assign ((resid  90 and name HB*  ))   ( (resid  91 and name HE1  )) assign ((resid  90 and name HB*  ))   ( (resid  91 and name HN   )) assign ((resid  90 and name HB1  ))   ( (resid  91 and name HZ2  )) assign ((resid  90 and name HB2  ))   ( (resid  91 and name HZ2  )) assign ((resid  91 and name HA   ))   ( (resid  92 and name HD1* )) assign ((resid  91 and name HA   ))   ( (resid  92 and name HN   )) assign ((resid  91 and name HN   ))   ( (resid  91 and name HB*  )) assign ((resid  91 and name HN   ))   ( (resid  92 and name HD1* )) assign ((resid  92 and name HA   ))   ( (resid  92 and name HD1* )) assign ((resid  92 and name HA   ))   ( (resid  92 and name HG2* )) assign ((resid  92 and name HA   ))   ( (resid  93 and name HN   )) assign ((resid  92 and name HB   ))   ( (resid  92 and name HD1* )) assign ((resid  92 and name HB   ))   ( (resid  93 and name HN   )) assign ((resid  92 and name HD1* ))   ( (resid  93 and name HN   )) assign ((resid  92 and name HG2* ))   ( (resid  92 and name HD1* )) assign ((resid  92 and name HG2* ))   ( (resid  92 and name HG1* )) assign ((resid  92 and name HG2* ))   ( (resid  93 and name HG*  )) assign ((resid  92 and name HG2* ))   ( (resid  93 and name HN   )) assign ((resid  92 and name HN   ))   ( (resid  92 and name HD1* )) assign ((resid  92 and name HN   ))   ( (resid  93 and name HN   )) assign ((resid  93 and name HA   ))   ( (resid  93 and name HG2* )) assign ((resid  93 and name HN   ))   ( (resid  93 and name HG*  )) assign ((resid  93 and name HN   ))   ( (resid  93 and name HG2* )) assign ((resid  94 and name HA   ))   ( (resid  94 and name HG1* )) assign ((resid  94 and name HA   ))   ( (resid  95 and name HB*  )) assign ((resid  94 and name HA   ))   ( (resid  95 and name HN   )) assign ((resid  94 and name HG1* ))   ( (resid  95 and name HA   )) assign ((resid  94 and name HG1* ))   ( (resid  95 and name HN   )) assign ((resid  94 and name HG1* ))   ( (resid  96 and name HA   )) assign ((resid  94 and name HG1* ))   ( (resid 105 and name HA   )) assign ((resid  94 and name HG1* ))   ( (resid 105 and name HG1* )) assign ((resid  95 and name HA   ))   ( (resid  95 and name HD1* )) assign ((resid  95 and name HA   ))   ( (resid  95 and name HD2* )) assign ((resid  95 and name HA   ))   ( (resid  96 and name HN   )) assign ((resid  95 and name HB*  ))   ( (resid  98 and name HA*  )) assign ((resid  95 and name HB*  ))   ( (resid  99 and name HD*  )) assign ((resid  95 and name HB1  ))   ( (resid  95 and name HD1* )) assign ((resid  95 and name HB1  ))   ( (resid  95 and name HD2* )) assign ((resid  95 and name HB2  ))   ( (resid  95 and name HD1* )) assign ((resid  95 and name HB2  ))   ( (resid  95 and name HD2* )) assign ((resid  95 and name HD1* ))   ( (resid  96 and name HN   )) assign ((resid  95 and name HD1* ))   ( (resid  97 and name HN   )) assign ((resid  95 and name HD2* ))   ( (resid  96 and name HN   )) assign ((resid  95 and name HD2* ))   ( (resid  98 and name HA*  )) assign ((resid  95 and name HD2* ))   ( (resid  98 and name HN   )) assign ((resid  95 and name HD2* ))   ( (resid  99 and name HD1  )) assign ((resid  95 and name HD2* ))   ( (resid  99 and name HD2  )) assign ((resid  95 and name HG   ))   ( (resid  97 and name HB1  )) assign ((resid  95 and name HG   ))   ( (resid  97 and name HB2  )) assign ((resid  95 and name HG   ))   ( (resid  97 and name HN   )) assign ((resid  95 and name HG   ))   ( (resid  98 and name HA*  )) assign ((resid  95 and name HG   ))   ( (resid  98 and name HN   )) assign ((resid  95 and name HN   ))   ( (resid  95 and name HB*  )) assign ((resid  95 and name HN   ))   ( (resid  95 and name HD1* )) assign ((resid  95 and name HN   ))   ( (resid  95 and name HD2* )) assign ((resid  95 and name HN   ))   ( (resid  95 and name HG   )) assign ((resid  96 and name HA   ))   ( (resid  96 and name HD1* )) assign ((resid  96 and name HA   ))   ( (resid  96 and name HD2* )) assign ((resid  96 and name HA   ))   ( (resid 105 and name HD1* )) assign ((resid  96 and name HB*  ))   ( (resid  96 and name HD1* )) assign ((resid  96 and name HB*  ))   ( (resid  97 and name HN   )) assign ((resid  96 and name HB*  ))   ( (resid 105 and name HD1* )) assign ((resid  96 and name HD2* ))   ( (resid  97 and name HN   )) assign ((resid  96 and name HD2* ))   ( (resid 105 and name HG2* )) assign ((resid  96 and name HD2* ))   ( (resid 109 and name HD1* )) assign ((resid  96 and name HG   ))   ( (resid 105 and name HD1* )) assign ((resid  96 and name HN   ))   ( (resid  96 and name HD2* )) assign ((resid  96 and name HN   ))   ( (resid  96 and name HG   )) assign ((resid  96 and name HN   ))   ( (resid  97 and name HN   )) assign ((resid  97 and name HA   ))   ( (resid  97 and name HD2* )) assign ((resid  97 and name HA   ))   ( (resid  98 and name HN   )) assign ((resid  97 and name HB*  ))   ( (resid  97 and name HD2* )) assign ((resid  97 and name HN   ))   ( (resid  97 and name HB*  )) assign ((resid  97 and name HN   ))   ( (resid  98 and name HN   )) assign ((resid  98 and name HA*  ))   ( (resid  99 and name HG*  )) assign ((resid  99 and name HB*  ))   ( (resid 100 and name HD2* )) assign ((resid  99 and name HB*  ))   ( (resid 100 and name HN   )) assign ((resid  99 and name HD*  ))   ( (resid 100 and name HG   )) assign ((resid  99 and name HD*  ))   ( (resid 100 and name HN   )) assign ((resid 100 and name HA   ))   ( (resid 100 and name HD1* )) assign ((resid 100 and name HA   ))   ( (resid 100 and name HD2* )) assign ((resid 100 and name HA   ))   ( (resid 101 and name HA*  )) assign ((resid 100 and name HA   ))   ( (resid 101 and name HN   )) assign ((resid 100 and name HA   ))   ( (resid 104 and name HB*  )) assign ((resid 100 and name HB*  ))   ( (resid 101 and name HA1  )) assign ((resid 100 and name HB*  ))   ( (resid 101 and name HA2  )) assign ((resid 100 and name HB*  ))   ( (resid 104 and name HB*  )) assign ((resid 100 and name HB*  ))   ( (resid 105 and name HG1* )) assign ((resid 100 and name HB1  ))   ( (resid 100 and name HD1* )) assign ((resid 100 and name HB1  ))   ( (resid 101 and name HN   )) assign ((resid 100 and name HB2  ))   ( (resid 100 and name HD1* )) assign ((resid 100 and name HB2  ))   ( (resid 101 and name HN   )) assign ((resid 100 and name HD1* ))   ( (resid 101 and name HA*  )) assign ((resid 100 and name HD1* ))   ( (resid 101 and name HN   )) assign ((resid 100 and name HD1* ))   ( (resid 104 and name HA   )) assign ((resid 100 and name HD1* ))   ( (resid 104 and name HB1  )) assign ((resid 100 and name HD1* ))   ( (resid 104 and name HB2  )) assign ((resid 100 and name HD1* ))   ( (resid 104 and name HG*  )) assign ((resid 100 and name HD1* ))   ( (resid 105 and name HA   )) assign ((resid 100 and name HD1* ))   ( (resid 105 and name HG1* )) assign ((resid 100 and name HD1* ))   ( (resid 105 and name HN   )) assign ((resid 100 and name HD2* ))   ( (resid 101 and name HN   )) assign ((resid 100 and name HD2* ))   ( (resid 104 and name HB*  )) assign ((resid 100 and name HD2* ))   ( (resid 105 and name HG1* )) assign ((resid 100 and name HN   ))   ( (resid 100 and name HB1  )) assign ((resid 100 and name HN   ))   ( (resid 100 and name HB2  )) assign ((resid 100 and name HN   ))   ( (resid 100 and name HD1* )) assign ((resid 100 and name HN   ))   ( (resid 100 and name HD2* )) assign ((resid 100 and name HN   ))   ( (resid 100 and name HG   )) assign ((resid 100 and name HN   ))   ( (resid 101 and name HN   )) assign ((resid 101 and name HA*  ))   ( (resid 102 and name HA   )) assign ((resid 101 and name HA*  ))   ( (resid 103 and name HB*  )) assign ((resid 101 and name HA*  ))   ( (resid 103 and name HN   )) assign ((resid 101 and name HA1  ))   ( (resid 102 and name HB*  )) assign ((resid 101 and name HA1  ))   ( (resid 102 and name HN   )) assign ((resid 101 and name HA1  ))   ( (resid 104 and name HN   )) assign ((resid 101 and name HA2  ))   ( (resid 102 and name HB*  )) assign ((resid 101 and name HA2  ))   ( (resid 102 and name HN   )) assign ((resid 101 and name HA2  ))   ( (resid 104 and name HN   )) assign ((resid 101 and name HN   ))   ( (resid 102 and name HN   )) assign ((resid 101 and name HN   ))   ( (resid 104 and name HB1  )) assign ((resid 101 and name HN   ))   ( (resid 104 and name HB2  )) assign ((resid 101 and name HN   ))   ( (resid 104 and name HN   )) assign ((resid 102 and name HA   ))   ( (resid 105 and name HB   )) assign ((resid 102 and name HA   ))   ( (resid 105 and name HD1* )) assign ((resid 102 and name HA   ))   ( (resid 105 and name HG2* )) assign ((resid 102 and name HA   ))   ( (resid 105 and name HN   )) assign ((resid 102 and name HA   ))   ( (resid 106 and name HN   )) assign ((resid 102 and name HB*  ))   ( (resid 103 and name HA   )) assign ((resid 102 and name HB*  ))   ( (resid 103 and name HB*  )) assign ((resid 102 and name HB*  ))   ( (resid 103 and name HG*  )) assign ((resid 102 and name HB*  ))   ( (resid 103 and name HN   )) assign ((resid 102 and name HB*  ))   ( (resid 104 and name HN   )) assign ((resid 102 and name HB*  ))   ( (resid 105 and name HB   )) assign ((resid 102 and name HB*  ))   ( (resid 105 and name HD1* )) assign ((resid 102 and name HB*  ))   ( (resid 105 and name HN   )) assign ((resid 102 and name HN   ))   ( (resid 102 and name HB*  )) assign ((resid 102 and name HN   ))   ( (resid 103 and name HB*  )) assign ((resid 102 and name HN   ))   ( (resid 104 and name HN   )) assign ((resid 102 and name HN   ))   ( (resid 105 and name HD1* )) assign ((resid 103 and name HA   ))   ( (resid 103 and name HD*  )) assign ((resid 103 and name HA   ))   ( (resid 103 and name HG*  )) assign ((resid 103 and name HA   ))   ( (resid 106 and name HB*  )) assign ((resid 103 and name HA   ))   ( (resid 106 and name HN   )) assign ((resid 103 and name HA   ))   ( (resid 107 and name HN   )) assign ((resid 103 and name HB*  ))   ( (resid 103 and name HD*  )) assign ((resid 103 and name HB*  ))   ( (resid 103 and name HE*  )) assign ((resid 103 and name HB*  ))   ( (resid 104 and name HN   )) assign ((resid 103 and name HG*  ))   ( (resid 104 and name HN   )) assign ((resid 103 and name HN   ))   ( (resid 103 and name HB*  )) assign ((resid 103 and name HN   ))   ( (resid 103 and name HG*  )) assign ((resid 103 and name HN   ))   ( (resid 104 and name HN   )) assign ((resid 104 and name HA   ))   ( (resid 104 and name HG*  )) assign ((resid 104 and name HA   ))   ( (resid 107 and name HN   )) assign ((resid 104 and name HA   ))   ( (resid 108 and name HN   )) assign ((resid 104 and name HB*  ))   ( (resid 105 and name HA   )) assign ((resid 104 and name HB1  ))   ( (resid 105 and name HN   )) assign ((resid 104 and name HB2  ))   ( (resid 105 and name HN   )) assign ((resid 104 and name HN   ))   ( (resid 104 and name HB*  )) assign ((resid 104 and name HN   ))   ( (resid 104 and name HG1  )) assign ((resid 104 and name HN   ))   ( (resid 104 and name HG2  )) assign ((resid 104 and name HN   ))   ( (resid 105 and name HN   )) assign ((resid 104 and name HN   ))   ( (resid 106 and name HN   )) assign ((resid 105 and name HA   ))   ( (resid 105 and name HD1* )) assign ((resid 105 and name HA   ))   ( (resid 105 and name HG1* )) assign ((resid 105 and name HA   ))   ( (resid 105 and name HG2* )) assign ((resid 105 and name HA   ))   ( (resid 108 and name HB*  )) assign ((resid 105 and name HA   ))   ( (resid 108 and name HD1* )) assign ((resid 105 and name HA   ))   ( (resid 108 and name HD2* )) assign ((resid 105 and name HA   ))   ( (resid 108 and name HG   )) assign ((resid 105 and name HA   ))   ( (resid 108 and name HN   )) assign ((resid 105 and name HA   ))   ( (resid 109 and name HD1* )) assign ((resid 105 and name HA   ))   ( (resid 109 and name HG11 )) assign ((resid 105 and name HA   ))   ( (resid 109 and name HG12 )) assign ((resid 105 and name HA   ))   ( (resid 109 and name HN   )) assign ((resid 105 and name HB   ))   ( (resid 106 and name HN   )) assign ((resid 105 and name HB   ))   ( (resid 107 and name HN   )) assign ((resid 105 and name HB   ))   ( (resid 109 and name HG1* )) assign ((resid 105 and name HG1* ))   ( (resid 109 and name HD1* )) assign ((resid 105 and name HG2* ))   ( (resid 105 and name HD1* )) assign ((resid 105 and name HG2* ))   ( (resid 105 and name HG11 )) assign ((resid 105 and name HG2* ))   ( (resid 105 and name HG12 )) assign ((resid 105 and name HG2* ))   ( (resid 106 and name HA   )) assign ((resid 105 and name HG2* ))   ( (resid 106 and name HD2  )) assign ((resid 105 and name HG2* ))   ( (resid 106 and name HN   )) assign ((resid 105 and name HG2* ))   ( (resid 107 and name HN   )) assign ((resid 105 and name HG2* ))   ( (resid 109 and name HD1* )) assign ((resid 105 and name HG2* ))   ( (resid 109 and name HG11 )) assign ((resid 105 and name HG2* ))   ( (resid 109 and name HG12 )) assign ((resid 105 and name HG2* ))   ( (resid 109 and name HG2* )) assign ((resid 105 and name HG2* ))   ( (resid 109 and name HN   )) assign ((resid 105 and name HN   ))   ( (resid 105 and name HB   )) assign ((resid 105 and name HN   ))   ( (resid 105 and name HD1* )) assign ((resid 105 and name HN   ))   ( (resid 105 and name HG1* )) assign ((resid 105 and name HN   ))   ( (resid 105 and name HG2* )) assign ((resid 105 and name HN   ))   ( (resid 106 and name HN   )) assign ((resid 106 and name HA   ))   ( (resid 106 and name HD2  )) assign ((resid 106 and name HA   ))   ( (resid 109 and name HB   )) assign ((resid 106 and name HA   ))   ( (resid 109 and name HD1* )) assign ((resid 106 and name HA   ))   ( (resid 109 and name HG2* )) assign ((resid 106 and name HA   ))   ( (resid 109 and name HN   )) assign ((resid 106 and name HA   ))   ( (resid 110 and name HN   )) assign ((resid 106 and name HB*  ))   ( (resid 107 and name HN   )) assign ((resid 106 and name HD2  ))   ( (resid 109 and name HD1* )) assign ((resid 106 and name HN   ))   ( (resid 106 and name HB*  )) assign ((resid 106 and name HN   ))   ( (resid 106 and name HD2  )) assign ((resid 106 and name HN   ))   ( (resid 107 and name HN   )) assign ((resid 106 and name HN   ))   ( (resid 108 and name HG   )) assign ((resid 106 and name HN   ))   ( (resid 108 and name HN   )) assign ((resid 106 and name HN   ))   ( (resid 109 and name HD1* )) assign ((resid 107 and name HA   ))   ( (resid 110 and name HB1  )) assign ((resid 107 and name HA   ))   ( (resid 110 and name HB2  )) assign ((resid 107 and name HA   ))   ( (resid 110 and name HN   )) assign ((resid 107 and name HA   ))   ( (resid 111 and name HN   )) assign ((resid 107 and name HB*  ))   ( (resid 108 and name HD2* )) assign ((resid 107 and name HB*  ))   ( (resid 108 and name HG   )) assign ((resid 107 and name HB*  ))   ( (resid 108 and name HN   )) assign ((resid 107 and name HB*  ))   ( (resid 110 and name HB*  )) assign ((resid 107 and name HN   ))   ( (resid 107 and name HB*  )) assign ((resid 107 and name HN   ))   ( (resid 108 and name HD2* )) assign ((resid 107 and name HN   ))   ( (resid 108 and name HG   )) assign ((resid 107 and name HN   ))   ( (resid 109 and name HN   )) assign ((resid 107 and name HN   ))   ( (resid 110 and name HB1  )) assign ((resid 107 and name HN   ))   ( (resid 110 and name HB2  )) assign ((resid 108 and name HA   ))   ( (resid 108 and name HD1* )) assign ((resid 108 and name HA   ))   ( (resid 108 and name HD2* )) assign ((resid 108 and name HA   ))   ( (resid 111 and name HB*  )) assign ((resid 108 and name HA   ))   ( (resid 111 and name HN   )) assign ((resid 108 and name HB*  ))   ( (resid 108 and name HD1* )) assign ((resid 108 and name HB*  ))   ( (resid 108 and name HD2* )) assign ((resid 108 and name HB*  ))   ( (resid 109 and name HG1* )) assign ((resid 108 and name HD2* ))   ( (resid 109 and name HN   )) assign ((resid 108 and name HG   ))   ( (resid 109 and name HG1* )) assign ((resid 108 and name HG   ))   ( (resid 109 and name HN   )) assign ((resid 108 and name HN   ))   ( (resid 108 and name HD1* )) assign ((resid 108 and name HN   ))   ( (resid 108 and name HD2* )) assign ((resid 108 and name HN   ))   ( (resid 108 and name HG   )) assign ((resid 108 and name HN   ))   ( (resid 109 and name HD1* )) assign ((resid 108 and name HN   ))   ( (resid 109 and name HG1* )) assign ((resid 108 and name HN   ))   ( (resid 109 and name HN   )) assign ((resid 108 and name HN   ))   ( (resid 110 and name HN   )) assign ((resid 109 and name HA   ))   ( (resid 109 and name HD1* )) assign ((resid 109 and name HA   ))   ( (resid 112 and name HB1  )) assign ((resid 109 and name HA   ))   ( (resid 112 and name HB2  )) assign ((resid 109 and name HA   ))   ( (resid 112 and name HN   )) assign ((resid 109 and name HB   ))   ( (resid 109 and name HD1* )) assign ((resid 109 and name HB   ))   ( (resid 110 and name HN   )) assign ((resid 109 and name HD1* ))   ( (resid 110 and name HN   )) assign ((resid 109 and name HG1* ))   ( (resid 110 and name HN   )) assign ((resid 109 and name HG2* ))   ( (resid 109 and name HD1* )) assign ((resid 109 and name HG2* ))   ( (resid 109 and name HG11 )) assign ((resid 109 and name HG2* ))   ( (resid 109 and name HG12 )) assign ((resid 109 and name HG2* ))   ( (resid 110 and name HA   )) assign ((resid 109 and name HG2* ))   ( (resid 110 and name HN   )) assign ((resid 109 and name HG2* ))   ( (resid 112 and name HA   )) assign ((resid 109 and name HG2* ))   ( (resid 112 and name HB*  )) assign ((resid 109 and name HG2* ))   ( (resid 113 and name HN   )) assign ((resid 109 and name HN   ))   ( (resid 109 and name HB   )) assign ((resid 109 and name HN   ))   ( (resid 109 and name HD1* )) assign ((resid 109 and name HN   ))   ( (resid 109 and name HG11 )) assign ((resid 109 and name HN   ))   ( (resid 109 and name HG12 )) assign ((resid 109 and name HN   ))   ( (resid 109 and name HG2* )) assign ((resid 109 and name HN   ))   ( (resid 110 and name HN   )) assign ((resid 109 and name HN   ))   ( (resid 111 and name HN   )) assign ((resid 110 and name HA   ))   ( (resid 113 and name HB1  )) assign ((resid 110 and name HA   ))   ( (resid 113 and name HB2  )) assign ((resid 110 and name HA   ))   ( (resid 113 and name HN   )) assign ((resid 110 and name HB*  ))   ( (resid 111 and name HA   )) assign ((resid 110 and name HB*  ))   ( (resid 111 and name HN   )) assign ((resid 110 and name HB1  ))   ( (resid 113 and name HB*  )) assign ((resid 110 and name HB2  ))   ( (resid 113 and name HB*  )) assign ((resid 110 and name HG*  ))   ( (resid 111 and name HN   )) assign ((resid 110 and name HG*  ))   ( (resid 114 and name HE2* )) assign ((resid 110 and name HN   ))   ( (resid 110 and name HB1  )) assign ((resid 110 and name HN   ))   ( (resid 110 and name HB2  )) assign ((resid 110 and name HN   ))   ( (resid 110 and name HG*  )) assign ((resid 110 and name HN   ))   ( (resid 111 and name HN   )) assign ((resid 111 and name HA   ))   ( (resid 114 and name HN   )) assign ((resid 111 and name HA   ))   ( (resid 115 and name HN   )) assign ((resid 111 and name HB*  ))   ( (resid 112 and name HA   )) assign ((resid 111 and name HB*  ))   ( (resid 112 and name HN   )) assign ((resid 111 and name HB*  ))   ( (resid 115 and name HD*  )) assign ((resid 111 and name HN   ))   ( (resid 111 and name HB*  )) assign ((resid 111 and name HN   ))   ( (resid 112 and name HN   )) assign ((resid 111 and name HN   ))   ( (resid 113 and name HN   )) assign ((resid 112 and name HA   ))   ( (resid 115 and name HB*  )) assign ((resid 112 and name HA   ))   ( (resid 115 and name HD*  )) assign ((resid 112 and name HA   ))   ( (resid 115 and name HN   )) assign ((resid 112 and name HA   ))   ( (resid 116 and name HG2* )) assign ((resid 112 and name HA   ))   ( (resid 116 and name HN   )) assign ((resid 112 and name HB1  ))   ( (resid 116 and name HG2* )) assign ((resid 112 and name HB2  ))   ( (resid 116 and name HG2* )) assign ((resid 112 and name HN   ))   ( (resid 112 and name HB1  )) assign ((resid 112 and name HN   ))   ( (resid 112 and name HB2  )) assign ((resid 112 and name HN   ))   ( (resid 113 and name HN   )) assign ((resid 112 and name HN   ))   ( (resid 115 and name HD*  )) assign ((resid 113 and name HA   ))   ( (resid 114 and name HG*  )) assign ((resid 113 and name HA   ))   ( (resid 116 and name HN   )) assign ((resid 113 and name HB*  ))   ( (resid 114 and name HA   )) assign ((resid 113 and name HB1  ))   ( (resid 114 and name HN   )) assign ((resid 113 and name HB2  ))   ( (resid 114 and name HN   )) assign ((resid 113 and name HN   ))   ( (resid 113 and name HB1  )) assign ((resid 113 and name HN   ))   ( (resid 113 and name HB2  )) assign ((resid 113 and name HN   ))   ( (resid 114 and name HN   )) assign ((resid 113 and name HN   ))   ( (resid 115 and name HN   )) assign ((resid 114 and name HA   ))   ( (resid 117 and name HB*  )) assign ((resid 114 and name HA   ))   ( (resid 117 and name HD*  )) assign ((resid 114 and name HA   ))   ( (resid 117 and name HE   )) assign ((resid 114 and name HA   ))   ( (resid 117 and name HG1  )) assign ((resid 114 and name HA   ))   ( (resid 117 and name HG2  )) assign ((resid 114 and name HA   ))   ( (resid 117 and name HN   )) assign ((resid 114 and name HB*  ))   ( (resid 114 and name HE2* )) assign ((resid 114 and name HB*  ))   ( (resid 115 and name HN   )) assign ((resid 114 and name HG*  ))   ( (resid 114 and name HE2* )) assign ((resid 114 and name HN   ))   ( (resid 114 and name HG*  )) assign ((resid 114 and name HN   ))   ( (resid 115 and name HN   )) assign ((resid 115 and name HA   ))   ( (resid 115 and name HD*  )) assign ((resid 115 and name HA   ))   ( (resid 115 and name HD1* )) assign ((resid 115 and name HA   ))   ( (resid 115 and name HD2* )) assign ((resid 115 and name HA   ))   ( (resid 116 and name HG2* )) assign ((resid 115 and name HB*  ))   ( (resid 116 and name HG2* )) assign ((resid 115 and name HB1  ))   ( (resid 115 and name HD1* )) assign ((resid 115 and name HB1  ))   ( (resid 115 and name HD2* )) assign ((resid 115 and name HB1  ))   ( (resid 116 and name HA   )) assign ((resid 115 and name HB1  ))   ( (resid 116 and name HN   )) assign ((resid 115 and name HB2  ))   ( (resid 115 and name HD1* )) assign ((resid 115 and name HB2  ))   ( (resid 115 and name HD2* )) assign ((resid 115 and name HB2  ))   ( (resid 116 and name HA   )) assign ((resid 115 and name HB2  ))   ( (resid 116 and name HN   )) assign ((resid 115 and name HN   ))   ( (resid 115 and name HB1  )) assign ((resid 115 and name HN   ))   ( (resid 115 and name HB2  )) assign ((resid 115 and name HN   ))   ( (resid 115 and name HD*  )) assign ((resid 115 and name HN   ))   ( (resid 115 and name HG   )) assign ((resid 115 and name HN   ))   ( (resid 116 and name HG2* )) assign ((resid 115 and name HN   ))   ( (resid 116 and name HN   )) assign ((resid 115 and name HN   ))   ( (resid 117 and name HN   )) assign ((resid 116 and name HA   ))   ( (resid 116 and name HG2* )) assign ((resid 116 and name HB   ))   ( (resid 117 and name HN   )) assign ((resid 116 and name HG*  ))   ( (resid 117 and name HN   )) assign ((resid 116 and name HG2* ))   ( (resid 117 and name HN   )) assign ((resid 116 and name HN   ))   ( (resid 116 and name HG*  )) assign ((resid 116 and name HN   ))   ( (resid 116 and name HG2* )) assign ((resid 116 and name HN   ))   ( (resid 117 and name HN   )) assign ((resid 117 and name HA   ))   ( (resid 117 and name HG1  )) assign ((resid 117 and name HA   ))   ( (resid 117 and name HG2  )) assign ((resid 117 and name HA   ))   ( (resid 118 and name HA   )) assign ((resid 117 and name HA   ))   ( (resid 118 and name HN   )) assign ((resid 117 and name HB*  ))   ( (resid 117 and name HD*  )) assign ((resid 117 and name HB*  ))   ( (resid 118 and name HN   )) assign ((resid 117 and name HB1  ))   ( (resid 117 and name HE   )) assign ((resid 117 and name HB2  ))   ( (resid 117 and name HE   )) assign ((resid 117 and name HG*  ))   ( (resid 118 and name HN   )) assign ((resid 117 and name HN   ))   ( (resid 117 and name HB*  )) assign ((resid 117 and name HN   ))   ( (resid 117 and name HG1  )) assign ((resid 117 and name HN   ))   ( (resid 117 and name HG2  )) assign ((resid 117 and name HN   ))   ( (resid 118 and name HN   )) assign ((resid 118 and name HA   ))   ( (resid 118 and name HD1* )) assign ((resid 118 and name HA   ))   ( (resid 118 and name HG   )) assign ((resid 118 and name HA   ))   ( (resid 119 and name HB*  )) assign ((resid 118 and name HA   ))   ( (resid 119 and name HN   )) assign ((resid 118 and name HB*  ))   ( (resid 118 and name HD1* )) assign ((resid 118 and name HB*  ))   ( (resid 118 and name HD2* )) assign ((resid 118 and name HB*  ))   ( (resid 119 and name HA   )) assign ((resid 118 and name HB*  ))   ( (resid 119 and name HN   )) assign ((resid 118 and name HB*  ))   ( (resid 120 and name HN   )) assign ((resid 118 and name HD2* ))   ( (resid 119 and name HG*  )) assign ((resid 118 and name HD2* ))   ( (resid 119 and name HN   )) assign ((resid 118 and name HN   ))   ( (resid 118 and name HB*  )) assign ((resid 118 and name HN   ))   ( (resid 118 and name HD1* )) assign ((resid 118 and name HN   ))   ( (resid 118 and name HD2* )) assign ((resid 118 and name HN   ))   ( (resid 118 and name HG   )) assign ((resid 119 and name HA   ))   ( (resid 119 and name HG1  )) assign ((resid 119 and name HA   ))   ( (resid 119 and name HG2  )) assign ((resid 119 and name HA   ))   ( (resid 120 and name HB*  )) assign ((resid 119 and name HA   ))   ( (resid 120 and name HN   )) assign ((resid 119 and name HB1  ))   ( (resid 120 and name HN   )) assign ((resid 119 and name HB2  ))   ( (resid 120 and name HN   )) assign ((resid 119 and name HG*  ))   ( (resid 120 and name HA   )) assign ((resid 119 and name HG1  ))   ( (resid 120 and name HN   )) assign ((resid 119 and name HG2  ))   ( (resid 120 and name HN   )) assign ((resid 119 and name HN   ))   ( (resid 119 and name HB*  )) assign ((resid 119 and name HN   ))   ( (resid 119 and name HG1  )) assign ((resid 119 and name HN   ))   ( (resid 119 and name HG2  )) assign ((resid 119 and name HN   ))   ( (resid 120 and name HB*  )) assign ((resid 120 and name HA   ))   ( (resid 121 and name HN   )) assign ((resid 120 and name HB*  ))   ( (resid 121 and name HN   )) assign ((resid 121 and name HA   ))   ( (resid 122 and name HN   )) assign ((resid 121 and name HB*  ))   ( (resid 122 and name HN   )) assign ((resid 122 and name HA   ))   ( (resid 123 and name HN   )) assign ((resid 122 and name HB*  ))   ( (resid 123 and name HN   )) assign ((resid 123 and name HA   ))   ( (resid 124 and name HN   ))

1.80 0.00 3.40 1.80 0.00 1.99 1.80 0.00 1.84 1.80 0.00 3.00 1.80 0.00 1.64 1.80 0.00 2.68 1.80 0.00 3.47 1.80 0.00 2.20 1.80 0.00 3.00 1.80 0.00 2.72 1.80 0.00 2.72 1.80 0.00 3.00 1.80 0.00 2.15 1.80 0.00 2.94 1.80 0.00 2.62 1.80 0.00 3.22 1.80 0.00 3.29 1.80 0.00 3.42 1.80 0.00 4.05 1.80 0.00 2.46 1.80 0.00 1.81 1.80 0.00 2.13 1.80 0.00 2.05 1.80 0.00 3.21 1.80 0.00 1.49 1.80 0.00 1.99 1.80 0.00 3.67 1.80 0.00 2.48 1.80 0.00 4.25 1.80 0.00 1.61 1.80 0.00 1.67 1.80 0.00 2.89 1.80 0.00 3.90 1.80 0.00 3.44 1.80 0.00 2.39 1.80 0.00 3.72 1.80 0.00 3.91 1.80 0.00 2.96 1.80 0.00 2.93 1.80 0.00 2.93 1.80 0.00 3.56 1.80 0.00 2.96 1.80 0.00 2.93 1.80 0.00 2.93 1.80 0.00 3.56 1.80 0.00 1.90 1.80 0.00 3.09 1.80 0.00 3.15 1.80 0.00 3.40 1.80 0.00 1.64 1.80 0.00 3.07 1.80 0.00 2.34 1.80 0.00 3.55 1.80 0.00 3.55 1.80 0.00 4.07 1.80 0.00 3.51 1.80 0.00 3.48 1.80 0.00 3.48 1.80 0.00 3.22 1.80 0.00 2.79 1.80 0.00 2.01 1.80 0.00 3.57 1.80 0.00 1.75 1.80 0.00 2.59 1.80 0.00 1.93 1.80 0.00 2.72 1.80 0.00 2.96 1.80 0.00 2.77 1.80 0.00 3.01 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 3.13 1.80 0.00 4.25 1.80 0.00 2.28 1.80 0.00 1.74 1.80 0.00 4.11 1.80 0.00 2.55 1.80 0.00 4.11 1.80 0.00 2.55 1.80 0.00 1.89 1.80 0.00 4.10 1.80 0.00 4.10 1.80 0.00 2.31 1.80 0.00 2.85 1.80 0.00 3.33 1.80 0.00 2.43 1.80 0.00 2.92 1.80 0.00 2.74 1.80 0.00 3.20 1.80 0.00 3.26 1.80 0.00 3.27 1.80 0.00 3.01 1.80 0.00 2.79 1.80 0.00 3.06 1.80 0.00 2.05 1.80 0.00 4.07 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 1.91 1.80 0.00 3.18 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 1.43 1.80 0.00 4.17 1.80 0.00 4.17 1.80 0.00 1.79 1.80 0.00 1.63 1.80 0.00 2.71 1.80 0.00 2.93 1.80 0.00 2.62 1.80 0.00 2.62 1.80 0.00 1.74 1.80 0.00 4.07 1.80 0.00 1.87 1.80 0.00 1.83 1.80 0.00 2.09 1.80 0.00 2.46 1.80 0.00 2.50 1.80 0.00 2.26 1.80 0.00 4.16 1.80 0.00 3.18 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 2.58 1.80 0.00 3.38 1.80 0.00 4.25 1.80 0.00 3.00 1.80 0.00 3.00 1.80 0.00 3.09 1.80 0.00 2.77 1.80 0.00 2.88 1.80 0.00 2.96 1.80 0.00 3.92 1.80 0.00 3.74 1.80 0.00 2.39 1.80 0.00 2.69 1.80 0.00 3.21 1.80 0.00 3.30 1.80 0.00 3.28 1.80 0.00 3.24 1.80 0.00 4.21 1.80 0.00 3.24 1.80 0.00 3.30 1.80 0.00 3.57 1.80 0.00 2.71 1.80 0.00 2.92 1.80 0.00 3.37 1.80 0.00 2.17 1.80 0.00 4.00 1.80 0.00 2.05 1.80 0.00 2.05 1.80 0.00 2.97 1.80 0.00 1.93 1.80 0.00 3.47 1.80 0.00 3.25 1.80 0.00 3.34 1.80 0.00 2.90 1.80 0.00 3.53 1.80 0.00 3.37 1.80 0.00 3.90 1.80 0.00 4.03 1.80 0.00 2.02 1.80 0.00 2.16 1.80 0.00 1.81 1.80 0.00 2.27 1.80 0.00 2.68 1.80 0.00 3.22 1.80 0.00 3.14 1.80 0.00 3.57 1.80 0.00 1.85 1.80 0.00 3.25 1.80 0.00 1.94 1.80 0.00 3.53 1.80 0.00 3.78 1.80 0.00 4.07 1.80 0.00 3.19 1.80 0.00 2.67 1.80 0.00 2.72 1.80 0.00 2.15 1.80 0.00 3.58 1.80 0.00 3.98 1.80 0.00 3.44 1.80 0.00 3.39 1.80 0.00 3.32 1.80 0.00 1.51 1.80 0.00 2.62 1.80 0.00 2.02 1.80 0.00 3.76 1.80 0.00 3.53 1.80 0.00 2.68 1.80 0.00 4.25 1.80 0.00 3.35 1.80 0.00 3.41 1.80 0.00 3.37 1.80 0.00 2.28 1.80 0.00 2.34 1.80 0.00 1.83 1.80 0.00 1.96 1.80 0.00 3.88 1.80 0.00 4.25 1.80 0.00 3.79 1.80 0.00 3.79 1.80 0.00 2.28 1.80 0.00 2.75 1.80 0.00 4.20 1.80 0.00 1.95 1.80 0.00 2.23 1.80 0.00 2.23 1.80 0.00 1.99 1.80 0.00 4.25 1.80 0.00 2.27 1.80 0.00 2.60 1.80 0.00 2.69 1.80 0.00 1.90 1.80 0.00 4.07 1.80 0.00 2.63 1.80 0.00 2.34 1.80 0.00 3.04 1.80 0.00 3.67 1.80 0.00 3.45 1.80 0.00 3.08 1.80 0.00 3.72 1.80 0.00 2.18 1.80 0.00 4.25 1.80 0.00 2.17 1.80 0.00 1.82 1.80 0.00 1.82 1.80 0.00 2.95 1.80 0.00 3.02 1.80 0.00 1.87 1.80 0.00 3.26 1.80 0.00 3.03 1.80 0.00 3.14 1.80 0.00 2.15 1.80 0.00 3.22 1.80 0.00 2.81 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 3.27 1.80 0.00 1.84 1.80 0.00 3.49 1.80 0.00 3.93 1.80 0.00 3.32 1.80 0.00 2.81 1.80 0.00 3.28 1.80 0.00 3.50 1.80 0.00 3.06 1.80 0.00 4.25 1.80 0.00 2.73 1.80 0.00 2.74 1.80 0.00 3.67 1.80 0.00 3.37 1.80 0.00 1.40 1.80 0.00 1.95 1.80 0.00 3.72 1.80 0.00 1.80 1.80 0.00 3.70 1.80 0.00 1.61 1.80 0.00 3.16 1.80 0.00 3.32 1.80 0.00 3.58 1.80 0.00 4.25 1.80 0.00 3.98 1.80 0.00 2.99 1.80 0.00 3.27 1.80 0.00 3.98 1.80 0.00 2.99 1.80 0.00 3.27 1.80 0.00 3.72 1.80 0.00 2.74 1.80 0.00 3.08 1.80 0.00 2.39 1.80 0.00 2.39 1.80 0.00 4.15 1.80 0.00 1.81 1.80 0.00 2.22 1.80 0.00 2.09 1.80 0.00 3.66 1.80 0.00 3.28 1.80 0.00 4.11 1.80 0.00 4.11 1.80 0.00 4.17 1.80 0.00 2.42 1.80 0.00 2.42 1.80 0.00 1.53 1.80 0.00 1.76 1.80 0.00 1.76 1.80 0.00 2.92 1.80 0.00 1.87 1.80 0.00 3.40 1.80 0.00 2.86 1.80 0.00 2.15 1.80 0.00 1.94 1.80 0.00 3.79 1.80 0.00 1.51 1.80 0.00 2.55 1.80 0.00 2.55 1.80 0.00 3.85 1.80 0.00 2.55 1.80 0.00 2.55 1.80 0.00 3.85 1.80 0.00 1.82 1.80 0.00 1.82 1.80 0.00 2.93 1.80 0.00 1.81 1.80 0.00 2.04 1.80 0.00 3.83 1.80 0.00 2.85 1.80 0.00 2.88 1.80 0.00 2.01 1.80 0.00 2.50 1.80 0.00 1.52 1.80 0.00 1.71 1.80 0.00 2.69 1.80 0.00 1.76 1.80 0.00 4.21 1.80 0.00 1.78 1.80 0.00 3.30 1.80 0.00 1.35 1.80 0.00 2.86 1.80 0.00 3.77 1.80 0.00 3.81 1.80 0.00 2.68 1.80 0.00 1.91 1.80 0.00 3.21 1.80 0.00 3.69 1.80 0.00 2.12 1.80 0.00 2.07 1.80 0.00 1.97 1.80 0.00 3.57 1.80 0.00 2.55 1.80 0.00 1.94 1.80 0.00 2.36 1.80 0.00 3.12 1.80 0.00 3.70 1.80 0.00 1.63 1.80 0.00 3.23 1.80 0.00 2.10 1.80 0.00 1.57 1.80 0.00 3.78 1.80 0.00 3.22 1.80 0.00 3.34 1.80 0.00 1.48 1.80 0.00 2.95 1.80 0.00 3.56 1.80 0.00 3.73 1.80 0.00 3.37 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 1.97 1.80 0.00 2.23 1.80 0.00 3.34 1.80 0.00 4.12 1.80 0.00 4.12 1.80 0.00 1.54 1.80 0.00 2.58 1.80 0.00 2.53 1.80 0.00 2.69 1.80 0.00 3.91 1.80 0.00 3.91 1.80 0.00 3.27 1.80 0.00 3.63 1.80 0.00 3.16 1.80 0.00 2.04 1.80 0.00 2.10 1.80 0.00 2.10 1.80 0.00 3.52 1.80 0.00 4.07 1.80 0.00 3.38 1.80 0.00 2.29 1.80 0.00 2.85 1.80 0.00 2.25 1.80 0.00 3.26 1.80 0.00 3.58 1.80 0.00 2.46 1.80 0.00 3.17 1.80 0.00 1.73 1.80 0.00 2.35 1.80 0.00 3.22 1.80 0.00 3.36 1.80 0.00 1.29 1.80 0.00 2.74 1.80 0.00 2.69 1.80 0.00 2.63 1.80 0.00 2.52 1.80 0.00 4.07 1.80 0.00 1.83 1.80 0.00 3.17 1.80 0.00 1.81 1.80 0.00 3.13 1.80 0.00 4.25 1.80 0.00 2.46 1.80 0.00 2.46 1.80 0.00 3.73 1.80 0.00 4.07 1.80 0.00 3.33 1.80 0.00 4.07 1.80 0.00 3.33 1.80 0.00 3.49 1.80 0.00 3.51 1.80 0.00 2.60 1.80 0.00 2.52 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 2.34 1.80 0.00 2.34 1.80 0.00 2.05 1.80 0.00 3.84 1.80 0.00 3.91 1.80 0.00 1.92 1.80 0.00 2.02 1.80 0.00 2.79 1.80 0.00 2.75 1.80 0.00 3.09 1.80 0.00 2.75 1.80 0.00 3.08 1.80 0.00 3.78 1.80 0.00 3.78 1.80 0.00 1.83 1.80 0.00 2.30 1.80 0.00 2.30 1.80 0.00 2.10 1.80 0.00 1.65 1.80 0.00 2.39 1.80 0.00 1.69 1.80 0.00 3.09 1.80 0.00 3.68 1.80 0.00 2.99 1.80 0.00 2.63 1.80 0.00 2.01 1.80 0.00 2.49 1.80 0.00 2.69 1.80 0.00 2.69 1.80 0.00 4.15 1.80 0.00 3.57 1.80 0.00 2.25 1.80 0.00 3.20 1.80 0.00 4.25 1.80 0.00 1.83 1.80 0.00 1.73 1.80 0.00 3.44 1.80 0.00 1.64 1.80 0.00 2.31 1.80 0.00 3.49 1.80 0.00 1.72 1.80 0.00 4.14 1.80 0.00 2.72 1.80 0.00 4.04 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 3.23 1.80 0.00 2.88 1.80 0.00 2.69 1.80 0.00 2.51 1.80 0.00 2.55 1.80 0.00 4.25 1.80 0.00 3.41 1.80 0.00 1.75 1.80 0.00 2.07 1.80 0.00 4.12 1.80 0.00 1.97 1.80 0.00 1.97 1.80 0.00 3.78 1.80 0.00 2.06 1.80 0.00 2.06 1.80 0.00 3.58 1.80 0.00 3.11 1.80 0.00 3.70 1.80 0.00 3.70 1.80 0.00 3.27 1.80 0.00 2.85 1.80 0.00 3.64 1.80 0.00 2.37 1.80 0.00 2.36 1.80 0.00 2.01 1.80 0.00 2.47 1.80 0.00 2.80 1.80 0.00 3.20 1.80 0.00 3.46 1.80 0.00 3.58 1.80 0.00 2.75 1.80 0.00 3.01 1.80 0.00 4.07 1.80 0.00 3.57 1.80 0.00 3.84 1.80 0.00 3.52 1.80 0.00 3.29 1.80 0.00 2.93 1.80 0.00 3.38 1.80 0.00 2.28 1.80 0.00 3.29 1.80 0.00 3.15 1.80 0.00 3.71 1.80 0.00 3.01 1.80 0.00 2.38 1.80 0.00 3.40 1.80 0.00 2.58 1.80 0.00 2.99 1.80 0.00 1.52 1.80 0.00 3.55 1.80 0.00 1.85 1.80 0.00 3.53 1.80 0.00 3.85 1.80 0.00 3.85 1.80 0.00 2.17 1.80 0.00 4.14 1.80 0.00 2.95 1.80 0.00 2.95 1.80 0.00 2.94 1.80 0.00 3.77 1.80 0.00 2.64 1.80 0.00 3.60 1.80 0.00 3.24 1.80 0.00 3.62 1.80 0.00 2.83 1.80 0.00 3.08 1.80 0.00 3.89 1.80 0.00 1.71 1.80 0.00 2.53 1.80 0.00 2.81 1.80 0.00 2.51 1.80 0.00 2.07 1.80 0.00 3.06 1.80 0.00 3.70 1.80 0.00 3.09 1.80 0.00 1.69 1.80 0.00 2.41 1.80 0.00 2.09 1.80 0.00 2.66 1.80 0.00 4.07 1.80 0.00 4.25 1.80 0.00 3.30 1.80 0.00 3.19 1.80 0.00 3.90 1.80 0.00 2.45 1.80 0.00 2.02 1.80 0.00 1.91 1.80 0.00 2.63 1.80 0.00 2.24 1.80 0.00 3.51 1.80 0.00 1.72 1.80 0.00 1.68 1.80 0.00 3.74 1.80 0.00 2.97 1.80 0.00 2.70 1.80 0.00 3.94 1.80 0.00 3.90 1.80 0.00 2.57 1.80 0.00 2.24 1.80 0.00 3.06 1.80 0.00 4.06 1.80 0.00 2.39 1.80 0.00 3.12 1.80 0.00 3.17 1.80 0.00 2.79 1.80 0.00 2.97 1.80 0.00 3.76 1.80 0.00 3.66 1.80 0.00 3.24 1.80 0.00 3.82 1.80 0.00 3.24 1.80 0.00 3.82 1.80 0.00 2.12 1.80 0.00 2.64 1.80 0.00 1.52 1.80 0.00 3.08 1.80 0.00 1.69 1.80 0.00 2.82 1.80 0.00 4.07 1.80 0.00 3.84 1.80 0.00 4.18 1.80 0.00 2.85 1.80 0.00 3.47 1.80 0.00 1.70 1.80 0.00 3.90 1.80 0.00 2.30 1.80 0.00 3.35 1.80 0.00 2.23 1.80 0.00 2.03 1.80 0.00 4.10 1.80 0.00 2.56 1.80 0.00 2.42 1.80 0.00 3.88 1.80 0.00 2.56 1.80 0.00 2.42 1.80 0.00 3.88 1.80 0.00 2.41 1.80 0.00 1.63 1.80 0.00 3.20 1.80 0.00 3.20 1.80 0.00 3.04 1.80 0.00 4.25 1.80 0.00 1.65 1.80 0.00 3.34 1.80 0.00 3.23 1.80 0.00 3.25 1.80 0.00 1.84 1.80 0.00 1.96 1.80 0.00 3.82 1.80 0.00 2.40 1.80 0.00 2.20 1.80 0.00 4.16 1.80 0.00 2.83 1.80 0.00 2.86 1.80 0.00 4.24 1.80 0.00 2.83 1.80 0.00 2.86 1.80 0.00 4.24 1.80 0.00 2.46 1.80 0.00 4.25 1.80 0.00 2.24 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 3.37 1.80 0.00 2.89 1.80 0.00 4.25 1.80 0.00 3.20 1.80 0.00 3.95 1.80 0.00 2.89 1.80 0.00 1.95 1.80 0.00 4.25 1.80 0.00 2.29 1.80 0.00 2.46 1.80 0.00 3.53 1.80 0.00 3.44 1.80 0.00 3.13 1.80 0.00 3.78 1.80 0.00 1.33 1.80 0.00 3.32 1.80 0.00 3.46 1.80 0.00 2.64 1.80 0.00 3.84 1.80 0.00 3.12 1.80 0.00 3.62 1.80 0.00 3.82 1.80 0.00 2.96 1.80 0.00 3.67 1.80 0.00 3.28 1.80 0.00 3.45 1.80 0.00 1.89 1.80 0.00 4.50 1.80 0.00 2.35 1.80 0.00 2.89 1.80 0.00 2.89 1.80 0.00 2.53 1.80 0.00 3.52 1.80 0.00 4.25 1.80 0.00 3.16 1.80 0.00 1.67 1.80 0.00 3.46 1.80 0.00 1.95 1.80 0.00 4.25 1.80 0.00 2.41 1.80 0.00 2.41 1.80 0.00 4.25 1.80 0.00 3.45 1.80 0.00 3.76 1.80 0.00 3.68 1.80 0.00 3.90 1.80 0.00 4.06 1.80 0.00 1.92 1.80 0.00 2.26 1.80 0.00 3.99 1.80 0.00 1.69 1.80 0.00 1.95 1.80 0.00 3.46 1.80 0.00 3.02 1.80 0.00 3.45 1.80 0.00 4.03 1.80 0.00 3.14 1.80 0.00 4.07 1.80 0.00 2.63 1.80 0.00 2.24 1.80 0.00 2.46 1.80 0.00 1.89 1.80 0.00 2.58 1.80 0.00 3.34 1.80 0.00 2.22 1.80 0.00 3.17 1.80 0.00 2.84 1.80 0.00 2.84 1.80 0.00 4.07 1.80 0.00 4.07 1.80 0.00 2.25 1.80 0.00 4.16 1.80 0.00 2.39 1.80 0.00 2.99 1.80 0.00 1.48 1.80 0.00 2.08 1.80 0.00 2.64 1.80 0.00 2.58 1.80 0.00 2.92 1.80 0.00 3.06 1.80 0.00 3.04 1.80 0.00 4.25 1.80 0.00 2.97 1.80 0.00 3.07 1.80 0.00 3.09 1.80 0.00 2.97 1.80 0.00 3.07 1.80 0.00 3.09 1.80 0.00 2.84 1.80 0.00 3.41 1.80 0.00 1.89 1.80 0.00 3.21 1.80 0.00 3.27 1.80 0.00 3.61 1.80 0.00 3.55 1.80 0.00 3.00 1.80 0.00 3.09 1.80 0.00 3.29 1.80 0.00 3.19 1.80 0.00 1.84 1.80 0.00 2.96 1.80 0.00 1.79 1.80 0.00 3.26 1.80 0.00 3.70 1.80 0.00 3.39 1.80 0.00 1.84 1.80 0.00 2.31 1.80 0.00 3.80 1.80 0.00 3.80 1.80 0.00 1.33 1.80 0.00 3.20 1.80 0.00 4.25 1.80 0.00 4.07 1.80 0.00 3.53 1.80 0.00 2.80 1.80 0.00 2.82 1.80 0.00 3.71 1.80 0.00 3.16 1.80 0.00 3.41 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 2.55 1.80 0.00 1.93 1.80 0.00 3.71 1.80 0.00 1.73 1.80 0.00 1.81 1.80 0.00 3.47 1.80 0.00 1.48 1.80 0.00 1.91 1.80 0.00 3.73 1.80 0.00 3.84 1.80 0.00 2.66 1.80 0.00 4.07 1.80 0.00 2.86 1.80 0.00 2.70 1.80 0.00 2.91 1.80 0.00 2.23 1.80 0.00 4.03 1.80 0.00 2.61 1.80 0.00 3.08 1.80 0.00 4.25 1.80 0.00 3.48 1.80 0.00 3.48 1.80 0.00 3.20 1.80 0.00 1.40 1.80 0.00 1.70 1.80 0.00 1.98 1.80 0.00 4.25 1.80 0.00 3.08 1.80 0.00 3.99 1.80 0.00 2.75 1.80 0.00 2.70 1.80 0.00 2.57 1.80 0.00 4.07 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 1.61 1.80 0.00 1.93 1.80 0.00 3.95 1.80 0.00 3.95 1.80 0.00 3.16 1.80 0.00 1.75 1.80 0.00 3.13 1.80 0.00 3.00 1.80 0.00 1.59 1.80 0.00 2.06 1.80 0.00 1.97 1.80 0.00 3.19 1.80 0.00 3.52 1.80 0.00 4.25 1.80 0.00 3.62 1.80 0.00 2.82 1.80 0.00 1.54 1.80 0.00 2.45 1.80 0.00 3.18 1.80 0.00 4.25 1.80 0.00 2.99 1.80 0.00 1.90 1.80 0.00 4.25 1.80 0.00 2.01 1.80 0.00 2.94 1.80 0.00 3.02 1.80 0.00 2.96 1.80 0.00 3.40 1.80 0.00 1.96 1.80 0.00 3.94 1.80 0.00 3.16 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 3.13 1.80 0.00 2.37 1.80 0.00 3.13 1.80 0.00 2.37 1.80 0.00 1.42 1.80 0.00 2.66 1.80 0.00 2.66 1.80 0.00 3.02 1.80 0.00 3.62 1.80 0.00 2.90 1.80 0.00 4.25 1.80 0.00 2.91 1.80 0.00 3.42 1.80 0.00 3.85 1.80 0.00 3.18 1.80 0.00 3.40 1.80 0.00 4.25 1.80 0.00 2.99 1.80 0.00 2.30 1.80 0.00 2.30 1.80 0.00 2.45 1.80 0.00 1.43 1.80 0.00 4.25 1.80 0.00 3.42 1.80 0.00 2.67 1.80 0.00 2.20 1.80 0.00 2.20 1.80 0.00 1.73 1.80 0.00 3.40 1.80 0.00 1.04 1.80 0.00 4.26 1.80 0.00 1.76 1.80 0.00 3.02 1.80 0.00 4.25 1.80 0.00 3.87 1.80 0.00 3.21 1.80 0.00 4.25 1.80 0.00 2.55 1.80 0.00 2.35 1.80 0.00 3.25 1.80 0.00 3.68 1.80 0.00 2.38 1.80 0.00 2.20 1.80 0.00 3.20 1.80 0.00 4.07 1.80 0.00 1.31 1.80 0.00 2.48 1.80 0.00 2.48 1.80 0.00 3.09 1.80 0.00 2.52 1.80 0.00 1.35 1.80 0.00 3.80 1.80 0.00 1.82 1.80 0.00 4.52 1.80 0.00 3.55 1.80 0.00 1.48 1.80 0.00 2.89 1.80 0.00 2.28 1.80 0.00 2.33 1.80 0.00 3.44 1.80 0.00 4.25 1.80 0.00 1.63 1.80 0.00 2.77 1.80 0.00 3.20 1.80 0.00 1.20 1.80 0.00 3.29 1.80 0.00 3.78 1.80 0.00 1.20 1.80 0.00 2.09 1.80 0.00 0.99 1.80 0.00 4.03 1.80 0.00 1.71 1.80 0.00 2.74 1.80 0.00 2.10 1.80 0.00 1.48 1.80 0.00 3.20 1.80 0.00 3.37 1.80 0.00 3.20 1.80 0.00 3.20 1.80 0.00 3.20 1.80 0.00 3.15 1.80 0.00 2.71 1.80 0.00 2.47 1.80 0.00 2.47 1.80 0.00 3.20 1.80 0.00 3.78 1.80 0.00 3.83 1.80 0.00 3.48 1.80 0.00 1.54 1.80 0.00 1.81 1.80 0.00 2.91 1.80 0.00 2.63 1.80 0.00 3.23 1.80 0.00 2.07 1.80 0.00 4.18 1.80 0.00 3.47 1.80 0.00 4.25 1.80 0.00 3.13 1.80 0.00 1.60 1.80 0.00 2.41 1.80 0.00 1.48 1.80 0.00 3.39 1.80 0.00 1.82 1.80 0.00 1.58 1.80 0.00 4.25 1.80 0.00 2.40 1.80 0.00 3.38 1.80 0.00 2.61 1.80 0.00 4.07 1.80 0.00 1.87 1.80 0.00 3.00 1.80 0.00 2.27 1.80 0.00 1.59 1.80 0.00 3.70 1.80 0.00 3.02 1.80 0.00 3.59 1.80 0.00 1.61 1.80 0.00 3.71 1.80 0.00 4.25 1.80 0.00 3.59 1.80 0.00 3.59 1.80 0.00 4.25 1.80 0.00 3.34 1.80 0.00 3.22 1.80 0.00 2.59 1.80 0.00 3.34 1.80 0.00 3.22 1.80 0.00 2.59 1.80 0.00 2.27 1.80 0.00 2.27 1.80 0.00 4.10 1.80 0.00 3.00 1.80 0.00 4.25 1.80 0.00 3.20 1.80 0.00 1.93 1.80 0.00 2.06 1.80 0.00 2.37 1.80 0.00 2.99 1.80 0.00 3.48 1.80 0.00 3.06 1.80 0.00 2.74 1.80 0.00 2.48 1.80 0.00 2.75 1.80 0.00 1.90 1.80 0.00 2.66 1.80 0.00 1.25 1.80 0.00 3.01 1.80 0.00 3.56 1.80 0.00 2.95 1.80 0.00 3.50 1.80 0.00 2.77 1.80 0.00 2.59 1.80 0.00 1.80 1.80 0.00 3.37 1.80 0.00 1.74 1.80 0.00 2.69 1.80 0.00 2.74 1.80 0.00 1.62 1.80 0.00 2.92 1.80 0.00 1.67 1.80 0.00 1.93 1.80 0.00 1.97 1.80 0.00 2.16 1.80 0.00 3.68 1.80 0.00 3.68 1.80 0.00 3.98 1.80 0.00 1.91 1.80 0.00 2.08 1.80 0.00 1.61 1.80 0.00 4.25 1.80 0.00 3.17 1.80 0.00 3.48 1.80 0.00 1.79 1.80 0.00 2.02 1.80 0.00 3.62 1.80 0.00 2.35 1.80 0.00 3.03 1.80 0.00 4.05 1.80 0.00 4.25 1.80 0.00 3.12 1.80 0.00 1.92 1.80 0.00 4.17 1.80 0.00 3.20 1.80 0.00 2.36 1.80 0.00 4.25 1.80 0.00 2.36 1.80 0.00 4.25 1.80 0.00 3.38 1.80 0.00 3.45 1.80 0.00 3.09 1.80 0.00 2.24 1.80 0.00 2.84 1.80 0.00 3.84 1.80 0.00 2.17 1.80 0.00 4.03 1.80 0.00 2.94 1.80 0.00 3.20 1.80 0.00 1.93 1.80 0.00 2.79 1.80 0.00 3.01 1.80 0.00 3.01 1.80 0.00 2.70 1.80 0.00 3.62 1.80 0.00 2.99 1.80 0.00 2.99 1.80 0.00 2.86 1.80 0.00 3.64 1.80 0.00 3.42 1.80 0.00 3.30 1.80 0.00 1.54 1.80 0.00 2.16 1.80 0.00 4.25 1.80 0.00 3.94 1.80 0.00 3.52 1.80 0.00 4.25 1.80 0.00 4.18 1.80 0.00 3.74 1.80 0.00 3.74 1.80 0.00 3.64 1.80 0.00 2.84 1.80 0.00 2.84 1.80 0.00 1.75 1.80 0.00 2.61 1.80 0.00 2.68 1.80 0.00 4.07 1.80 0.00 2.43 1.80 0.00 3.41 1.80 0.00 3.41 1.80 0.00 1.76 1.80 0.00 3.20 1.80 0.00 3.45 1.80 0.00 2.85 1.80 0.00 2.85 1.80 0.00 2.85 1.80 0.00 2.85 1.80 0.00 4.25 1.80 0.00 3.79 1.80 0.00 3.79 1.80 0.00 3.20 1.80 0.00 1.74 1.80 0.00 2.26 1.80 0.00 3.62 1.80 0.00 1.50 1.80 0.00 3.17 1.80 0.00 2.48 1.80 0.00 2.48 1.80 0.00 1.38 1.80 0.00 3.01 1.80 0.00 3.26 1.80 0.00 3.01 1.80 0.00 2.37 1.80 0.00 3.24 1.80 0.00 3.34 1.80 0.00 2.42 1.80 0.00 3.20 1.80 0.00 2.47 1.80 0.00 2.61 1.80 0.00 3.60 1.80 0.00 2.37 1.80 0.00 3.16 1.80 0.00 3.03 1.80 0.00 3.36 1.80 0.00 3.38 1.80 0.00 2.30 1.80 0.00 2.69 1.80 0.00 3.20 1.80 0.00 2.25 1.80 0.00 2.59 1.80 0.00 1.06 1.80 0.00 4.25 1.80 0.00 3.01 1.80 0.00 3.59 1.80 0.00 1.40 1.80 0.00 2.70 1.80 0.00 2.55 1.80 0.00 3.82 1.80 0.00 2.02 1.80 0.00 1.72 1.80 0.00 3.37 1.80 0.00 4.25 1.80 0.00 2.79 1.80 0.00 4.07 1.80 0.00 1.89 1.80 0.00 1.52 1.80 0.00 2.59 1.80 0.00 2.27 1.80 0.00 2.28 1.80 0.00 3.70 1.80 0.00 2.92 1.80 0.00 1.93 1.80 0.00 2.70 1.80 0.00 1.79 1.80 0.00 1.72 1.80 0.00 3.34 1.80 0.00 3.01 1.80 0.00 3.98 1.80 0.00 3.98 1.80 0.00 3.98 1.80 0.00 3.98 1.80 0.00 3.90 1.80 0.00 4.03 1.80 0.00 2.02 1.80 0.00 3.24 1.80 0.00 3.02 1.80 0.00 4.09 1.80 0.00 4.09 1.80 0.00 3.02 1.80 0.00 4.09 1.80 0.00 4.09 1.80 0.00 1.57 1.80 0.00 2.64 1.80 0.00 3.37 1.80 0.00 2.47 1.80 0.00 1.69 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 2.22 1.80 0.00 2.22 1.80 0.00 3.71 1.80 0.00 2.12 1.80 0.00 3.59 1.80 0.00 3.32 1.80 0.00 2.39 1.80 0.00 1.69 1.80 0.00 2.60 1.80 0.00 2.60 1.80 0.00 1.49 1.80 0.00 3.68 1.80 0.00 3.03 1.80 0.00 2.73 1.80 0.00 3.06 1.80 0.00 2.28 1.80 0.00 2.02 1.80 0.00 2.51 1.80 0.00 2.51 1.80 0.00 3.32 1.80 0.00 3.53 1.80 0.00 4.07 1.80 0.00 3.20 1.80 0.00 2.84 1.80 0.00 2.70 1.80 0.00 3.47 1.80 0.00 1.81 1.80 0.00 3.03 1.80 0.00 3.00 1.80 0.00 2.59 1.80 0.00 1.20 1.80 0.00 2.18 1.80 0.00 2.25 1.80 0.00 3.80 1.80 0.00 1.10 1.80 0.00 1.53 1.80 0.00 2.15 1.80 0.00 3.80 1.80 0.00 2.22 1.80 0.00 3.48 1.80 0.00 1.94 1.80 0.00 2.64 1.80 0.00 2.52 1.80 0.00 1.75 1.80 0.00 3.45 1.80 0.00 2.86 1.80 0.00 1.28 1.80 0.00 3.25 1.80 0.00 1.69 1.80 0.00 1.58 1.80 0.00 3.48 1.80 0.00 2.97 1.80 0.00 2.53 1.80 0.00 2.67 1.80 0.00 3.35 1.80 0.00 3.39 1.80 0.00 2.72 1.80 0.00 4.25 1.80 0.00 2.45 1.80 0.00 2.56 1.80 0.00 2.36 1.80 0.00 2.16 1.80 0.00 3.53 1.80 0.00 3.78 1.80 0.00 3.60 1.80 0.00 1.62 1.80 0.00 3.73 1.80 0.00 3.73 1.80 0.00 4.25 1.80 0.00 3.05 1.80 0.00 3.05 1.80 0.00 3.70 1.80 0.00 4.21 1.80 0.00 2.38 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 1.35 1.80 0.00 1.25 1.80 0.00 2.37 1.80 0.00 1.96 1.80 0.00 3.26 1.80 0.00 2.35 1.80 0.00 4.04 1.80 0.00 4.04 1.80 0.00 3.03 1.80 0.00 4.07 1.80 0.00 1.63 1.80 0.00 3.34 1.80 0.00 4.25 1.80 0.00 2.95 1.80 0.00 2.36 1.80 0.00 4.16 1.80 0.00 4.16 1.80 0.00 2.95 1.80 0.00 4.02 1.80 0.00 1.97 1.80 0.00 3.17 1.80 0.00 1.31 1.80 0.00 1.46 1.80 0.00 2.70 1.80 0.00 3.46 1.80 0.00 3.52 1.80 0.00 2.31 1.80 0.00 2.57 1.80 0.00 2.20 1.80 0.00 3.25 1.80 0.00 3.71 1.80 0.00 1.54 1.80 0.00 2.14 1.80 0.00 3.66 1.80 0.00 2.67 1.80 0.00 2.34 1.80 0.00 1.93 1.80 0.00 3.07 1.80 0.00 1.93 1.80 0.00 3.07 1.80 0.00 3.92 1.80 0.00 3.06 1.80 0.00 2.88 1.80 0.00 1.91 1.80 0.00 2.38 1.80 0.00 3.14 1.80 0.00 2.15 1.80 0.00 2.15 1.80 0.00 3.03 1.80 0.00 2.74 1.80 0.00 1.92 1.80 0.00 3.16 1.80 0.00 3.99 1.80 0.00 3.99 1.80 0.00 3.92 1.80 0.00 2.15 1.80 0.00 2.15 1.80 0.00 3.52 1.80 0.00 2.40 1.80 0.00 3.60 1.80 0.00 1.89 1.80 0.00 3.63 1.80 0.00 1.56 1.80 0.00 3.58 1.80 0.00 3.01 1.80 0.00 3.91 1.80 0.00 3.74 1.80 0.00 3.20 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 3.34 1.80 0.00 3.36 1.80 0.00 3.17 1.80 0.00 3.68 1.80 0.00 3.06 1.80 0.00 2.48 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 2.51 1.80 0.00 3.26 1.80 0.00 3.78 1.80 0.00 3.22 1.80 0.00 3.06 1.80 0.00 2.51 1.80 0.00 3.26 1.80 0.00 3.78 1.80 0.00 3.22 1.80 0.00 3.06 1.80 0.00 1.30 1.80 0.00 3.37 1.80 0.00 3.34 1.80 0.00 3.34 1.80 0.00 1.45 1.80 0.00 3.70 1.80 0.00 3.49 1.80 0.00 2.77 1.80 0.00 1.97 1.80 0.00 1.98 1.80 0.00 2.06 1.80 0.00 2.06 1.80 0.00 3.23 1.80 0.00 4.01 1.80 0.00 4.01 1.80 0.00 2.29 1.80 0.00 2.63 1.80 0.00 2.22 1.80 0.00 3.41 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 2.71 1.80 0.00 1.98 1.80 0.00 1.98 1.80 0.00 2.08 1.80 0.00 2.08 1.80 0.00 3.20 1.80 0.00 3.51 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 2.92 1.80 0.00 2.92 1.80 0.00 1.33 1.80 0.00 3.33 1.80 0.00 2.74 1.80 0.00 2.74 1.80 0.00 1.53 1.80 0.00 3.44 1.80 0.00 4.09 1.80 0.00 4.09 1.80 0.00 1.80 1.80 0.00 2.46 1.80 0.00 1.64 1.80 0.00 1.84 1.80 0.00 3.20 1.80 0.00 3.12 1.80 0.00 1.25 1.80 0.00 2.45 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 2.09 1.80 0.00 3.88 1.80 0.00 2.92 1.80 0.00 2.45 1.80 0.00 2.26 1.80 0.00 2.67 1.80 0.00 2.74 1.80 0.00 2.74 1.80 0.00 1.57 1.80 0.00 3.69 1.80 0.00 2.53 1.80 0.00 3.00 1.80 0.00 2.05 1.80 0.00 1.91 1.80 0.00 2.93 1.80 0.00 1.84 1.80 0.00 4.25 1.80 0.00 2.43 1.80 0.00 3.64 1.80 0.00 2.74 1.80 0.00 4.25 1.80 0.00 2.33 1.80 0.00 1.64 1.80 0.00 3.35 1.80 0.00 2.94 1.80 0.00 2.94 1.80 0.00 2.30 1.80 0.00 1.83 1.80 0.00 2.53 1.80 0.00 2.12 1.80 0.00 4.25 1.80 0.00 4.17 1.80 0.00 1.52 1.80 0.00 1.94 1.80 0.00 2.16 1.80 0.00 2.77 1.80 0.00 4.07 1.80 0.00 3.28 1.80 0.00 2.17 1.80 0.00 2.15 1.80 0.00 2.10 1.80 0.00 2.10 1.80 0.00 3.58 1.80 0.00 1.89 1.80 0.00 4.07 1.80 0.00 3.01 1.80 0.00 3.01 1.80 0.00 4.25 1.80 0.00 2.28 1.80 0.00 3.12 1.80 0.00 2.23 1.80 0.00 2.51 1.80 0.00 3.24 1.80 0.00 4.13 1.80 0.00 4.03 1.80 0.00 3.76 1.80 0.00 3.24 1.80 0.00 4.13 1.80 0.00 4.13 1.80 0.00 4.25 1.80 0.00 3.25 1.80 0.00 3.25 1.80 0.00 3.90 1.80 0.00 2.60 1.80 0.00 1.79 1.80 0.00 3.18 1.80 0.00 4.07 1.80 0.00 3.73 1.80 0.00 3.02 1.80 0.00 3.34 1.80 0.00 3.14 1.80 0.00 3.30 1.80 0.00 2.49 1.80 0.00 2.94 1.80 0.00 4.25 1.80 0.00 3.03 1.80 0.00 1.64 1.80 0.00 3.15 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 1.64 1.80 0.00 1.86 1.80 0.00 3.88 1.80 0.00 1.93 1.80 0.00 3.26 1.80 0.00 2.89 1.80 0.00 2.81 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 4.01 1.80 0.00 2.08 1.80 0.00 2.03 1.80 0.00 3.11 1.80 0.00 2.81 1.80 0.00 1.70 1.80 0.00 2.02 1.80 0.00 1.79 1.80 0.00 2.52 1.80 0.00 3.42 1.80 0.00 1.78 1.80 0.00 1.95 1.80 0.00 4.25 1.80 0.00 2.57 1.80 0.00 3.17 1.80 0.00 4.18 1.80 0.00 2.19 1.80 0.00 3.01 1.80 0.00 3.45 1.80 0.00 1.83 1.80 0.00 3.57 1.80 0.00 1.96 1.80 0.00 3.05 1.80 0.00 2.12 1.80 0.00 2.99 1.80 0.00 3.19 1.80 0.00 2.40 1.80 0.00 1.67 1.80 0.00 2.69 1.80 0.00 2.10 1.80 0.00 3.32 1.80 0.00 3.69 1.80 0.00 2.72 1.80 0.00 1.97 1.80 0.00 2.72 1.80 0.00 1.97 1.80 0.00 3.40 1.80 0.00 3.22 1.80 0.00 4.09 1.80 0.00 1.90 1.80 0.00 2.90 1.80 0.00 3.58 1.80 0.00 3.58 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 2.46 1.80 0.00 2.79 1.80 0.00 2.70 1.80 0.00 1.97 1.80 0.00 3.19 1.80 0.00 3.17 1.80 0.00 3.23 1.80 0.00 2.95 1.80 0.00 1.59 1.80 0.00 2.30 1.80 0.00 1.59 1.80 0.00 2.52 1.80 0.00 3.57 1.80 0.00 3.70 1.80 0.00 2.58 1.80 0.00 3.63 1.80 0.00 2.94 1.80 0.00 3.29 1.80 0.00 2.88 1.80 0.00 3.36 1.80 0.00 3.58 1.80 0.00 1.96 1.80 0.00 1.63 1.80 0.00 2.06 1.80 0.00 2.19 1.80 0.00 3.21 1.80 0.00 4.06 1.80 0.00 2.70 1.80 0.00 2.92 1.80 0.00 2.23 1.80 0.00 2.53 1.80 0.00 2.67 1.80 0.00 3.19 1.80 0.00 1.24 1.80 0.00 3.37 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 2.90 1.80 0.00 3.57 1.80 0.00 1.61 1.80 0.00 2.61 1.80 0.00 1.61 1.80 0.00 2.61 1.80 0.00 3.08 1.80 0.00 2.38 1.80 0.00 3.82 1.80 0.00 2.73 1.80 0.00 2.73 1.80 0.00 3.20 1.80 0.00 2.58 1.80 0.00 1.92 1.80 0.00 3.14 1.80 0.00 3.46 1.80 0.00 3.02 1.80 0.00 2.75 1.80 0.00 2.39 1.80 0.00 2.39 1.80 0.00 2.69 1.80 0.00 2.23 1.80 0.00 2.30 1.80 0.00 3.39 1.80 0.00 3.56 1.80 0.00 4.07 1.80 0.00 2.64 1.80 0.00 3.27 1.80 0.00 1.71 1.80 0.00 3.76 1.80 0.00 3.27 1.80 0.00 1.71 1.80 0.00 3.76 1.80 0.00 3.14 1.80 0.00 3.49 1.80 0.00 3.49 1.80 0.00 2.80 1.80 0.00 2.18 1.80 0.00 1.87 1.80 0.00 3.35 1.80 0.00 2.90 1.80 0.00 3.59 1.80 0.00 3.01 1.80 0.00 3.24 1.80 0.00 2.62 1.80 0.00 1.56 1.80 0.00 3.17 1.80 0.00 3.04 1.80 0.00 2.85 1.80 0.00 3.58 1.80 0.00 1.17 1.80 0.00 3.46 1.80 0.00 3.29 1.80 0.00 4.25 1.80 0.00 3.30 1.80 0.00 2.04 1.80 0.00 2.33 1.80 0.00 2.59 1.80 0.00 4.01 1.80 0.00 1.80 1.80 0.00 3.24 1.80 0.00 3.20 1.80 0.00 3.02 1.80 0.00 1.71 1.80 0.00 1.89 1.80 0.00 1.62 1.80 0.00 1.82 1.80 0.00 2.84 1.80 0.00 3.20 1.80 0.00 3.78 1.80 0.00 2.99 1.80 0.00 2.99 1.80 0.00 1.54 1.80 0.00 2.60 1.80 0.00 2.60 1.80 0.00 1.70 1.80 0.00 3.11 1.80 0.00 2.70 1.80 0.00 2.12 1.80 0.00 1.68 1.80 0.00 3.21 1.80 0.00 1.72 1.80 0.00 4.22 1.80 0.00 2.16 1.80 0.00 2.50 1.80 0.00 4.13 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 3.49 1.80 0.00 1.98 1.80 0.00 3.87 1.80 0.00 4.25 1.80 0.00 4.07 1.80 0.00 1.59 1.80 0.00 2.75 1.80 0.00 2.75 1.80 0.00 3.04 1.80 0.00 2.78 1.80 0.00 2.31 1.80 0.00 3.89 1.80 0.00 1.26 1.80 0.00 3.02 1.80 0.00 3.02 1.80 0.00 3.01 1.80 0.00 3.49 1.80 0.00 1.65 1.80 0.00 2.38 1.80 0.00 1.42 1.80 0.00 2.66 1.80 0.00 1.93 1.80 0.00 2.16 1.80 0.00 2.85 1.80 0.00 2.14 1.80 0.00 3.46 1.80 0.00 3.16 1.80 0.00 3.20 1.80 0.00 1.79 1.80 0.00 2.29 1.80 0.00 1.67 1.80 0.00 2.68 1.80 0.00 1.89 1.80 0.00 4.12 1.80 0.00 3.72 1.80 0.00 3.84 1.80 0.00 3.33 1.80 0.00 3.33 1.80 0.00 3.37 1.80 0.00 4.25 1.80 0.00 2.37 1.80 0.00 2.82 1.80 0.00 1.99 1.80 0.00 4.25 1.80 0.00 1.37 1.80 0.00 4.12 1.80 0.00 2.78 1.80 0.00 3.63 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 2.90 1.80 0.00 1.42 1.80 0.00 3.39 1.80 0.00 2.90 1.80 0.00 1.61 1.80 0.00 1.59 1.80 0.00 4.25 1.80 0.00 3.78 1.80 0.00 4.25 1.80 0.00 3.24 1.80 0.00 2.40 1.80 0.00 2.02 1.80 0.00 1.40 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 2.10 1.80 0.00 3.70 1.80 0.00 3.01 1.80 0.00 2.91 1.80 0.00 2.91 1.80 0.00 2.93 1.80 0.00 1.89 1.80 0.00 2.73 1.80 0.00 4.25 1.80 0.00 4.03 1.80 0.00 1.39 1.80 0.00 2.86 1.80 0.00 2.86 1.80 0.00 3.17 1.80 0.00 2.63 1.80 0.00 4.25 1.80 0.00 3.49 1.80 0.00 3.09 1.80 0.00 1.86 1.80 0.00 2.92 1.80 0.00 2.40 1.80 0.00 2.40 1.80 0.00 2.38 1.80 0.00 2.28 1.80 0.00 3.52 1.80 0.00 3.16 1.80 0.00 3.16 1.80 0.00 2.36 1.80 0.00 3.15 1.80 0.00 1.80 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 2.78 1.80 0.00 3.44 1.80 0.00 1.80 1.80 0.00 1.80 1.80 0.00 2.74 1.80 0.00 2.35 1.80 0.00 3.40 1.80 0.00 3.70 1.80 0.00 2.73 1.80 0.00 1.94 1.80 0.00 2.90 1.80 0.00 1.57 1.80 0.00 1.94 1.80 0.00 4.20 1.80 0.00 2.55 1.80 0.00 2.55 1.80 0.00 2.67 1.80 0.00 2.56 1.80 0.00 3.20 1.80 0.00 3.15 1.80 0.00 3.15 1.80 0.00 2.37 1.80 0.00 2.37 1.80 0.00 2.24 1.80 0.00 3.40 1.80 0.00 3.91 1.80 0.00 4.22 1.80 0.00 3.66 1.80 0.00 3.30 1.80 0.00 3.30 1.80 0.00 2.20 1.80 0.00 2.20 1.80 0.00 2.48 1.80 0.00 4.07 1.80 0.00 2.31 1.80 0.00 2.83 1.80 0.00 4.25 1.80 0.00 3.84 1.80 0.00 3.84 1.80 0.00 2.84 1.80 0.00 2.83 1.80 0.00 2.61 1.80 0.00 1.67 1.80 0.00 2.02 1.80 0.00 2.40 1.80 0.00 1.47 1.80 0.00 2.45 1.80 0.00 2.45 1.80 0.00 3.50 1.80 0.00 1.86 1.80 0.00 2.42 1.80 0.00 2.42 1.80 0.00 3.66 1.80 0.00 3.60 1.80 0.00 2.42 1.80 0.00 2.42 1.80 0.00 3.66 1.80 0.00 3.60 1.80 0.00 2.24 1.80 0.00 2.24 1.80 0.00 2.48 1.80 0.00 2.41 1.80 0.00 3.74 1.80 0.00 2.25 1.80 0.00 3.27 1.80 0.00 1.71 1.80 0.00 3.36 1.80 0.00 3.09 1.80 0.00 3.27 1.80 0.00 2.20 1.80 0.00 2.08 1.80 0.00 1.64 1.80 0.00 2.51 1.80 0.00 2.51 1.80 0.00 3.71 1.80 0.00 1.83 1.80 0.00 1.75 1.80 0.00 2.62 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 3.53 1.80 0.00 1.47 1.80 0.00 3.13 1.80 0.00 3.13 1.80 0.00 3.24 1.80 0.00 2.59 1.80 0.00 2.24 1.80 0.00 3.51 1.80 0.00 1.13 1.80 0.00 1.32 1.80 0.00 1.36 1.80 0.00 3.14 1.80 0.00 2.80 1.80 0.00 3.92 1.80 0.00 3.66 1.80 0.00 3.20 1.80 0.00 1.68 1.80 0.00 2.48 1.80 0.00 3.56 1.80 0.00 2.36 1.80 0.00 2.57 1.80 0.00 2.57 1.80 0.00 3.55 1.80 0.00 1.09 1.80 0.00 3.87 1.80 0.00 3.87 1.80 0.00 4.09 1.80 0.00 4.25 1.80 0.00 4.25 1.80 0.00 1.98 1.80 0.00 2.70 1.80 0.00 2.70 1.80 0.00 3.64 1.80 0.00 1.67 1.80 0.00 2.31 1.80 0.00 1.20 1.80 0.00 1.62 1.80 0.00 1.76 1.80 0.00 2.61 1.80 0.00 1.76

list of removed NOE constraints

   313-> TYR    14 HN   - ASP     15 HA    1.80  4.92 	 # NoRestrctn S [2.00 3.99] -- sequential
   440-> PHE    25 HN   - PRO     26 HA    1.80  5.52 	 # NoRestrctn S [2.00 3.99] -- sequential
   833-> ILE    51 HN   - GLY     52 HA*   1.80  5.56 	 # NoRestrctn S [2.00 3.55] -- sequential
   889-> LYS    57 HA   - ARG     58 HN    1.80  3.99 	 # NoRestrctn S [2.00 3.99] -- sequential
  1176-> LEU    70 HN   - VAL     71 HA    1.80  5.47 	 # NoRestrctn S [2.00 3.99] -- sequential
 ====== TOTAL ======:  5

table of distance constraints violations


  Residual Violations greater than 0.10 

    5-> MET      1 HB*  - MET      1 HE*  [ 1.80  3.44]  0.00  0.00  0.00  0.10  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00 -   1 [ 0.10 ..  0.10]
   66-> ARG      3 HB*  - LEU     96 HD1* [ 1.80  4.52]  0.02  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.15  0.00  0.00  0.00  0.00  0.00  0.00 -   2 [ 0.02 ..  0.15]
   73-> ARG      3 HE   - LEU     43 HD1* [ 1.80  4.93]  0.00  0.18  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.08  0.09  0.00  0.00  0.00  0.04 -   4 [ 0.04 ..  0.18]
   79-> ARG      3 HG2  - ILE      7 HD1* [ 1.80  5.91]  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.13  0.00  0.00  0.00  0.00  0.00  0.00 -   1 [ 0.13 ..  0.13]
   80-> ARG      3 HG2  - LEU     43 HD1* [ 1.80  4.35]  0.00  0.00  0.00  0.06  0.00  0.25  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.14  0.00  0.00  0.00  0.00  0.00  0.00 -   3 [ 0.06 ..  0.25]
  137-> PHE      6 HD*  - LEU     43 HD2* [ 1.80  4.49]  0.04  0.00  0.01  0.00  0.00  0.14  0.00  0.04  0.04  0.05  0.08  0.00  0.07  0.05  0.08  0.08  0.06  0.03  0.05  0.00 -  14 [ 0.01 ..  0.14]
  160-> PHE      6 HZ   - LEU     64 HD2* [ 1.80  5.17]  0.00  0.11  0.00  0.01  0.00  0.00  0.00  0.00  0.11  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.09  0.04  0.00  0.00 -   5 [ 0.01 ..  0.11]
  176-> ILE      7 HD1* - PHE     31 HD*  [ 1.80  5.87]  0.00  0.09  0.00  0.15  0.00  0.07  0.00  0.00  0.00  0.00  0.00  0.00  0.05  0.00  0.00  0.06  0.00  0.00  0.00  0.00 -   6 [ 0.00 ..  0.15]
  189-> ILE      7 HG2* - GLN     11 HE21 [ 1.80  5.56]  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.14  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00 -   1 [ 0.14 ..  0.14]
  204-> ASP      8 HA   - GLN     11 HG*  [ 1.80  4.08]  0.00  0.00  0.19  0.00  0.00  0.00  0.03  0.16  0.00  0.11  0.00  0.00  0.00  0.00  0.00  0.00  0.13  0.14  0.02  0.00 -   7 [ 0.02 ..  0.19]
  235-> ALA     10 HA   - TYR     14 HD*  [ 1.80  3.95]  0.00  0.00  0.00  0.12  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00 -   1 [ 0.12 ..  0.12]
  239-> ALA     10 HB*  - GLN     11 HE21 [ 1.80  6.05]  0.00  0.00  0.13  0.00  0.00  0.00  0.00  0.03  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.06  0.00  0.00 -   3 [ 0.03 ..  0.13]
  240-> ALA     10 HB*  - GLN     11 HG*  [ 1.80  5.07]  0.00  0.00  0.00  0.00  0.00  0.00  0.24  0.05  0.00  0.20  0.00  0.00  0.00  0.00  0.00  0.00  0.09  0.05  0.26  0.00 -   6 [ 0.05 ..  0.26]
  248-> ALA     10 HB*  - THR     16 HN   [ 1.80  4.86]  0.00  0.00  0.00  0.00  0.13  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.08  0.00  0.03  0.00  0.00  0.00  0.00  0.00 -   4 [ 0.00 ..  0.13]
  253-> ALA     10 HB*  - ALA     41 HB*  [ 1.80  5.17]  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.09  0.20  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.03 -   4 [ 0.00 ..  0.20]
  272-> GLN     11 HG*  - ASP     15 HA   [ 1.80  4.88]  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.13  0.00  0.00  0.00  0.00  0.00  0.00  0.00 -   1 [ 0.13 ..  0.13]
  277-> LYS     12 HA   - LYS     12 HD*  [ 1.80  4.02]  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.11  0.00  0.00 -   1 [ 0.11 ..  0.11]
  360-> ASP     19 HB*  - VAL     30 HG2* [ 1.80  4.49]  0.00  0.00  0.00  0.00  0.00  0.11  0.00  0.00  0.03  0.00  0.00  0.00  0.00  0.02  0.00  0.00  0.00  0.00  0.00  0.00 -   3 [ 0.02 ..  0.11]
  486-> VAL     30 HA   - LEU     42 HD2* [ 1.80  4.60]  0.01  0.00  0.00  0.00  0.00  0.00  0.00  0.11  0.00  0.03  0.11  0.00  0.00  0.10  0.12  0.07  0.00  0.08  0.00  0.00 -   8 [ 0.01 ..  0.12]
  497-> VAL     30 HG1* - LEU     42 HB*  [ 1.80  4.73]  0.00  0.00  0.11  0.00  0.02  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.02  0.00 -   3 [ 0.02 ..  0.11]
  524-> PHE     31 HZ   - LEU     43 HB*  [ 1.80  4.63]  0.04  0.00  0.00  0.05  0.00  0.13  0.00  0.00  0.00  0.00  0.01  0.08  0.00  0.04  0.00  0.00  0.00  0.00  0.00  0.00 -   6 [ 0.01 ..  0.13]
  526-> ARG     32 HA   - TYR     40 HN   [ 1.80  5.69]  0.00  0.11  0.10  0.00  0.00  0.00  0.00  0.12  0.00  0.00  0.00  0.00  0.12  0.02  0.00  0.00  0.01  0.00  0.00  0.10 -   7 [ 0.01 ..  0.12]
  530-> ARG     32 HB*  - TRP     39 HD1  [ 1.80  4.31]  0.20  0.00  0.00  0.09  0.00  0.00  0.00  0.00  0.12  0.23  0.01  0.00  0.00  0.12  0.00  0.00  0.04  0.06  0.10  0.06 -  10 [ 0.01 ..  0.23]
  533-> ARG     32 HN   - ALA     41 HB*  [ 1.80  5.50]  0.00  0.06  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.12  0.00  0.00  0.00  0.00  0.02  0.00  0.00 -   3 [ 0.02 ..  0.12]
  539-> HIS     33 HB*  - LYS     38 HN   [ 1.80  5.87]  0.15  0.00  0.00  0.00  0.06  0.00  0.00  0.00  0.00  0.00  0.00  0.10  0.00  0.00  0.00  0.00  0.02  0.00  0.07  0.00 -   5 [ 0.02 ..  0.15]
  557-> ASN     36 HB*  - LEU    118 HD1* [ 1.80  4.37]  0.00  0.00  0.00  0.06  0.00  0.00  0.11  0.05  0.00  0.00  0.00  0.04  0.00  0.04  0.03  0.00  0.00  0.00  0.00  0.03 -   7 [ 0.03 ..  0.11]
  558-> ASN     36 HB*  - LEU    118 HD2* [ 1.80  4.04]  0.00  0.00  0.00  0.00  0.11  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00 -   1 [ 0.11 ..  0.11]
  559-> ASN     36 HB*  - LEU    118 HG   [ 1.80  4.86]  0.00  0.09  0.00  0.00  0.14  0.00  0.00  0.02  0.00  0.00  0.00  0.00  0.11  0.00  0.00  0.00  0.00  0.00  0.00  0.00 -   4 [ 0.02 ..  0.14]
  567-> ASN     36 HD2* - GLU    119 HN   [ 1.80  5.46]  0.00  0.16  0.00  0.00  0.00  0.04  0.00  0.00  0.00  0.00  0.00  0.00  0.09  0.00  0.00  0.04  0.06  0.00  0.06  0.00 -   6 [ 0.04 ..  0.16]
  573-> ASP     37 HN   - LYS     38 HN   [ 1.80  4.44]  0.00  0.00  0.00  0.00  0.20  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00 -   1 [ 0.20 ..  0.20]
  577-> LYS     38 HN   - LYS     38 HD*  [ 1.80  4.62]  0.00  0.00  0.00  0.20  0.02  0.00  0.00  0.11  0.00  0.00  0.14  0.00  0.24  0.00  0.00  0.00  0.00  0.00  0.00  0.00 -   5 [ 0.02 ..  0.24]
  581-> TYR     40 HB*  - TRP     91 HD1  [ 1.80  4.65]  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.02  0.00  0.00  0.02  0.00  0.00  0.18  0.00  0.03  0.00  0.01 -   5 [ 0.01 ..  0.18]
  597-> LEU     42 HD1* - MET     44 HE*  [ 1.80  3.43]  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.05  0.00  0.00  0.08  0.00  0.00  0.00  0.00  0.11  0.00  0.11  0.00  0.00 -   4 [ 0.05 ..  0.11]
  638-> MET     44 HE*  - ILE     62 HA   [ 1.80  5.12]  0.00  0.00  0.00  0.00  0.07  0.08  0.00  0.05  0.00  0.00  0.01  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.10  0.00 -   6 [ 0.00 ..  0.10]
  691-> ILE     46 HN   - ARG     58 HB*  [ 1.80  5.87]  0.00  0.00  0.00  0.00  0.11  0.00  0.03  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00 -   2 [ 0.03 ..  0.11]
  692-> ILE     46 HN   - ARG     58 HG*  [ 1.80  5.87]  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.20  0.00  0.00  0.00  0.00  0.00 -   1 [ 0.20 ..  0.20]
  699-> PRO     47 HA   - ARG     58 HG*  [ 1.80  4.44]  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.14  0.00  0.00  0.00  0.00  0.00  0.19 -   2 [ 0.14 ..  0.19]
  760-> GLU     49 HA   - ILE     53 HG2* [ 1.80  5.83]  0.00  0.00  0.00  0.00  0.26  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.17  0.00  0.00 -   2 [ 0.17 ..  0.26]
  762-> GLU     49 HA   - ASP     56 HA   [ 1.80  4.88]  0.03  0.01  0.11  0.03  0.16  0.06  0.00  0.14  0.13  0.06  0.07  0.13  0.05  0.09  0.10  0.05  0.00  0.09  0.00  0.12 -  17 [ 0.01 ..  0.16]
  780-> LYS     50 HN   - LYS     50 HG*  [ 1.80  3.73]  0.00  0.14  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00 -   1 [ 0.14 ..  0.14]
  831-> ILE     51 HN   - ILE     51 HG12 [ 1.80  4.10]  0.00  0.00  0.00  0.03  0.04  0.00  0.00  0.00  0.08  0.13  0.08  0.01  0.00  0.01  0.00  0.00  0.07  0.00  0.00  0.02 -   9 [ 0.01 ..  0.13]
  849-> ILE     53 HD1* - GLY     55 HN   [ 1.80  6.05]  0.00  0.00  0.10  0.13  0.20  0.00  0.00  0.00  0.00  0.08  0.00  0.07  0.12  0.13  0.08  0.00  0.18  0.18  0.11  0.00 -  11 [ 0.07 ..  0.20]
  866-> ILE     53 HG2* - ASP     56 HN   [ 1.80  6.32]  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.25  0.00  0.00  0.00 -   1 [ 0.25 ..  0.25]
  867-> ILE     53 HG2* - LYS     57 HN   [ 1.80  5.35]  0.00  0.08  0.00  0.00  0.00  0.00  0.00  0.00  0.03  0.11  0.00  0.07  0.00  0.01  0.00  0.05  0.00  0.00  0.00  0.00 -   7 [ 0.00 ..  0.11]
  873-> ILE     53 HN   - VAL     59 HG2* [ 1.80  6.05]  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.13  0.12  0.00  0.00  0.03  0.00  0.13  0.00  0.00  0.03  0.00  0.19 -   6 [ 0.03 ..  0.19]
  877-> ASN     54 HN   - ASN     54 HB*  [ 1.80  3.00]  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.13  0.00  0.00 -   1 [ 0.13 ..  0.13]
  883-> ASP     56 HA   - LYS     57 HG*  [ 1.80  5.83]  0.00  0.00  0.00  0.00  0.26  0.37  0.00  0.38  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.42  0.22  0.22  0.00  0.00 -   6 [ 0.22 ..  0.42]
  895-> LYS     57 HG*  - VAL     59 HG1* [ 1.80  4.51]  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.21  0.00  0.00  0.00  0.00  0.00  0.18  0.00  0.00  0.00  0.24  0.00 -   3 [ 0.18 ..  0.24]
  947-> ASP     60 HN   - ASN     97 HA   [ 1.80  5.00]  0.08  0.21  0.16  0.09  0.14  0.16  0.19  0.15  0.26  0.02  0.08  0.11  0.10  0.21  0.11  0.06  0.26  0.18  0.16  0.21 -  20 [ 0.02 ..  0.26]
  983-> ILE     62 HG2* - LEU     64 HB*  [ 1.80  6.05]  0.00  0.07  0.00  0.00  0.00  0.03  0.03  0.03  0.00  0.01  0.00  0.04  0.00  0.00  0.10  0.08  0.01  0.00  0.00  0.00 -   9 [ 0.01 ..  0.10]
  994-> LEU     64 HA   - LEU     64 HD2* [ 1.80  3.72]  0.00  0.24  0.00  0.00  0.00  0.00  0.26  0.00  0.26  0.00  0.00  0.00  0.00  0.00  0.29  0.00  0.25  0.26  0.00  0.00 -   6 [ 0.24 ..  0.29]
  995-> LEU     64 HA   - LEU     74 HD1* [ 1.80  5.97]  0.00  0.20  0.00  0.00  0.00  0.00  0.28  0.00  0.26  0.00  0.00  0.00  0.00  0.00  0.18  0.00  0.31  0.24  0.00  0.00 -   6 [ 0.18 ..  0.31]
 1007-> LEU     64 HD1* - ILE    109 HA   [ 1.80  3.97]  0.00  0.15  0.00  0.00  0.00  0.00  0.15  0.00  0.15  0.00  0.00  0.00  0.00  0.00  0.11  0.00  0.08  0.15  0.00  0.00 -   6 [ 0.08 ..  0.15]
 1016-> LEU     64 HD2* - SER    112 HA   [ 1.80  5.42]  0.00  0.11  0.00  0.00  0.06  0.00  0.10  0.00  0.10  0.00  0.00  0.00  0.00  0.00  0.01  0.00  0.14  0.18  0.00  0.00 -   8 [ 0.00 ..  0.18]
 1032-> LYS     65 HD*  - VAL     66 HN   [ 1.80  5.44]  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.19  0.00  0.00  0.09  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.11  0.00 -   3 [ 0.09 ..  0.19]
 1034-> LYS     65 HD*  - LEU    115 HB2  [ 1.80  4.64]  0.00  0.02  0.00  0.00  0.00  0.12  0.00  0.01  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00 -   3 [ 0.01 ..  0.12]
 1036-> LYS     65 HE*  - LEU    115 HB*  [ 1.80  4.41]  0.00  0.00  0.00  0.00  0.01  0.00  0.02  0.00  0.11  0.00  0.00  0.00  0.00  0.00  0.05  0.00  0.00  0.00  0.00  0.00 -   4 [ 0.01 ..  0.11]
 1041-> LYS     65 HE2  - LEU    115 HB*  [ 1.80  5.21]  0.01  0.00  0.00  0.07  0.04  0.00  0.01  0.00  0.00  0.00  0.00  0.00  0.00  0.12  0.02  0.00  0.00  0.00  0.00  0.00 -   6 [ 0.01 ..  0.12]
 1049-> LYS     65 HN   - LEU     74 HD1* [ 1.80  6.05]  0.00  0.08  0.00  0.00  0.00  0.00  0.12  0.00  0.08  0.00  0.00  0.00  0.00  0.00  0.05  0.00  0.11  0.10  0.00  0.00 -   6 [ 0.05 ..  0.12]
 1052-> LYS     65 HN   - THR    116 HG2* [ 1.80  5.00]  0.09  0.00  0.00  0.00  0.00  0.35  0.00  0.10  0.00  0.00  0.11  0.01  0.03  0.00  0.00  0.03  0.00  0.00  0.22  0.00 -   8 [ 0.01 ..  0.35]
 1055-> VAL     66 HA   - GLN     67 HG*  [ 1.80  5.42]  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.24  0.00  0.00  0.00 -   1 [ 0.24 ..  0.24]
 1058-> VAL     66 HA   - LEU    115 HD1* [ 1.80  4.28]  0.00  0.00  0.00  0.15  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00 -   1 [ 0.15 ..  0.15]
 1059-> VAL     66 HA   - LEU    115 HD2* [ 1.80  4.28]  0.00  0.09  0.06  0.00  0.00  0.00  0.00  0.00  0.11  0.00  0.06  0.00  0.05  0.00  0.14  0.05  0.00  0.00  0.00  0.06 -   9 [ 0.00 ..  0.14]
 1070-> VAL     66 HG1* - ILE     92 HG2* [ 1.80  4.41]  0.01  0.03  0.00  0.00  0.00  0.00  0.00  0.11  0.05  0.00  0.06  0.00  0.13  0.00  0.00  0.00  0.07  0.00  0.15  0.00 -   8 [ 0.01 ..  0.15]
 1075-> VAL     66 HG2* - LEU     70 HD1* [ 1.80  5.16]  0.00  0.05  0.00  0.00  0.00  0.10  0.00  0.00  0.00  0.04  0.00  0.03  0.02  0.07  0.08  0.10  0.00  0.05  0.00  0.00 -   9 [ 0.02 ..  0.10]
 1082-> VAL     66 HG2* - LEU     74 HD2* [ 1.80  2.86]  0.00  0.00  0.01  0.07  0.00  0.00  0.00  0.00  0.00  0.00  0.06  0.05  0.01  0.00  0.00  0.16  0.02  0.00  0.00  0.05 -   8 [ 0.01 ..  0.16]
 1083-> VAL     66 HG2* - LYS     88 HG*  [ 1.80  6.05]  0.00  0.00  0.05  0.00  0.00  0.00  0.13  0.00  0.00  0.00  0.00  0.04  0.00  0.00  0.04  0.00  0.08  0.12  0.13  0.00 -   8 [ 0.00 ..  0.13]
 1086-> VAL     66 HG2* - ILE     92 HD1* [ 1.80  3.20]  0.05  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.02  0.06  0.06  0.15  0.00  0.07  0.08  0.01  0.10 -   9 [ 0.01 ..  0.15]
 1093-> VAL     66 HN   - HIS     90 HN   [ 1.80  6.05]  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.08  0.02  0.00  0.00  0.03  0.04  0.00  0.13 -   5 [ 0.02 ..  0.13]
 1113-> GLN     67 HE2* - GLU     69 HG*  [ 1.80  5.70]  0.00  0.11  0.01  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.03  0.00  0.00 -   4 [ 0.00 ..  0.11]
 1154-> GLU     69 HG*  - LEU     70 HD2* [ 1.80  5.00]  0.00  0.03  0.00  0.00  0.03  0.00  0.11  0.00  0.00  0.00  0.00  0.09  0.00  0.03  0.00  0.00  0.03  0.00  0.00  0.00 -   6 [ 0.03 ..  0.11]
 1184-> VAL     71 HA   - LEU     74 HD1* [ 1.80  4.77]  0.03  0.00  0.13  0.05  0.00  0.16  0.00  0.00  0.00  0.04  0.00  0.12  0.00  0.00  0.00  0.08  0.15  0.00  0.00  0.10 -  10 [ 0.00 ..  0.16]
 1190-> VAL     71 HB   - ILE     92 HG2* [ 1.80  6.05]  0.00  0.05  0.00  0.02  0.02  0.01  0.12  0.00  0.02  0.08  0.00  0.13  0.10  0.10  0.11  0.06  0.00  0.12  0.00  0.10 -  14 [ 0.01 ..  0.13]
 1198-> VAL     71 HG2* - ARG     75 HB*  [ 1.80  3.42]  0.00  0.00  0.00  0.08  0.00  0.00  0.00  0.00  0.00  0.00  0.17  0.00  0.00  0.00  0.00  0.11  0.12  0.00  0.00  0.00 -   4 [ 0.08 ..  0.17]
 1202-> VAL     71 HG2* - ARG     75 HG3  [ 1.80  4.85]  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.18  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00 -   1 [ 0.18 ..  0.18]
 1203-> VAL     71 HG2* - ARG     75 HG2  [ 1.80  4.85]  0.00  0.00  0.00  0.00  0.03  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.03  0.00  0.00  0.12  0.02  0.00 -   6 [ 0.00 ..  0.12]
 1227-> SER     73 HA   - LYS     76 HG2  [ 1.80  5.96]  0.00  0.00  0.00  0.00  0.26  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00 -   1 [ 0.26 ..  0.26]
 1231-> SER     73 HB*  - LYS     76 HE*  [ 1.80  4.97]  0.00  0.01  0.00  0.00  0.00  0.00  0.00  0.07  0.06  0.00  0.00  0.00  0.00  0.14  0.00  0.00  0.00  0.00  0.00  0.00 -   4 [ 0.01 ..  0.14]
 1235-> LEU     74 HA   - LYS     76 HE*  [ 1.80  5.26]  0.15  0.00  0.15  0.00  0.13  0.08  0.12  0.00  0.00  0.00  0.00  0.09  0.00  0.00  0.00  0.00  0.06  0.00  0.00  0.00 -   7 [ 0.06 ..  0.15]
 1242-> LEU     74 HA   - LEU    108 HD2* [ 1.80  3.34]  0.03  0.00  0.03  0.12  0.03  0.11  0.00  0.18  0.00  0.05  0.00  0.11  0.04  0.00  0.00  0.05  0.00  0.00  0.03  0.02 -  12 [ 0.02 ..  0.18]
 1246-> LEU     74 HB*  - LEU    108 HD2* [ 1.80  4.14]  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.13  0.00  0.00  0.00 -   1 [ 0.13 ..  0.13]
 1256-> LEU     74 HD2* - LYS     76 HN   [ 1.80  4.94]  0.00  0.00  0.00  0.12  0.00  0.00  0.00  0.10  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.02  0.23  0.00  0.00  0.08 -   5 [ 0.02 ..  0.23]
 1260-> LEU     74 HN   - LEU     74 HD2* [ 1.80  4.54]  0.00  0.17  0.00  0.00  0.12  0.00  0.00  0.19  0.08  0.00  0.00  0.00  0.00  0.13  0.12  0.00  0.03  0.10  0.00  0.00 -   8 [ 0.03 ..  0.19]
 1278-> ARG     75 HD*  - LYS     88 HD*  [ 1.80  5.00]  0.00  0.03  0.02  0.00  0.18  0.13  0.00  0.00  0.00  0.06  0.00  0.00  0.00  0.00  0.07  0.29  0.00  0.10  0.00  0.00 -   8 [ 0.02 ..  0.29]
 1283-> ARG     75 HE   - PRO     82 HG*  [ 1.80  4.97]  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.11  0.00  0.01  0.00  0.03  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00 -   3 [ 0.01 ..  0.11]
 1286-> ARG     75 HG*  - PRO     82 HB*  [ 1.80  4.28]  0.00  0.00  0.00  0.09  0.00  0.05  0.00  0.00  0.04  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.14  0.00 -   4 [ 0.04 ..  0.14]
 1288-> ARG     75 HG*  - THR     93 HN   [ 1.80  6.05]  0.01  0.00  0.00  0.00  0.00  0.00  0.00  0.25  0.00  0.00  0.00  0.00  0.00  0.03  0.00  0.00  0.00  0.00  0.00  0.05 -   5 [ 0.00 ..  0.25]
 1292-> ARG     75 HG3  - PRO     82 HD*  [ 1.80  5.02]  0.00  0.00  0.00  0.11  0.00  0.00  0.00  0.00  0.00  0.00  0.11  0.00  0.00  0.00  0.00  0.20  0.00  0.00  0.00  0.00 -   3 [ 0.11 ..  0.20]
 1325-> LYS     76 HN   - LYS     76 HD3  [ 1.80  5.00]  0.39  0.00  0.35  0.00  0.36  0.00  0.27  0.00  0.00  0.00  0.00  0.32  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00 -   5 [ 0.27 ..  0.39]
 1340-> LYS     77 HG*  - LEU    108 HD2* [ 1.80  4.26]  0.04  0.00  0.00  0.01  0.01  0.02  0.01  0.00  0.05  0.00  0.00  0.00  0.00  0.03  0.03  0.10  0.00  0.00  0.02  0.00 -  11 [ 0.00 ..  0.10]
 1343-> LYS     77 HN   - ILE     80 HD1* [ 1.80  5.00]  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.13  0.18  0.00  0.07  0.00  0.00  0.00  0.00 -   3 [ 0.07 ..  0.18]
 1347-> PRO     78 HA   - PRO     99 HG3  [ 1.80  6.05]  0.04  0.00  0.00  0.00  0.00  0.37  0.00  0.00  0.15  0.00  0.00  0.02  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.07 -   5 [ 0.02 ..  0.37]
 1369-> ILE     80 HA   - LEU    100 HD1* [ 1.80  6.05]  0.00  0.00  0.00  0.00  0.00  0.00  0.04  0.10  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.07  0.00 -   3 [ 0.04 ..  0.10]
 1370-> ILE     80 HA   - LEU    100 HD2* [ 1.80  4.13]  0.05  0.00  0.00  0.12  0.00  0.07  0.00  0.00  0.00  0.09  0.12  0.09  0.10  0.00  0.00  0.18  0.01  0.00  0.00  0.15 -  10 [ 0.01 ..  0.18]
 1373-> ILE     80 HD1* - LEU    100 HB*  [ 1.80  4.74]  0.05  0.00  0.00  0.02  0.00  0.11  0.00  0.00  0.00  0.00  0.00  0.05  0.00  0.00  0.00  0.00  0.00  0.07  0.00  0.00 -   5 [ 0.02 ..  0.11]
 1374-> ILE     80 HG1* - LEU    100 HD1* [ 1.80  4.74]  0.00  0.00  0.02  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.17  0.00  0.00  0.00 -   2 [ 0.02 ..  0.17]
 1382-> ILE     80 HN   - ILE     80 HD1* [ 1.80  3.74]  0.00  0.00  0.00  0.09  0.00  0.00  0.05  0.13  0.00  0.00  0.02  0.10  0.00  0.00  0.00  0.00  0.00  0.00  0.07  0.08 -   8 [ 0.00 ..  0.13]
 1414-> ASN     87 HB*  - GLU     89 HN   [ 1.80  4.98]  0.00  0.29  0.00  0.02  0.00  0.01  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00 -   3 [ 0.01 ..  0.29]
 1416-> ASN     87 HB*  - TRP     91 HE1  [ 1.80  5.53]  0.00  0.08  0.00  0.00  0.00  0.00  0.19  0.00  0.00  0.00  0.01  0.00  0.00  0.00  0.02  0.00  0.00  0.01  0.00  0.00 -   5 [ 0.01 ..  0.19]
 1422-> LYS     88 HG*  - ILE     92 HG2* [ 1.80  4.74]  0.06  0.07  0.00  0.00  0.07  0.00  0.04  0.00  0.00  0.02  0.00  0.00  0.00  0.03  0.07  0.10  0.00  0.06  0.00  0.05 -  10 [ 0.02 ..  0.10]
 1434-> GLU     89 HN   - GLU     89 HG*  [ 1.80  3.66]  0.00  0.36  0.00  0.00  0.00  0.28  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.29  0.00  0.00 -   3 [ 0.28 ..  0.36]
 1445-> TRP     91 HN   - ILE     92 HD1* [ 1.80  4.91]  0.00  0.00  0.23  0.00  0.00  0.00  0.00  0.17  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.06 -   3 [ 0.06 ..  0.23]
 1515-> PRO     99 HD*  - LEU    100 HG   [ 1.80  4.72]  0.02  0.00  0.00  0.06  0.00  0.19  0.00  0.00  0.00  0.09  0.02  0.05  0.05  0.06  0.00  0.03  0.00  0.04  0.00  0.00 -  10 [ 0.02 ..  0.19]
 1520-> LEU    100 HA   - GLY    101 HN   [ 1.80  3.04]  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.21  0.00  0.00  0.00  0.00  0.00  0.00  0.31  0.00  0.24 -   3 [ 0.21 ..  0.31]
 1532-> LEU    100 HD1* - GLU    104 HA   [ 1.80  5.62]  0.00  0.00  0.08  0.00  0.00  0.00  0.00  0.00  0.03  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.21  0.00  0.01  0.02 -   5 [ 0.01 ..  0.21]
 1598-> GLU    104 HN   - GLU    104 HG2  [ 1.80  4.40]  0.00  0.06  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.07  0.06  0.00  0.20  0.00  0.00  0.20  0.20  0.22 -   7 [ 0.06 ..  0.22]
 1643-> HIS    106 HN   - HIS    106 HD2  [ 1.80  4.48]  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.17  0.00  0.00  0.00  0.14  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00 -   2 [ 0.14 ..  0.17]
 1652-> SER    107 HB*  - LEU    108 HD2* [ 1.80  4.17]  0.00  0.00  0.00  0.03  0.00  0.00  0.00  0.11  0.00  0.05  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00 -   3 [ 0.03 ..  0.11]
 1726-> SER    112 HA   - THR    116 HG2* [ 1.80  4.36]  0.00  0.00  0.00  0.00  0.00  0.00  0.08  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.10  0.00  0.00  0.00 -   3 [ 0.00 ..  0.10]
 1728-> SER    112 HB3  - THR    116 HG2* [ 1.80  4.95]  0.03  0.00  0.00  0.01  0.00  0.00  0.00  0.00  0.05  0.00  0.00  0.00  0.00  0.00  0.03  0.00  0.00  0.14  0.00  0.03 -   6 [ 0.01 ..  0.14]
 1743-> GLN    114 HA   - ARG    117 HB*  [ 1.80  4.11]  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.15  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00 -   1 [ 0.15 ..  0.15]
 1765-> LEU    115 HB2  - THR    116 HA   [ 1.80  5.46]  0.00  0.00  0.00  0.20  0.00  0.18  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.01  0.00  0.00  0.00  0.00  0.00  0.00 -   3 [ 0.01 ..  0.20]
 1770-> LEU    115 HN   - LEU    115 HG   [ 1.80  4.21]  0.00  0.00  0.00  0.25  0.00  0.23  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.24  0.00  0.00  0.00  0.00  0.00  0.00 -   3 [ 0.23 ..  0.25]
 1797-> LEU    118 HA   - GLU    119 HN   [ 1.80  2.93]  0.00  0.00  0.22  0.00  0.00  0.00  0.00  0.00  0.07  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.19  0.00  0.00  0.00 -   3 [ 0.07 ..  0.22]
 1801-> LEU    118 HB*  - GLU    119 HN   [ 1.80  4.60]  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.07  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.11  0.00  0.00  0.03 -   3 [ 0.03 ..  0.11]
 1803-> LEU    118 HD2* - GLU    119 HG*  [ 1.80  5.46]  0.00  0.08  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.07  0.00  0.32  0.16  0.00  0.00  0.00  0.00  0.21  0.00  0.00 -   5 [ 0.07 ..  0.32]
 1806-> LEU    118 HN   - LEU    118 HD1* [ 1.80  4.28]  0.00  0.00  0.00  0.21  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00 -   1 [ 0.21 ..  0.21]
 1808-> LEU    118 HN   - LEU    118 HG   [ 1.80  4.16]  0.00  0.27  0.00  0.00  0.26  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.22  0.00  0.00  0.00  0.00  0.00  0.00  0.00 -   3 [ 0.22 ..  0.27]
 1812-> GLU    119 HA   - HIS    120 HN   [ 1.80  2.89]  0.00  0.00  0.00  0.00  0.00  0.07  0.00  0.00  0.08  0.03  0.00  0.00  0.15  0.16  0.00  0.00  0.00  0.00  0.00  0.32 -   6 [ 0.03 ..  0.32]
 1815-> GLU    119 HG*  - HIS    120 HA   [ 1.80  5.89]  0.11  0.10  0.02  0.19  0.00  0.05  0.00  0.00  0.00  0.00  0.12  0.00  0.03  0.20  0.00  0.05  0.00  0.00  0.05  0.00 -  10 [ 0.02 ..  0.20]
 1819-> GLU    119 HN   - GLU    119 HG3  [ 1.80  4.50]  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.23  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00 -   1 [ 0.23 ..  0.23]
 1821-> GLU    119 HN   - HIS    120 HB*  [ 1.80  5.44]  0.00  0.00  0.00  0.00  0.04  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.18 -   2 [ 0.04 ..  0.18]
 1824-> HIS    121 HA   - HIS    122 HN   [ 1.80  3.00]  0.00  0.00  0.18  0.00  0.00  0.00  0.00  0.24  0.00  0.00  0.21  0.00  0.00  0.00  0.00  0.13  0.00  0.00  0.00  0.00 -   4 [ 0.13 ..  0.24]
 1825-> HIS    121 HB*  - HIS    122 HN   [ 1.80  3.42]  0.00  0.00  0.05  0.00  0.00  0.00  0.00  0.00  0.00  0.00  0.01  0.00  0.06  0.00  0.00  0.14  0.00  0.00  0.00  0.00 -   4 [ 0.01 ..  0.14]
 1829-> PHE      6 HN   - ASN      2 O    [ 1.70  2.30]  0.07  0.00  0.00  0.05  0.00  0.03  0.00  0.00  0.00  0.00  0.00  0.01  0.00  0.10  0.00  0.00  0.04  0.00  0.04  0.09 -   8 [ 0.01 ..  0.10]
 1845-> ASP     19 HN   - VAL     30 O    [ 1.70  2.30]  0.05  0.03  0.00  0.00  0.10  0.00  0.00  0.07  0.05  0.10  0.10  0.00  0.12  0.12  0.09  0.01  0.00  0.01  0.02  0.06 -  14 [ 0.01 ..  0.12]
 1853-> PHE     31 HN   - ALA     41 O    [ 1.70  2.30]  0.00  0.00  0.14  0.00  0.08  0.14  0.19  0.00  0.00  0.00  0.00  0.15  0.00  0.00  0.00  0.00  0.00  0.00  0.11  0.00 -   6 [ 0.08 ..  0.19]
 1857-> MET     44 HN   - VAL     61 O    [ 1.70  2.30]  0.11  0.08  0.17  0.08  0.15  0.12  0.05  0.12  0.11  0.18  0.14  0.15  0.09  0.07  0.09  0.16  0.10  0.07  0.15  0.12 -  20 [ 0.05 ..  0.18]
 1858-> MET     44 N    - VAL     61 O    [ 2.70  3.30]  0.05  0.05  0.10  0.03  0.10  0.09  0.03  0.06  0.01  0.09  0.06  0.11  0.02  0.00  0.04  0.07  0.03  0.00  0.10  0.05 -  18 [ 0.01 ..  0.11]
 1859-> ILE     46 HN   - VAL     59 O    [ 1.70  2.30]  0.03  0.00  0.09  0.09  0.03  0.14  0.12  0.07  0.00  0.00  0.00  0.10  0.07  0.09  0.06  0.07  0.11  0.13  0.02  0.07 -  17 [ 0.00 ..  0.14]
 1865-> VAL     59 HN   - ILE     46 O    [ 1.70  2.30]  0.05  0.08  0.07  0.08  0.05  0.08  0.10  0.07  0.02  0.00  0.02  0.01  0.06  0.03  0.05  0.00  0.11  0.08  0.13  0.00 -  17 [ 0.01 ..  0.13]
 1867-> VAL     61 HN   - MET     44 O    [ 1.70  2.30]  0.02  0.01  0.06  0.00  0.00  0.00  0.01  0.01  0.02  0.00  0.05  0.03  0.02  0.00  0.05  0.07  0.04  0.10  0.07  0.10 -  16 [ 0.00 ..  0.10]
 1869-> ILE     62 HN   - VAL     94 O    [ 1.70  2.30]  0.14  0.00  0.10  0.17  0.13  0.15  0.00  0.09  0.00  0.16  0.11  0.11  0.15  0.21  0.03  0.14  0.00  0.00  0.12  0.17 -  15 [ 0.03 ..  0.21]
 1871-> ASP     63 HN   - LEU     42 O    [ 1.70  2.30]  0.08  0.06  0.00  0.08  0.00  0.00  0.00  0.06  0.07  0.22  0.01  0.00  0.10  0.07  0.08  0.09  0.11  0.00  0.05  0.07 -  14 [ 0.01 ..  0.22]
 1873-> LEU     64 HN   - ILE     92 O    [ 1.70  2.30]  0.00  0.13  0.00  0.00  0.00  0.06  0.13  0.00  0.18  0.00  0.00  0.00  0.00  0.00  0.07  0.00  0.09  0.12  0.00  0.00 -   7 [ 0.06 ..  0.18]
 1875-> VAL     66 HN   - HIS     90 O    [ 1.70  2.30]  0.06  0.01  0.07  0.05  0.00  0.00  0.00  0.12  0.05  0.00  0.07  0.00  0.00  0.00  0.00  0.13  0.00  0.05  0.00  0.00 -   9 [ 0.01 ..  0.13]
 1877-> TYR     81 HN   - THR     93 O    [ 1.70  2.30]  0.05  0.00  0.00  0.08  0.03  0.16  0.07  0.03  0.00  0.04  0.10  0.07  0.05  0.00  0.00  0.00  0.00  0.07  0.11  0.02 -  13 [ 0.02 ..  0.16]
 1881-> THR     93 HN   - TYR     81 O    [ 1.70  2.30]  0.06  0.20  0.11  0.13  0.16  0.21  0.29  0.23  0.21  0.17  0.15  0.10  0.20  0.12  0.22  0.15  0.27  0.18  0.20  0.13 -  20 [ 0.06 ..  0.29]
 1885-> LEU     95 HN   - GLY     79 O    [ 1.70  2.30]  0.12  0.00  0.00  0.12  0.09  0.11  0.00  0.00  0.00  0.06  0.11  0.18  0.08  0.05  0.00  0.06  0.00  0.02  0.13  0.16 -  15 [ 0.00 ..  0.18]
 1889-> ILE    105 HN   - GLY    101 O    [ 1.70  2.30]  0.00  0.07  0.03  0.00  0.09  0.00  0.11  0.09  0.00  0.00  0.03  0.00  0.00  0.00  0.13  0.00  0.09  0.00  0.06  0.00 -  10 [ 0.00 ..  0.13]
 1901-> ASP    111 HN   - SER    107 O    [ 1.70  2.30]  0.09  0.00  0.05  0.00  0.02  0.00  0.03  0.05  0.00  0.02  0.00  0.10  0.00  0.00  0.04  0.00  0.01  0.00  0.00  0.02 -  11 [ 0.00 ..  0.10]
 1907-> GLN    114 HN   - GLU    110 O    [ 1.70  2.30]  0.07  0.00  0.04  0.00  0.12  0.03  0.01  0.08  0.00  0.07  0.00  0.09  0.00  0.01  0.00  0.01  0.00  0.07  0.09  0.07 -  13 [ 0.01 ..  0.12]
   -------------------------------------------  
       Number of Violations greater than 0.10               8    17    14    17    21    25    20    24    15    13    15    18    15    18    16    16    23    26    18    18
   -------------------------------------------  

        ----  Summary Of Residual Distance Constraint Violations ---- 
                      Mod  1 Mod  2 Mod  3 Mod  4 Mod  5 Mod  6 Mod  7 Mod  8 Mod  9 Mod 10 Mod 11 Mod 12 Mod 13 Mod 14 Mod 15 Mod 16 Mod 17 Mod 18 Mod 19 Mod 20       Averages   
                      ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~     ~~~~~~~~~~~  
      0.1 - 0.2  ang:      6     12     11     14     14     18     15     20     10      9     13     15     13     14     12     13     14     19     15     14        13.55
      0.2 - 0.5  ang:      2      5      3      3      7      7      5      4      5      4      2      3      2      4      4      3      9      7      3      4         4.30
        > 0.5    ang:      0      0      0      0      0      0      0      0      0      0      0      0      0      0      0      0      0      0      0      0         0.00
        Total       :     83     82     69     81     85     76     79     85     65     71     72     89     78     81     76     71     94     88     88     82        79.75
 Minimum Violation  :  0.000  0.000  0.000  0.000  0.000  0.000  0.000  0.000  0.000  0.000  0.000  0.000  0.000  0.000  0.000  0.000  0.000  0.000  0.000  0.000        0.000
 Maximum Violation  :  0.392  0.356  0.354  0.246  0.361  0.368  0.286  0.379  0.263  0.229  0.212  0.325  0.236  0.242  0.288  0.417  0.313  0.314  0.263  0.325        0.417
    Max  Intra Viol :  0.392  0.356  0.354  0.246  0.361  0.284  0.272  0.188  0.260  0.133  0.141  0.325  0.236  0.242  0.288  0.063  0.249  0.294  0.199  0.221        0.392
    Max  Seque Viol :  0.111  0.099  0.226  0.200  0.258  0.368  0.245  0.379  0.084  0.205  0.212  0.318  0.157  0.204  0.029  0.417  0.237  0.314  0.263  0.325        0.417
    Max Medium Viol :  0.149  0.286  0.188  0.135  0.262  0.157  0.193  0.183  0.209  0.139  0.165  0.122  0.126  0.176  0.180  0.108  0.254  0.185  0.242  0.097        0.286
    Max   Long Viol :  0.204  0.215  0.172  0.169  0.177  0.365  0.286  0.248  0.263  0.229  0.149  0.177  0.199  0.212  0.219  0.290  0.313  0.241  0.218  0.212        0.365
 Average Violation  :  0.002  0.003  0.002  0.003  0.003  0.004  0.003  0.003  0.002  0.002  0.002  0.003  0.003  0.003  0.003  0.003  0.004  0.004  0.003  0.003      0.00285
    Avge Intra Viol :  0.001  0.003  0.001  0.002  0.002  0.001  0.001  0.002  0.001  0.000  0.001  0.002  0.001  0.001  0.002  0.000  0.001  0.003  0.001  0.001      0.00147
    Avge Seque Viol :  0.002  0.002  0.002  0.002  0.003  0.001  0.002  0.002  0.001  0.002  0.002  0.002  0.002  0.003  0.002  0.002  0.004  0.003  0.002  0.001      0.00208
    Avge Mediu Viol :  0.001  0.001  0.002  0.002  0.002  0.002  0.001  0.004  0.001  0.002  0.002  0.002  0.002  0.001  0.000  0.002  0.002  0.002  0.002  0.003      0.00177
    Avge  Long Viol :  0.004  0.005  0.004  0.005  0.005  0.008  0.006  0.005  0.005  0.005  0.004  0.005  0.005  0.005  0.005  0.005  0.005  0.006  0.006  0.006      0.00522
 RMS     Violation  :  0.015  0.021  0.018  0.018  0.021  0.024  0.020  0.021  0.018  0.016  0.015  0.019  0.016  0.018  0.017  0.019  0.023  0.022  0.018  0.019      0.01911
   RMS   Intra      :  0.019  0.027  0.017  0.020  0.023  0.018  0.018  0.015  0.014  0.007  0.009  0.022  0.016  0.014  0.019  0.004  0.014  0.024  0.011  0.012      0.01711
   RMS   Sequential :  0.012  0.017  0.015  0.011  0.022  0.011  0.014  0.015  0.011  0.013  0.012  0.012  0.012  0.016  0.014  0.012  0.024  0.018  0.014  0.009      0.01470
   RMS Medium range :  0.008  0.008  0.020  0.016  0.017  0.023  0.014  0.027  0.008  0.013  0.018  0.018  0.013  0.014  0.002  0.023  0.020  0.022  0.015  0.023      0.01719
   RMS  Long range  :  0.018  0.024  0.019  0.022  0.023  0.035  0.027  0.025  0.027  0.024  0.019  0.021  0.021  0.023  0.024  0.026  0.027  0.025  0.025  0.026      0.02423


 Final --global-- Summary for 20 models, 1908 NOEs/model, 38160 NOEs total
~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ 
     Summ of viol :    108.942
    Summ sq. viol :     13.937
     Maximum viol :      0.417
     Average viol :    0.00285
        RMSD viol :    0.01911
   Std. Dev. viol :    0.01890
      RMS   Intra :    0.01711 
      RMS   Seque :    0.01470 
      RMS   Medi  :    0.01719 
      RMS   Long  :    0.02423

table of dihedral angle constraints violations

   21-> [LYS  A  13] PHI    -87.3  -47.3    1.6    0.9    0.9    0.0    0.0    0.0    0.0    0.0    0.9    0.0    3.1    2.8    0.1    1.0    0.0    0.0    0.0    0.0    0.0    0.7 -   9 [   0.0 ..    3.1] 
   22-> [LYS  A  13] PSI    -52.8  -12.8    0.0    1.1    0.4    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.4    0.6    0.0    1.0    0.0    0.0    0.0    0.0    0.7    0.0 -   6 [   0.0 ..    1.1] 
   23-> [TYR  A  14] PHI   -144.7  -84.7    0.0    0.0    0.5    2.3    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0 -   2 [   0.0 ..    2.3] 
   24-> [TYR  A  14] PSI    -20.7   39.3    0.0    1.0    1.4    0.0    0.0    0.1    0.0    0.0    0.0    0.7    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0 -   4 [   0.0 ..    1.4] 
   28-> [LYS  A  17] PSI     95.4  155.4    0.0    0.0    1.3    0.0    0.0    0.0    0.0    1.9    2.3    0.0    0.6    0.0    1.4    0.0    2.3    0.0    0.0    0.0    0.0    0.0 -   6 [   0.0 ..    2.3] 
   33-> [HIS  A  20] PHI   -146.5  -86.5    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    1.1 -   1 [   0.0 ..    1.1] 
   34-> [HIS  A  20] PSI     87.7  147.7    1.7    1.4    1.8    1.2    2.1    0.9    1.6    2.6    1.5    0.0    1.6    1.3    1.9    0.0    2.3    0.8    2.4    2.4    2.3    0.0 -  17 [   0.0 ..    2.6] 
   54-> [ARG  A  32] PSI    132.2 -167.8    0.0    0.0    0.0    0.0    0.0    2.6    0.0    0.0    0.0    0.0    0.0    1.7    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0 -   3 [   0.0 ..    2.6] 
   55-> [HIS  A  33] PHI    -99.4  -39.4    0.2    0.0    0.7    1.2    0.0    3.9    1.4    0.7    0.5    1.4    0.6    3.5    0.0    0.8    0.0    1.6    1.5    0.6    0.0    0.0 -  14 [   0.0 ..    3.9] 
   57-> [SER  A  34] PHI   -101.6  -41.6    0.0    0.0    0.0    0.0    0.0    0.0    0.0    1.3    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0 -   1 [   0.0 ..    1.3] 
   58-> [SER  A  34] PSI    -49.8   10.2    0.0    0.0    0.0    0.0    0.0    0.0    0.0    1.1    0.0    0.0    0.0    0.0    0.7    0.0    0.0    0.0    0.0    0.0    0.0    0.0 -   2 [   0.0 ..    1.1] 
   60-> [ASP  A  35] PSI    -43.4   16.6    0.0    0.0    0.0    0.0    1.2    0.0    0.0    0.0    0.7    0.0    0.0    0.0    0.0    0.0    1.8    0.0    0.0    0.0    0.0    2.2 -   5 [   0.0 ..    2.2] 
   61-> [ASN  A  36] PHI   -121.8  -61.8    0.0    0.0    0.0    0.0    0.7    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    1.8    0.0    0.0    0.0    0.0    3.8 -   3 [   0.0 ..    3.8] 
   62-> [ASN  A  36] PSI    -30.0   30.0    0.9    1.8    0.2    0.0    0.0    0.0    0.0    1.8    0.0    0.2    0.8    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.7 -   8 [   0.0 ..    1.8] 
   63-> [TYR  A  40] PHI   -158.3  -98.3    0.2    0.0    0.0    0.0    0.0    1.3    0.0    0.0    0.0    1.9    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0 -   3 [   0.0 ..    1.9] 
   64-> [TYR  A  40] PSI    126.4 -173.6    7.3    0.0    0.0    0.1    0.0    6.5    5.0    3.7    1.2    7.5    0.7    5.6    0.2    7.6    0.0    0.5    0.7    0.0    3.1    2.1 -  15 [   0.0 ..    7.6] 
   65-> [ALA  A  41] PHI   -150.3  -90.3    7.2    0.6    0.7    1.8    0.9    6.5    4.3    4.5    1.3    6.8    1.1    5.7    0.5    7.3    1.0    0.0    1.6    0.0    3.5    3.3 -  18 [   0.0 ..    7.3] 
   66-> [ALA  A  41] PSI    105.9  165.9    0.5    0.0    0.2    0.0    0.3    0.5    1.0    0.0    0.0    0.0    0.0    0.6    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.2 -   7 [   0.0 ..    1.0] 
   76-> [ILE  A  46] PSI     82.0  142.0    3.3    4.5    3.6    3.8    4.0    4.7    5.0    2.8    3.8    4.2    4.0    4.2    5.3    3.5    3.6    3.0    3.8    3.6    4.3    5.0 -  20 [   2.8 ..    5.3] 
   77-> [PRO  A  47] PHI   -106.6  -46.6    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.3    0.0    1.3    0.0    0.0    0.0    0.0    0.0    0.0 -   3 [   0.0 ..    1.3] 
   80-> [ALA  A  48] PSI    -61.2  -21.2    0.0    0.0    0.0    0.0    0.5    0.0    0.0    0.0    0.3    1.4    0.3    0.0    0.1    0.0    0.0    0.2    0.0    0.0    0.3    1.0 -   8 [   0.0 ..    1.4] 
   82-> [GLU  A  49] PSI    -55.0  -15.0    0.7    0.0    0.3    0.0    0.0    0.0    1.5    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    1.0    0.0    0.0    0.0    0.0 -   4 [   0.0 ..    1.5] 
   93-> [ASP  A  60] PHI   -149.5  -89.5    0.0    0.0    0.7    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    1.3    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0 -   2 [   0.0 ..    1.3] 
  114-> [GLY  A  72] PSI    -55.8  -15.8    0.0    0.0    0.0    0.0    0.7    0.0    0.0    1.1    0.4    0.0    0.0    0.0    0.0    1.2    0.4    0.0    0.0    1.1    0.0    0.0 -   6 [   0.0 ..    1.2] 
  116-> [SER  A  73] PSI    -59.1  -19.1    0.0    0.0    0.0    0.0    1.5    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    1.4    0.0    0.0    0.0    0.0    0.0    0.0 -   2 [   0.0 ..    1.5] 
  117-> [LEU  A  74] PHI    -84.8  -44.8    0.0    0.7    0.0    2.2    0.0    0.2    0.0    1.5    1.7    0.0    0.1    0.0    0.0    3.5    0.6    0.0    0.0    0.0    1.0    0.0 -   9 [   0.0 ..    3.5] 
  118-> [LEU  A  74] PSI    -64.1  -24.1    0.0    0.0    0.0    0.0    0.0    0.0    0.0    2.5    0.0    0.0    0.0    0.0    0.0    0.2    0.0    0.0    0.0    1.0    0.0    0.0 -   3 [   0.0 ..    2.5] 
  121-> [LYS  A  76] PHI   -109.7  -69.7    0.0    0.0    0.0    0.0    1.9    0.0    0.0    0.0    0.0    0.0    0.0    1.6    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.7 -   3 [   0.0 ..    1.9] 
  122-> [LYS  A  76] PSI    -31.0    9.0    1.9    0.0    0.5    0.0    1.9    0.0    0.0    0.0    0.0    0.0    0.0    1.4    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0 -   4 [   0.0 ..    1.9] 
  129-> [TYR  A  81] PHI   -123.5  -63.5    0.0    0.4    0.0    0.0    0.0    0.0    0.6    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    1.1    0.0    0.0    0.0    0.0 -   3 [   0.0 ..    1.1] 
  130-> [TYR  A  81] PSI     97.6  157.6    0.0    0.0    0.0    0.0    0.0    3.6    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0 -   1 [   0.0 ..    3.6] 
  133-> [TRP  A  91] PHI   -155.2  -95.2    0.0    0.0    0.0    0.0    0.0    1.3    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0 -   1 [   0.0 ..    1.3] 
  168-> [GLN  A 114] PSI    -62.4  -22.4    0.0    0.0    0.0    0.0    0.0    1.8    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0 -   1 [   0.0 ..    1.8] 
  170-> [LEU  A 115] PSI    -54.3  -14.3    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.8    0.0    0.0    0.0    0.0    0.0    0.0    0.0    1.1    0.0    0.0    0.0    0.0 -   2 [   0.0 ..    1.1] 
  171-> [THR  A 116] PHI   -129.4  -89.4    0.0    0.0    0.0    0.0    0.5    0.0    0.0    0.0    0.0    1.4    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.3 -   3 [   0.0 ..    1.4] 
  172-> [THR  A 116] PSI    -26.3   13.7    1.5    0.8    1.0    1.0    0.0    3.1    0.0    0.2    0.8    0.0    1.3    0.0    1.3    1.2    0.6    1.0    0.0    1.1    1.8    0.0 -  14 [   0.0 ..    3.1] 

    ----  ACOSummary Of Residual ACO Constraint Violations ---- 

                      Mod  1 Mod  2 Mod  3 Mod  4 Mod  5 Mod  6 Mod  7 Mod  8 Mod  9 Mod 10 Mod 11 Mod 12 Mod 13 Mod 14 Mod 15 Mod 16 Mod 17 Mod 18 Mod 19 Mod 20        Averages  
                      ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~      ~~~~~~~~~~~ 
 1 - 10.  degrees   :      7      4      5      7      6     10      7     11      6      7      5     10      4      8      6      4      4      4      5      6          6.30
   > 10.  degrees   :      0      0      0      0      0      0      0      0      0      0      0      0      0      0      0      0      0      0      0      0          0.00
        Total       :     15     13     16      8     12     18     11     16     13      9     14     16     13     15      9     13      7      6     11     16         12.55
 Minimum Violation  :    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0    0.0          0.00
 Maximum Violation  :    7.3    4.5    3.6    3.8    4.0    6.5    5.0    4.5    3.8    7.5    4.0    5.7    5.3    7.6    3.6    3.0    3.8    3.6    4.3    5.0          7.62
     Max   PHI Viol :    7.2    0.9    0.9    2.3    1.9    6.5    4.3    4.5    1.7    6.8    3.1    5.7    0.5    7.3    1.8    1.6    1.6    0.6    3.5    3.8          7.29
     Max   PSI Viol :    7.3    4.5    3.6    3.8    4.0    6.5    5.0    3.7    3.8    7.5    4.0    5.6    5.3    7.6    3.6    3.0    3.8    3.6    4.3    5.0          7.62
 Average Violation  :    0.2    0.1    0.1    0.1    0.1    0.2    0.1    0.2    0.1    0.1    0.1    0.2    0.1    0.2    0.1    0.1    0.1    0.1    0.1    0.1         0.113
     Avge  PHI Viol :  0.329  0.195  0.212  0.296  0.213  0.403  0.271  0.309  0.232  0.366  0.260  0.430  0.141  0.403  0.200  0.196  0.190  0.085  0.243  0.355         0.281
     Avge  PSI Viol :  0.456  0.348  0.352  0.268  0.375  0.529  0.406  0.469  0.356  0.403  0.344  0.422  0.358  0.447  0.358  0.303  0.300  0.326  0.380  0.386         0.384
 RMS     Violation  :  0.864  0.417  0.373  0.431  0.440  0.961  0.666  0.638  0.418  0.871  0.446  0.808  0.463  0.920  0.432  0.318  0.389  0.359  0.542  0.617         0.604
      RMS  PHI Viol :  0.792  0.155  0.179  0.416  0.243  0.847  0.487  0.537  0.257  0.793  0.373  0.810  0.092  0.893  0.234  0.219  0.237  0.067  0.396  0.575         0.505
      RMS  PSI Viol :  0.931  0.570  0.497  0.446  0.573  1.063  0.805  0.725  0.532  0.941  0.508  0.807  0.648  0.946  0.564  0.393  0.497  0.503  0.656  0.657         0.689


 Final --global-- Summary for 20 models, 172 ACOs/model, 3440 ACOs total
~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ 
      Summ. Viol. :     390.29
  Summ. Sq. Viol. :    1255.72
      Max.  Viol. :      7.619
      Avg.  Viol. :    0.11346
      RMS   Viol. :    0.60418
  Std. Dev. Viol. :    0.59343

JPEG image for inter-residue distance constraints per residue plot

S(phi)|S(psi) V/S Residue number

Text output from PDBStat of phi psi order


#     CHAIN                                                              .GT.  SUM.GT.
#  RES  ID DIH  S(phi)  S(psi)  S(chi1) S(chi2) S(chi3) S(chi4) S(chi5)  0.90     1.6 
#  ----------------------------------------------------------------------------------- 
   MET  A   1           0.929   0.839   0.655   0.265                                
   ASN  A   2   0.961   0.991   0.596   0.377                               2        2 
   ARG  A   3   1.000   0.998   0.717   0.926   0.100   0.699   1.000       3        3 
   GLN  A   4   0.995   0.999   0.989   0.566   0.547                       4        4 
   GLN  A   5   1.000   0.999   0.992   0.322   0.555                       5        5 
   PHE  A   6   1.000   1.000   0.997   0.701                               6        6 
   ILE  A   7   1.000   1.000   0.988   0.193                               7        7 
   ASP  A   8   1.000   0.999   0.613   0.941                               8        8 
   TYR  A   9   0.999   0.998   0.997   0.506                               9        9 
   ALA  A  10   0.998   0.994                                              10       10 
   GLN  A  11   0.999   0.991   0.322   0.675   0.231                      11       11 
   LYS  A  12   0.994   0.993   0.654   0.934   0.805   0.322              12       12 
   LYS  A  13   0.990   0.969   0.668   0.479   0.880   0.266              13       13 
   TYR  A  14   0.964   0.980   0.951   0.732                              14       14 
   ASP  A  15   0.988   0.996   0.209   0.743                              15       15 
   THR  A  16   0.988   0.986   0.603                                      16       16 
   LYS  A  17   0.987   0.970   0.666   0.677   0.574   0.101              17       17 
   PRO  A  18   0.989   0.993   0.909   0.856                              18       18 
   ASP  A  19   0.986   0.980   0.638   0.973                              19       19 
   HIS  A  20   0.966   0.970   0.720   0.305                              20       20 
   PRO  A  21   0.978   0.939   0.908   0.877                              21       21 
   TRP  A  22   0.993   0.953   0.867   0.791                              22       22 
   GLU  A  23   0.986   0.991   0.993   0.786   0.849                      23       23 
   LYS  A  24   0.995   0.998   0.997   0.995   0.266   0.504              24       24 
   PHE  A  25   0.991   0.996   0.992   0.317                              25       25 
   PRO  A  26   0.997   0.997   0.946   0.900                              26       26 
   ASP  A  27   0.996   0.999   0.584   0.957                              27       27 
   TYR  A  28   0.994   0.997   0.997   0.985                              28       28 
   ALA  A  29   0.995   0.989                                              29       29 
   VAL  A  30   0.991   0.999   0.984                                      30       30 
   PHE  A  31   0.998   0.980   0.994   0.798                              31       31 
   ARG  A  32   0.991   0.986   0.403   0.940   0.248   0.570   1.000      32       32 
   HIS  A  33   0.993   0.974   0.802   0.210                              33       33 
   SER  A  34   0.985   0.976   0.229                                      34       34 
   ASP  A  35   0.969   0.946   0.652   0.991                              35       35 
   ASN  A  36   0.983   0.914   0.398   0.345                              36       36 
   ASP  A  37   0.881   0.442   0.507   0.851                                        
   LYS  A  38   0.475   0.151   0.346   0.732   0.609   0.575                        
   TRP  A  39   0.426   0.860   0.322   0.342                                        
   TYR  A  40   0.934   0.998   0.682   0.320                              40       40 
   ALA  A  41   0.998   0.966                                              41       41 
   LEU  A  42   0.968   0.982   0.080   0.203                              42       42 
   LEU  A  43   0.995   0.997   0.999   0.992                              43       43 
   MET  A  44   0.996   0.996   0.997   0.665   0.993                      44       44 
   ASP  A  45   0.998   0.980   0.373   0.996                              45       45 
   ILE  A  46   0.978   1.000   0.999   0.997                              46       46 
   PRO  A  47   0.993   0.998   0.932   0.891                              47       47 
   ALA  A  48   0.999   0.999                                              48       48 
   GLU  A  49   0.991   0.989   0.485   0.808   0.917                      49       49 
   LYS  A  50   0.986   0.973   0.983   0.485   0.757   0.364              50       50 
   ILE  A  51   0.978   0.994   0.999   0.999                              51       51 
   GLY  A  52   0.982   0.964                                              52       52 
   ILE  A  53   0.987   0.996   0.995   0.999                              53       53 
   ASN  A  54   0.788   0.369   0.450   0.544                                        
   GLY  A  55   0.530   0.541                                                        
   ASP  A  56   0.450   0.975   0.205   0.948                                        
   LYS  A  57   0.964   0.983   0.329   0.934   0.728   0.372              57       57 
   ARG  A  58   0.989   0.994   0.656   0.948   0.265   0.741   0.991      58       58 
   VAL  A  59   0.999   0.997   0.999                                      59       59 
   ASP  A  60   0.996   0.998   0.782   0.877                              60       60 
   VAL  A  61   1.000   0.999   0.992                                      61       61 
   ILE  A  62   0.999   0.997   0.998   0.999                              62       62 
   ASP  A  63   0.958   0.990   0.617   0.909                              63       63 
   LEU  A  64   0.992   0.961   0.407   0.512                              64       64 
   LYS  A  65   0.995   0.997   0.546   0.920   0.396   0.424              65       65 
   VAL  A  66   0.999   0.999   0.991                                      66       66 
   GLN  A  67   0.993   0.996   0.947   0.995   0.172                      67       67 
   PRO  A  68   0.991   0.994   0.924   0.880                              68       68 
   GLU  A  69   0.993   0.999   0.343   0.448   0.886                      69       69 
   LEU  A  70   0.998   0.996   0.998   0.999                              70       70 
   VAL  A  71   0.999   0.997   0.997                                      71       71 
   GLY  A  72   0.993   0.975                                              72       72 
   SER  A  73   0.998   0.986   0.187                                      73       73 
   LEU  A  74   0.991   0.991   0.610   0.862                              74       74 
   ARG  A  75   0.994   0.978   0.795   0.955   0.497   0.580   1.000      75       75 
   LYS  A  76   0.990   0.979   0.807   0.218   0.777   0.523              76       76 
   LYS  A  77   0.980   0.966   0.982   0.739   0.556   0.195              77       77 
   PRO  A  78   0.989   0.997   0.914   0.865                              78       78 
   GLY  A  79   0.991   0.991                                              79       79 
   ILE  A  80   0.989   0.998   0.995   0.412                              80       80 
   TYR  A  81   0.994   0.992   0.988   0.129                              81       81 
   PRO  A  82   0.989   0.995   0.922   0.870                              82       82 
   ALA  A  83   0.992   0.951                                              83       83 
   TYR  A  84   0.900   0.456   0.616   0.197                                        
   HIS  A  85   0.431   0.488   0.251   0.168                                        
   MET  A  86   0.665   0.196   0.775   0.612   0.306                                
   ASN  A  87   0.325   0.083   0.848   0.250                                        
   LYS  A  88   0.266   0.656   0.991   0.995   0.465   0.460                        
   GLU  A  89   0.770   0.943   0.587   0.869   0.967                                
   HIS  A  90   0.964   0.965   0.986   0.392                              90       90 
   TRP  A  91   0.994   0.990   0.988   0.631                              91       91 
   ILE  A  92   0.993   0.987   0.988   0.756                              92       92 
   THR  A  93   0.991   0.995   0.635                                      93       93 
   VAL  A  94   0.998   1.000   0.997                                      94       94 
   LEU  A  95   0.999   0.996   0.999   1.000                              95       95 
   LEU  A  96   0.997   0.995   0.998   0.996                              96       96 
   ASN  A  97   0.995   0.993   0.687   0.296                              97       97 
   GLY  A  98   0.981   0.982                                              98       98 
   PRO  A  99   0.993   0.908   0.969   0.949                              99       99 
   LEU  A 100   0.909   0.808   0.415   0.074                                      100 
   GLY  A 101   0.812   0.989                                                      101 
   ALA  A 102   0.999   0.996                                             102      102 
   LYS  A 103   0.998   0.999   0.573   0.745   0.602   0.286             103      103 
   GLU  A 104   0.999   0.999   0.633   0.197   0.970                     104      104 
   ILE  A 105   1.000   1.000   0.997   0.999                             105      105 
   HIS  A 106   0.999   1.000   0.898   0.914                             106      106 
   SER  A 107   1.000   1.000   0.297                                     107      107 
   LEU  A 108   1.000   1.000   1.000   0.999                             108      108 
   ILE  A 109   1.000   1.000   1.000   1.000                             109      109 
   GLU  A 110   0.999   0.999   0.998   0.590   0.920                     110      110 
   ASP  A 111   1.000   0.999   0.719   0.989                             111      111 
   SER  A 112   0.996   0.997   0.118                                     112      112 
   PHE  A 113   1.000   1.000   0.999   0.998                             113      113 
   GLN  A 114   0.992   0.992   0.775   0.732   0.623                     114      114 
   LEU  A 115   0.990   0.983   0.871   0.437                             115      115 
   THR  A 116   0.991   0.998   0.993                                     116      116 
   ARG  A 117   0.979   0.812   0.378   0.892   0.339   0.711   1.000              117 
   LEU  A 118   0.793   0.791   0.721   0.707                                        
   GLU  A 119   0.302   0.505   0.578   0.584   0.904                                
   HIS  A 120   0.445   0.215   0.400   0.267                                        
   HIS  A 121   0.732   0.630   0.717   0.023                                        
   HIS  A 122   0.657   0.158   0.365   0.283                                        
   HIS  A 123   0.606   0.528   0.268   0.366                                        
   HIS  A 124   0.696   0.191   0.230   0.110                                        
   HIS  A 125   0.565           0.219   0.143

JPEG image of S(phi)~Residue_number Plot

JPEG image of S(psi)~Residue_number Plot

Table of Backbone and Heavy Atom RMSD

Text report of backbone and heavy atom RMSD for ordered regions

 > 
 > Kabsch RMSD data for family `PSR293_NMR_em_bcr3.pdb' 
 > 
 > Kabsch RMSD of backbone atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model  1 is: 0.529
 > Kabsch RMSD of backbone atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model  2 is: 0.518
 > Kabsch RMSD of backbone atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model  3 is: 0.626
 > Kabsch RMSD of backbone atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model  4 is: 0.666
 > Kabsch RMSD of backbone atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model  5 is: 0.678
 > Kabsch RMSD of backbone atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model  6 is: 0.823
 > Kabsch RMSD of backbone atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model  7 is: 0.640
 > Kabsch RMSD of backbone atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model  8 is: 0.704
 > Kabsch RMSD of backbone atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model  9 is: 0.727
 > Kabsch RMSD of backbone atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model 10 is: 0.473 (*)
 > Kabsch RMSD of backbone atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model 11 is: 0.587
 > Kabsch RMSD of backbone atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model 12 is: 0.548
 > Kabsch RMSD of backbone atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model 13 is: 0.674
 > Kabsch RMSD of backbone atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model 14 is: 0.867
 > Kabsch RMSD of backbone atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model 15 is: 0.718
 > Kabsch RMSD of backbone atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model 16 is: 0.593
 > Kabsch RMSD of backbone atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model 17 is: 0.718
 > Kabsch RMSD of backbone atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model 18 is: 0.706
 > Kabsch RMSD of backbone atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model 19 is: 0.618
 > Kabsch RMSD of backbone atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model 20 is: 0.734
 >
 > Kabsch RMSD statistics for 20 structures: 
 > Mean RMSD using as refer. str. `average' for res.[2..36],[40..53],[57..83],[90..99],[102..116], is: 0.657 
 > Range of RMSD values to reference struct. is 0.473 to 0.867 


 > Kabsch RMSD of heavy atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model  1 is: 0.924 (*)
 > Kabsch RMSD of heavy atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model  2 is: 1.067
 > Kabsch RMSD of heavy atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model  3 is: 1.093
 > Kabsch RMSD of heavy atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model  4 is: 1.132
 > Kabsch RMSD of heavy atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model  5 is: 1.052
 > Kabsch RMSD of heavy atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model  6 is: 1.245
 > Kabsch RMSD of heavy atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model  7 is: 1.136
 > Kabsch RMSD of heavy atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model  8 is: 1.315
 > Kabsch RMSD of heavy atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model  9 is: 1.117
 > Kabsch RMSD of heavy atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model 10 is: 1.038
 > Kabsch RMSD of heavy atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model 11 is: 1.010
 > Kabsch RMSD of heavy atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model 12 is: 1.033
 > Kabsch RMSD of heavy atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model 13 is: 1.160
 > Kabsch RMSD of heavy atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model 14 is: 1.366
 > Kabsch RMSD of heavy atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model 15 is: 1.168
 > Kabsch RMSD of heavy atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model 16 is: 1.082
 > Kabsch RMSD of heavy atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model 17 is: 1.114
 > Kabsch RMSD of heavy atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model 18 is: 1.089
 > Kabsch RMSD of heavy atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model 19 is: 1.048
 > Kabsch RMSD of heavy atoms in res. A[2..36],A[40..53],A[57..83],A[90..99],A[102..116],for model 20 is: 1.131
 >
 > Kabsch RMSD statistics for 20 structures: 
 > Mean RMSD using as refer. str. `average' for res.[2..36],[40..53],[57..83],[90..99],[102..116], is: 1.116 
 > Range of RMSD values to reference struct. is 0.924 to 1.366

Text report of backbone RMSD for entire protein

 > Kabsch RMSD of backb atoms in res. *[1..125],for model  1 is: 1.231
 > Kabsch RMSD of backb atoms in res. *[1..125],for model  2 is: 1.611
 > Kabsch RMSD of backb atoms in res. *[1..125],for model  3 is: 1.919
 > Kabsch RMSD of backb atoms in res. *[1..125],for model  4 is: 1.770
 > Kabsch RMSD of backb atoms in res. *[1..125],for model  5 is: 1.660
 > Kabsch RMSD of backb atoms in res. *[1..125],for model  6 is: 1.459
 > Kabsch RMSD of backb atoms in res. *[1..125],for model  7 is: 2.331
 > Kabsch RMSD of backb atoms in res. *[1..125],for model  8 is: 1.598
 > Kabsch RMSD of backb atoms in res. *[1..125],for model  9 is: 1.039 (*)
 > Kabsch RMSD of backb atoms in res. *[1..125],for model 10 is: 1.519
 > Kabsch RMSD of backb atoms in res. *[1..125],for model 11 is: 1.237
 > Kabsch RMSD of backb atoms in res. *[1..125],for model 12 is: 1.618
 > Kabsch RMSD of backb atoms in res. *[1..125],for model 13 is: 2.548
 > Kabsch RMSD of backb atoms in res. *[1..125],for model 14 is: 1.603
 > Kabsch RMSD of backb atoms in res. *[1..125],for model 15 is: 1.904
 > Kabsch RMSD of backb atoms in res. *[1..125],for model 16 is: 1.294
 > Kabsch RMSD of backb atoms in res. *[1..125],for model 17 is: 2.395
 > Kabsch RMSD of backb atoms in res. *[1..125],for model 18 is: 1.573
 > Kabsch RMSD of backb atoms in res. *[1..125],for model 19 is: 1.880
 > Kabsch RMSD of backb atoms in res. *[1..125],for model 20 is: 1.071
 >
 > Kabsch RMSD statistics for 20 structures: 
 > Mean RMSD using as refer. str. `average' for res.[1..125], is: 1.663 
 > Range of RMSD values to reference struct. is 1.039 to 2.548

Text report of heavy atom RMSD for entire protein

 > Kabsch RMSD of heavy atoms in res. *[1..125],for model  1 is: 1.854
 > Kabsch RMSD of heavy atoms in res. *[1..125],for model  2 is: 2.252
 > Kabsch RMSD of heavy atoms in res. *[1..125],for model  3 is: 2.528
 > Kabsch RMSD of heavy atoms in res. *[1..125],for model  4 is: 2.359
 > Kabsch RMSD of heavy atoms in res. *[1..125],for model  5 is: 2.331
 > Kabsch RMSD of heavy atoms in res. *[1..125],for model  6 is: 2.175
 > Kabsch RMSD of heavy atoms in res. *[1..125],for model  7 is: 3.002
 > Kabsch RMSD of heavy atoms in res. *[1..125],for model  8 is: 2.368
 > Kabsch RMSD of heavy atoms in res. *[1..125],for model  9 is: 1.722 (*)
 > Kabsch RMSD of heavy atoms in res. *[1..125],for model 10 is: 2.169
 > Kabsch RMSD of heavy atoms in res. *[1..125],for model 11 is: 1.893
 > Kabsch RMSD of heavy atoms in res. *[1..125],for model 12 is: 2.212
 > Kabsch RMSD of heavy atoms in res. *[1..125],for model 13 is: 3.165
 > Kabsch RMSD of heavy atoms in res. *[1..125],for model 14 is: 2.230
 > Kabsch RMSD of heavy atoms in res. *[1..125],for model 15 is: 2.443
 > Kabsch RMSD of heavy atoms in res. *[1..125],for model 16 is: 2.063
 > Kabsch RMSD of heavy atoms in res. *[1..125],for model 17 is: 2.828
 > Kabsch RMSD of heavy atoms in res. *[1..125],for model 18 is: 2.087
 > Kabsch RMSD of heavy atoms in res. *[1..125],for model 19 is: 2.367
 > Kabsch RMSD of heavy atoms in res. *[1..125],for model 20 is: 1.758
 >
 > Kabsch RMSD statistics for 20 structures: 
 > Mean RMSD using as refer. str. `average' for res.[1..125], is: 2.290 
 > Range of RMSD values to reference struct. is 1.722 to 3.165

Summary of heavy atom and backbone RMSDs over the whole protein and ordered residues

RMSD Values
	all residues	ordered residues	selected residues
All backbone atoms	1.7	0.7	0.7
All heavy atoms	2.3	1.1	1.1

Contact Map (constraints list and 3D Coordinates)

JPEG image of Contact Map for Constraints

PSR293_NMR_em_bcr3.upl.jpg

JPEG image of Contact Map for Coordinates

PSR293_NMR_em_bcr3.pdb.jpg

Output from PROCHECK

Ramachandran Plot for all models

Text summary of Ramachandran Plot


 +----------<<<  P  R  O  C  H  E  C  K     S  U  M  M  A  R  Y  >>>----------+
 |                                                                            |
 | PSR293_NMR_em_bcr3_020.rin   0.0                             2040 residues |
 |                                                                            |
+| Ramachandran plot:   94.0% core    5.8% allow    0.2% gener    0.0% disall |
 |                                                                            |
+| All Ramachandrans:   19 labelled residues (out of2040)                     |
*| Chi1-chi2 plots:     77 labelled residues (out of1400)                     |

JPEG image for all model Ramachandran Plot

Residue Properties for all models

JPEG for all model Residue Properties - page $num_n

Model Secondary Structures from Procheck

JPEG for Model Secondary Structures - page $num_n

Ramachandran Plots for each residue

JPEG for residue Ramachandran Plots - page $num_n

Ramachandran analysis for each residue from Molprobity

Chi1-Chi2 Plots for each residue

JPEG for residue Chi1-Chi2 Plots - page $num_n

Procheck G-factors for phi-psi for each residue

JPEG image for residue phi-psi G-factors

Table of Procheck G-factors for phi-psi for ordered residues

#phipsi_gfactor
#Residue\Model	average
2	-0.92
3	1.08
4	0.94
5	1.17
6	1.22
7	1.00
8	1.25
9	1.15
10	0.80
11	1.01
12	0.91
13	-0.15
14	-1.96
15	-0.77
16	0.24
17	-0.53
18	0.18
19	-1.08
20	-1.66
21	-0.48
22	-0.76
23	0.24
24	-0.74
25	-1.76
26	-0.02
27	0.17
28	-0.21
29	-0.87
30	0.43
31	-0.17
32	-0.57
33	-0.65
34	0.43
35	0.57
36	-0.73
40	-0.53
41	-1.60
42	-0.60
43	-0.24
44	-0.57
45	-0.17
46	-0.37
47	0.01
48	0.33
49	0.25
50	0.25
51	-2.00
52	0.75
53	-0.31
57	-0.36
58	-0.45
59	-0.06
60	-0.51
61	-0.06
62	-0.39
63	-0.41
64	-0.63
65	-0.33
66	-0.42
67	-0.47
68	0.11
69	-0.65
70	-0.61
71	0.93
72	0.71
73	0.26
74	-0.02
75	0.25
76	-0.21
77	-0.51
78	0.25
79	0.30
80	0.06
81	0.26
82	0.04
83	-0.58
90	-0.15
91	-0.28
92	-0.24
93	-0.09
94	0.39
95	-0.59
96	1.05
97	-0.32
98	-0.71
99	-1.55
101	-0.44
102	0.87
103	1.14
104	1.02
105	1.01
106	1.25
107	1.09
108	1.11
109	1.01
110	0.78
111	1.28
112	1.09
113	1.18
114	0.72
115	0.74
116	-0.68
#Reported_Model_Average	0.011
#Overall_Average_Reported	0.011

Procheck G-factors for all dihedral angles for each residue

JPEG image for residue all dihedral G-factors

Table of Procheck G-factors for all dihedrals for ordered residues

#alldih_gfactor
#Residue\Model	average
2	-0.10
3	0.85
4	0.12
5	0.74
6	0.78
7	0.42
8	0.90
9	0.68
10	0.80
11	0.73
12	0.91
13	0.04
14	-0.73
15	-0.54
16	0.08
17	-0.24
18	0.18
19	-0.20
20	-1.51
21	-0.48
22	-1.78
23	-0.19
24	0.18
25	-0.65
26	-0.02
27	0.41
28	-1.23
29	-0.87
30	0.12
31	0.20
32	-0.30
33	-0.75
34	0.39
35	0.72
36	-0.75
40	-0.10
41	-1.60
42	-1.35
43	-0.69
44	-1.14
45	0.17
46	-0.32
47	0.01
48	0.33
49	0.01
50	0.33
51	-1.59
52	0.75
53	0.16
57	0.00
58	0.11
59	-0.17
60	0.03
61	-0.31
62	-0.30
63	-0.17
64	-2.00
65	-0.05
66	-0.39
67	-0.06
68	0.11
69	-0.27
70	0.13
71	-0.01
72	0.71
73	0.14
74	-1.32
75	0.44
76	-1.31
77	-0.26
78	0.25
79	0.30
80	-0.20
81	0.18
82	0.04
83	-0.58
90	-0.01
91	-1.47
92	-0.50
93	-0.15
94	0.55
95	-0.11
96	0.89
97	0.10
98	-0.71
99	-1.55
101	-0.44
102	0.87
103	0.85
104	0.79
105	0.93
106	0.54
107	0.59
108	1.00
109	0.96
110	0.50
111	1.04
112	0.63
113	0.96
114	0.75
115	0.21
116	-0.24
#Reported_Model_Average	-0.040
#Overall_Average_Reported	-0.040

Output from Verify3D

Verify3D Score over a window of $winsize_s residues

JPEG image for Verify3D Score

Table of Verify3D scores for ordered residues across all models

#verify3d
#Residue\Model	1	2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20
2	0.41	0.41	0.41	0.41	0.51	0.51	0.51	0.41	0.41	0.51	0.51	0.41	0.41	0.41	0.51	0.51	0.41	0.51	0.41	0.51
3	0.56	0.56	1.10	0.56	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	0.56	1.10	1.10	0.56	1.10	0.56
4	0.29	0.62	0.29	0.62	0.62	0.62	0.62	0.29	0.29	0.62	0.62	0.29	0.62	0.62	0.62	0.62	0.29	0.29	0.29	0.62
5	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62
6	1.28	1.28	1.28	1.28	1.28	1.28	1.28	1.28	1.28	1.28	1.28	1.28	1.28	1.28	1.28	1.28	1.28	1.28	1.28	1.28
7	-0.02	-0.06	0.55	-0.06	-0.02	0.55	-0.06	0.55	-0.06	0.55	-0.02	-0.02	0.55	0.55	0.55	-0.02	0.55	-0.06	-0.02	0.55
8	0.29	0.29	0.29	0.29	0.29	0.29	0.29	0.44	0.29	0.29	0.29	0.44	0.29	0.29	0.44	0.29	0.29	0.29	0.29	0.29
9	0.86	0.50	0.50	0.50	0.86	0.86	0.86	0.86	0.86	0.86	0.86	0.86	0.50	0.86	-0.88	0.50	0.50	0.86	0.86	0.86
10	0.76	0.76	0.76	0.76	0.76	0.76	0.76	0.76	0.76	0.76	0.76	0.76	0.76	0.76	0.76	0.76	0.76	0.76	0.76	0.76
11	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62
12	0.07	0.66	0.66	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.66	0.07	0.66	0.07	0.07	0.66	0.07	0.66	0.66	0.07
13	0.56	0.66	0.66	-0.94	0.56	-0.94	0.56	0.56	0.66	0.56	0.66	0.56	0.56	0.66	-0.94	0.66	0.66	0.66	0.56	-0.94
14	1.14	0.52	1.14	1.14	1.14	1.14	0.52	1.14	0.52	0.52	0.52	1.25	0.52	1.14	0.52	1.14	1.14	0.52	0.52	1.25
15	0.23	0.23	0.23	0.23	0.51	0.23	0.23	0.23	0.23	0.23	0.23	0.23	0.51	0.23	0.23	0.23	0.23	0.23	0.23	0.23
16	0.55	0.55	0.08	0.08	0.55	0.08	0.08	0.08	0.55	0.08	0.08	0.08	0.08	0.08	0.08	0.08	0.08	0.08	0.08	0.08
17	-0.10	-0.10	0.47	0.47	-0.10	-0.10	0.47	0.47	-0.10	0.47	0.47	0.47	0.47	-0.10	-0.10	-0.10	-0.10	-0.10	-0.10	0.47
18	0.64	0.64	0.64	0.64	0.64	0.64	0.64	0.64	0.64	0.64	0.64	0.64	0.64	0.64	0.64	0.64	0.64	0.64	0.64	0.64
19	0.51	0.51	0.51	0.23	0.51	0.51	0.51	0.51	0.23	0.51	0.51	0.51	0.51	0.51	0.51	0.51	0.51	0.51	0.51	0.23
20	0.20	0.20	0.20	0.20	0.20	0.20	0.20	0.20	0.20	0.20	0.20	0.20	0.20	0.20	0.20	0.20	0.20	0.20	0.20	0.20
21	0.44	0.44	0.64	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.64	0.44	0.64	0.44	0.44	0.44	0.44	0.44	0.64
22	-0.42	-0.42	1.12	1.12	1.12	1.12	-0.42	-0.42	-0.42	1.12	1.12	-0.42	-0.42	-0.42	-0.42	1.12	-0.42	-0.42	-0.42	-0.42
23	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04
24	-0.10	-0.10	-0.10	-0.10	0.47	0.47	-0.10	-0.10	-0.10	0.47	0.47	-0.10	0.47	-0.10	0.47	-0.10	0.47	-0.10	0.47	-0.10
25	-0.84	-0.84	-1.29	-0.84	-0.84	-0.84	-0.84	-0.84	-1.29	-1.29	-1.29	-0.84	-1.29	-0.84	-1.29	-0.84	-0.84	-0.84	-0.84	-1.29
26	0.44	0.44	0.44	0.44	0.25	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44
27	0.23	0.51	0.23	0.23	0.51	0.23	0.23	0.51	0.51	0.23	0.23	0.51	0.23	0.23	0.23	0.51	0.23	0.34	0.23	0.23
28	1.14	1.14	1.14	1.25	1.14	1.14	1.14	1.14	1.14	1.14	1.14	1.14	0.52	1.14	1.14	1.25	1.14	1.14	1.14	1.14
29	0.59	0.59	0.59	0.59	0.59	0.59	0.59	0.59	0.59	0.59	0.59	0.59	0.59	0.59	0.59	0.59	0.59	0.59	0.59	0.59
30	0.44	0.44	0.71	0.44	0.71	0.44	0.44	0.44	0.44	0.44	0.44	0.16	0.71	0.44	0.44	0.71	1.18	0.44	0.44	0.16
31	1.40	1.40	1.40	1.40	1.40	1.40	1.40	1.40	1.40	1.40	1.40	1.40	1.40	1.40	1.40	1.40	1.40	1.40	1.40	1.40
32	0.71	0.24	0.71	0.71	0.71	0.24	0.24	0.24	0.71	0.71	0.24	0.24	0.71	0.24	0.24	0.24	0.24	0.24	0.71	0.24
33	0.54	0.54	0.54	0.54	1.04	1.04	0.54	0.54	0.54	0.54	0.54	1.04	1.04	0.54	1.04	0.54	0.54	1.04	0.54	1.04
34	0.34	0.34	0.34	0.34	0.34	0.34	0.34	0.34	0.34	0.34	0.34	0.34	0.34	0.34	0.34	0.34	0.34	0.34	0.34	0.34
35	0.23	0.23	0.23	0.23	0.51	0.23	0.23	0.23	0.23	0.23	0.23	0.51	0.23	0.23	0.51	0.23	0.23	0.23	0.23	0.23
36	-0.26	-0.26	-0.26	-0.26	-0.26	-0.26	-0.26	-0.26	-0.26	-0.26	-0.26	-0.56	-0.26	-0.26	-0.26	-0.26	-2.61	-0.26	0.51	-0.26
40	-0.43	1.25	-0.43	-0.43	-0.43	-0.43	1.25	1.14	-0.43	-0.43	1.25	-0.43	1.14	-0.43	-0.43	1.14	-0.43	-0.43	-0.43	1.25
41	-0.25	0.49	0.49	0.49	-0.25	0.49	-0.25	0.49	0.49	-0.25	0.49	0.49	0.49	-0.25	0.49	0.49	0.49	0.49	0.49	-0.25
42	-0.81	-0.81	0.36	-0.81	0.36	-0.81	0.36	0.14	-0.81	0.36	0.14	-0.81	0.36	-1.33	0.36	0.36	-0.81	0.36	0.14	-0.81
43	0.36	1.07	1.07	1.07	1.07	0.36	0.36	1.07	1.07	1.07	1.07	1.07	1.07	0.36	1.07	1.07	1.07	1.07	1.07	1.07
44	0.51	0.49	0.49	0.49	-0.68	0.51	0.51	0.49	0.49	0.51	0.49	-0.68	0.49	0.49	0.51	0.49	-0.68	0.49	0.49	0.49
45	-0.03	-0.03	-0.03	-0.03	-0.03	-0.03	-0.03	-0.03	-0.03	-0.03	-0.03	-0.03	-0.03	-0.03	-0.03	-0.03	-0.03	-0.03	-0.03	-0.03
46	1.07	1.07	1.07	1.07	1.50	1.50	1.50	1.07	1.07	1.07	1.07	1.07	1.50	1.50	1.50	1.07	1.50	1.50	1.50	1.07
47	-1.01	-0.65	-1.01	-0.65	-0.65	-0.65	-1.01	-0.65	-1.01	-0.65	-0.65	-0.65	-0.65	-1.01	-0.65	-0.65	-1.01	-0.65	-0.65	-1.01
48	0.49	0.49	0.49	0.49	0.49	0.49	0.49	0.49	0.49	0.49	0.49	0.49	0.49	0.49	0.49	0.49	0.49	0.49	0.49	0.49
49	0.28	0.28	0.28	0.28	0.28	0.28	0.28	0.28	0.28	0.28	0.28	0.28	0.28	0.28	0.28	0.28	0.28	0.28	0.28	0.28
50	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	-0.72	0.47	0.47	0.47
51	0.93	0.93	0.93	0.93	0.93	0.93	0.93	0.93	0.93	0.93	0.93	0.93	0.93	0.93	0.93	0.93	0.93	0.93	0.93	0.93
52	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10
53	-0.28	-0.28	-0.94	-0.94	-0.28	-0.94	-0.94	-0.94	-0.94	-0.28	-0.28	-0.28	-0.28	-0.54	-0.94	-0.94	-0.28	-0.94	-0.94	-0.94
57	0.47	0.47	0.47	0.47	0.47	-0.10	0.47	-0.10	-0.10	0.47	0.47	0.47	0.47	0.47	-0.10	-0.10	0.47	0.47	-0.10	0.47
58	-1.12	0.19	0.19	0.19	0.19	0.19	0.19	0.19	0.19	0.19	-1.12	0.19	0.19	0.19	-1.12	0.19	0.19	-1.12	0.19	0.19
59	1.18	0.71	1.18	0.71	0.71	0.71	1.18	1.18	0.71	0.71	1.18	1.18	1.18	0.71	0.44	0.44	1.18	0.71	0.71	0.71
60	-0.61	-0.61	-0.03	-0.03	-0.03	-0.61	-0.61	-0.61	-0.03	-0.03	-0.61	-0.61	-0.61	-0.61	-0.03	-0.03	-0.03	-0.03	-0.03	-0.61
61	1.18	1.18	1.18	0.71	1.18	1.18	1.18	0.71	0.71	1.18	0.71	1.18	1.18	1.18	1.18	1.18	1.18	1.18	1.18	1.18
62	1.50	1.50	1.50	1.50	1.50	1.50	1.50	1.50	1.50	1.50	1.50	1.50	1.50	1.50	1.50	1.50	1.50	1.50	1.50	1.50
63	-0.61	-0.61	-0.61	-0.61	-0.61	-0.61	-0.61	-0.61	-0.61	-1.80	-0.61	-0.61	-1.80	-0.61	-0.61	-0.61	-0.61	-0.61	-0.61	-0.61
64	0.36	1.07	0.36	1.07	1.07	1.07	1.07	0.36	1.07	0.36	0.36	0.36	0.36	0.36	1.07	0.36	1.07	1.07	1.07	0.36
65	0.35	0.35	-2.01	0.35	0.35	0.35	-0.83	0.35	0.55	0.35	0.35	-0.83	0.35	0.35	0.35	0.35	0.35	0.35	0.35	0.35
66	0.66	0.66	0.66	1.00	0.66	0.66	0.66	0.66	0.66	0.66	1.00	0.66	0.66	0.66	0.66	0.66	0.66	0.66	0.66	0.66
67	-0.57	-0.57	-0.57	-0.57	-0.57	-0.57	-0.57	-0.57	-0.57	-0.57	-0.57	-0.57	-0.57	-0.57	-0.57	-0.57	-0.57	-0.57	-0.57	-0.57
68	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.25	0.25	0.44	0.44	0.25	0.44	0.44	0.25	0.44	0.25	0.44	0.25
69	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.28	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04
70	-0.68	-0.68	-0.68	-0.68	-0.68	-0.68	-0.68	-0.68	-0.68	-0.68	-0.68	-0.68	-0.68	-0.68	-0.68	-0.68	-0.68	-0.68	-0.68	-0.68
71	0.30	0.30	0.30	0.30	0.30	0.30	-0.62	-0.62	0.30	0.30	0.30	-0.29	0.30	0.30	0.30	0.30	0.30	0.30	0.30	0.30
72	0.63	0.63	0.63	0.63	0.63	0.63	0.63	0.63	0.63	0.63	0.63	0.63	0.63	0.63	0.63	0.63	0.63	0.63	0.63	0.63
73	0.16	0.16	0.16	0.16	0.16	0.16	-0.38	0.16	0.16	0.16	0.16	0.16	0.16	-0.38	0.16	0.16	0.47	0.16	0.16	0.16
74	1.30	1.30	1.30	1.30	1.30	1.30	1.30	1.30	1.30	1.30	1.30	1.30	1.30	1.30	1.30	1.30	1.30	1.30	1.30	1.30
75	1.10	1.10	1.10	1.10	-0.51	1.10	-0.11	-1.80	1.10	1.10	1.10	1.10	-0.51	1.10	-0.51	-0.11	-0.51	1.10	1.10	1.10
76	0.66	0.66	0.66	0.66	0.66	0.66	0.66	0.66	0.66	0.66	0.07	0.66	0.66	0.66	0.66	0.66	0.66	0.66	0.66	0.66
77	-2.12	-0.72	-0.72	0.08	0.47	0.08	-0.72	0.47	-2.12	0.47	0.08	0.08	0.47	-0.72	0.47	0.08	-2.12	0.08	0.08	0.47
78	0.25	0.25	0.25	0.25	0.25	0.25	0.25	0.25	0.25	0.25	0.25	0.25	0.25	0.25	0.25	0.25	0.25	0.25	0.25	0.25
79	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10
80	1.50	1.07	1.07	1.50	1.50	1.50	1.50	1.07	1.50	1.50	1.50	1.50	1.07	1.50	1.50	1.50	1.07	1.50	1.50	1.50
81	1.09	1.09	1.30	-0.30	1.09	1.09	1.09	1.09	1.09	1.09	-0.30	1.09	1.09	1.09	1.09	1.09	1.09	1.09	1.09	1.09
82	-1.01	-0.65	-0.65	-1.01	-1.01	-0.65	-0.65	-0.65	-0.65	-0.65	-0.65	-1.01	-1.01	-1.01	-1.01	-1.01	-1.01	-0.65	-0.65	-0.65
83	-0.25	0.49	0.49	0.49	-0.25	0.49	-0.25	0.49	-0.25	0.49	0.49	-0.25	-0.25	0.49	-0.25	-0.25	-0.25	-0.25	-0.25	0.49
90	0.20	0.20	0.20	0.20	0.20	1.04	1.04	0.20	0.20	0.20	0.20	0.20	0.20	0.20	1.04	0.20	0.20	0.20	0.20	0.20
91	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07
92	1.50	1.50	1.07	1.50	1.50	1.07	1.50	0.26	1.50	1.07	1.07	1.07	1.50	1.50	1.50	1.07	1.50	1.50	1.50	1.50
93	0.95	0.95	0.95	0.95	0.95	0.95	0.95	0.95	0.95	0.95	0.95	0.95	0.95	0.95	0.95	0.95	0.95	0.95	0.95	0.95
94	1.18	1.18	1.18	1.18	1.18	1.18	1.18	1.18	1.18	1.18	1.18	1.18	1.18	1.18	1.18	1.18	1.18	1.18	1.18	1.18
95	1.07	1.07	1.07	1.07	1.07	1.07	1.07	1.07	1.07	1.07	1.07	1.07	1.07	1.07	1.07	1.07	1.07	1.07	1.07	1.07
96	1.06	0.77	1.06	1.06	1.06	1.06	0.77	1.06	1.06	1.06	1.06	1.06	1.06	1.06	1.06	1.06	1.06	1.06	1.06	1.06
97	0.51	0.51	0.41	0.41	0.51	0.51	0.51	0.51	0.51	0.41	0.51	0.51	0.41	0.51	0.51	0.51	0.51	0.51	0.41	0.41
98	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10
99	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44
101	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10
102	0.44	0.76	0.76	0.44	0.76	0.44	0.76	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.76	0.44
103	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.66	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07
104	-0.43	-0.43	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.09	0.62	0.62	0.62	0.62	0.62	0.62	0.62	-0.43
105	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11
106	0.82	0.82	0.82	0.82	0.82	0.82	0.82	0.17	0.82	0.82	-0.91	0.17	0.82	0.82	-0.91	0.82	-0.34	0.82	0.82	0.82
107	0.16	0.16	0.16	0.16	0.16	0.16	0.16	0.16	0.16	0.16	0.16	0.16	0.16	0.16	0.16	0.16	0.16	0.16	0.16	0.16
108	0.71	0.71	0.71	1.30	1.30	1.30	0.71	-0.30	1.30	-0.30	1.30	0.71	0.71	1.30	1.30	1.30	0.71	1.30	0.71	1.30
109	1.11	1.11	0.55	1.11	1.11	1.11	0.55	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11
110	0.62	0.62	0.62	0.62	0.62	0.60	0.62	0.62	0.62	0.62	0.60	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62
111	0.29	0.44	0.44	0.44	-0.28	0.29	0.29	0.29	-0.28	0.29	0.29	0.29	0.44	0.29	0.29	0.44	0.29	0.29	0.44	0.29
112	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47
113	-0.22	-0.22	-1.35	-1.35	-0.22	-1.35	-0.22	-0.22	0.87	-0.22	-1.35	-0.22	-0.22	-1.35	-0.22	-1.35	-0.22	-0.22	-0.22	-0.22
114	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62
115	-0.46	0.16	0.16	0.16	-0.46	0.16	-0.46	-0.46	0.16	0.16	0.16	-0.46	0.16	0.16	0.16	0.16	-0.46	-0.46	-0.46	0.16
116	0.55	0.55	0.55	0.55	0.55	0.08	0.55	0.55	0.55	0.55	0.55	0.08	0.55	0.08	0.55	0.55	0.55	0.55	0.55	0.55
#Reported_Model_Average	0.384	0.459	0.450	0.440	0.486	0.461	0.421	0.416	0.428	0.470	0.451	0.410	0.470	0.418	0.406	0.469	0.375	0.456	0.476	0.443
#Overall_Average_Reported	0.439

Output from ProsaII

ProsaII Score over a window of $winsize_s residues

JPEG image for ProsaII Score

Table of Verify3D scores for ordered residues across all models

#verify3d
#Residue\Model	1	2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20
2	0.41	0.41	0.41	0.41	0.51	0.51	0.51	0.41	0.41	0.51	0.51	0.41	0.41	0.41	0.51	0.51	0.41	0.51	0.41	0.51
3	0.56	0.56	1.10	0.56	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	0.56	1.10	1.10	0.56	1.10	0.56
4	0.29	0.62	0.29	0.62	0.62	0.62	0.62	0.29	0.29	0.62	0.62	0.29	0.62	0.62	0.62	0.62	0.29	0.29	0.29	0.62
5	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62
6	1.28	1.28	1.28	1.28	1.28	1.28	1.28	1.28	1.28	1.28	1.28	1.28	1.28	1.28	1.28	1.28	1.28	1.28	1.28	1.28
7	-0.02	-0.06	0.55	-0.06	-0.02	0.55	-0.06	0.55	-0.06	0.55	-0.02	-0.02	0.55	0.55	0.55	-0.02	0.55	-0.06	-0.02	0.55
8	0.29	0.29	0.29	0.29	0.29	0.29	0.29	0.44	0.29	0.29	0.29	0.44	0.29	0.29	0.44	0.29	0.29	0.29	0.29	0.29
9	0.86	0.50	0.50	0.50	0.86	0.86	0.86	0.86	0.86	0.86	0.86	0.86	0.50	0.86	-0.88	0.50	0.50	0.86	0.86	0.86
10	0.76	0.76	0.76	0.76	0.76	0.76	0.76	0.76	0.76	0.76	0.76	0.76	0.76	0.76	0.76	0.76	0.76	0.76	0.76	0.76
11	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62
12	0.07	0.66	0.66	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.66	0.07	0.66	0.07	0.07	0.66	0.07	0.66	0.66	0.07
13	0.56	0.66	0.66	-0.94	0.56	-0.94	0.56	0.56	0.66	0.56	0.66	0.56	0.56	0.66	-0.94	0.66	0.66	0.66	0.56	-0.94
14	1.14	0.52	1.14	1.14	1.14	1.14	0.52	1.14	0.52	0.52	0.52	1.25	0.52	1.14	0.52	1.14	1.14	0.52	0.52	1.25
15	0.23	0.23	0.23	0.23	0.51	0.23	0.23	0.23	0.23	0.23	0.23	0.23	0.51	0.23	0.23	0.23	0.23	0.23	0.23	0.23
16	0.55	0.55	0.08	0.08	0.55	0.08	0.08	0.08	0.55	0.08	0.08	0.08	0.08	0.08	0.08	0.08	0.08	0.08	0.08	0.08
17	-0.10	-0.10	0.47	0.47	-0.10	-0.10	0.47	0.47	-0.10	0.47	0.47	0.47	0.47	-0.10	-0.10	-0.10	-0.10	-0.10	-0.10	0.47
18	0.64	0.64	0.64	0.64	0.64	0.64	0.64	0.64	0.64	0.64	0.64	0.64	0.64	0.64	0.64	0.64	0.64	0.64	0.64	0.64
19	0.51	0.51	0.51	0.23	0.51	0.51	0.51	0.51	0.23	0.51	0.51	0.51	0.51	0.51	0.51	0.51	0.51	0.51	0.51	0.23
20	0.20	0.20	0.20	0.20	0.20	0.20	0.20	0.20	0.20	0.20	0.20	0.20	0.20	0.20	0.20	0.20	0.20	0.20	0.20	0.20
21	0.44	0.44	0.64	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.64	0.44	0.64	0.44	0.44	0.44	0.44	0.44	0.64
22	-0.42	-0.42	1.12	1.12	1.12	1.12	-0.42	-0.42	-0.42	1.12	1.12	-0.42	-0.42	-0.42	-0.42	1.12	-0.42	-0.42	-0.42	-0.42
23	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04
24	-0.10	-0.10	-0.10	-0.10	0.47	0.47	-0.10	-0.10	-0.10	0.47	0.47	-0.10	0.47	-0.10	0.47	-0.10	0.47	-0.10	0.47	-0.10
25	-0.84	-0.84	-1.29	-0.84	-0.84	-0.84	-0.84	-0.84	-1.29	-1.29	-1.29	-0.84	-1.29	-0.84	-1.29	-0.84	-0.84	-0.84	-0.84	-1.29
26	0.44	0.44	0.44	0.44	0.25	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44
27	0.23	0.51	0.23	0.23	0.51	0.23	0.23	0.51	0.51	0.23	0.23	0.51	0.23	0.23	0.23	0.51	0.23	0.34	0.23	0.23
28	1.14	1.14	1.14	1.25	1.14	1.14	1.14	1.14	1.14	1.14	1.14	1.14	0.52	1.14	1.14	1.25	1.14	1.14	1.14	1.14
29	0.59	0.59	0.59	0.59	0.59	0.59	0.59	0.59	0.59	0.59	0.59	0.59	0.59	0.59	0.59	0.59	0.59	0.59	0.59	0.59
30	0.44	0.44	0.71	0.44	0.71	0.44	0.44	0.44	0.44	0.44	0.44	0.16	0.71	0.44	0.44	0.71	1.18	0.44	0.44	0.16
31	1.40	1.40	1.40	1.40	1.40	1.40	1.40	1.40	1.40	1.40	1.40	1.40	1.40	1.40	1.40	1.40	1.40	1.40	1.40	1.40
32	0.71	0.24	0.71	0.71	0.71	0.24	0.24	0.24	0.71	0.71	0.24	0.24	0.71	0.24	0.24	0.24	0.24	0.24	0.71	0.24
33	0.54	0.54	0.54	0.54	1.04	1.04	0.54	0.54	0.54	0.54	0.54	1.04	1.04	0.54	1.04	0.54	0.54	1.04	0.54	1.04
34	0.34	0.34	0.34	0.34	0.34	0.34	0.34	0.34	0.34	0.34	0.34	0.34	0.34	0.34	0.34	0.34	0.34	0.34	0.34	0.34
35	0.23	0.23	0.23	0.23	0.51	0.23	0.23	0.23	0.23	0.23	0.23	0.51	0.23	0.23	0.51	0.23	0.23	0.23	0.23	0.23
36	-0.26	-0.26	-0.26	-0.26	-0.26	-0.26	-0.26	-0.26	-0.26	-0.26	-0.26	-0.56	-0.26	-0.26	-0.26	-0.26	-2.61	-0.26	0.51	-0.26
40	-0.43	1.25	-0.43	-0.43	-0.43	-0.43	1.25	1.14	-0.43	-0.43	1.25	-0.43	1.14	-0.43	-0.43	1.14	-0.43	-0.43	-0.43	1.25
41	-0.25	0.49	0.49	0.49	-0.25	0.49	-0.25	0.49	0.49	-0.25	0.49	0.49	0.49	-0.25	0.49	0.49	0.49	0.49	0.49	-0.25
42	-0.81	-0.81	0.36	-0.81	0.36	-0.81	0.36	0.14	-0.81	0.36	0.14	-0.81	0.36	-1.33	0.36	0.36	-0.81	0.36	0.14	-0.81
43	0.36	1.07	1.07	1.07	1.07	0.36	0.36	1.07	1.07	1.07	1.07	1.07	1.07	0.36	1.07	1.07	1.07	1.07	1.07	1.07
44	0.51	0.49	0.49	0.49	-0.68	0.51	0.51	0.49	0.49	0.51	0.49	-0.68	0.49	0.49	0.51	0.49	-0.68	0.49	0.49	0.49
45	-0.03	-0.03	-0.03	-0.03	-0.03	-0.03	-0.03	-0.03	-0.03	-0.03	-0.03	-0.03	-0.03	-0.03	-0.03	-0.03	-0.03	-0.03	-0.03	-0.03
46	1.07	1.07	1.07	1.07	1.50	1.50	1.50	1.07	1.07	1.07	1.07	1.07	1.50	1.50	1.50	1.07	1.50	1.50	1.50	1.07
47	-1.01	-0.65	-1.01	-0.65	-0.65	-0.65	-1.01	-0.65	-1.01	-0.65	-0.65	-0.65	-0.65	-1.01	-0.65	-0.65	-1.01	-0.65	-0.65	-1.01
48	0.49	0.49	0.49	0.49	0.49	0.49	0.49	0.49	0.49	0.49	0.49	0.49	0.49	0.49	0.49	0.49	0.49	0.49	0.49	0.49
49	0.28	0.28	0.28	0.28	0.28	0.28	0.28	0.28	0.28	0.28	0.28	0.28	0.28	0.28	0.28	0.28	0.28	0.28	0.28	0.28
50	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	-0.72	0.47	0.47	0.47
51	0.93	0.93	0.93	0.93	0.93	0.93	0.93	0.93	0.93	0.93	0.93	0.93	0.93	0.93	0.93	0.93	0.93	0.93	0.93	0.93
52	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10
53	-0.28	-0.28	-0.94	-0.94	-0.28	-0.94	-0.94	-0.94	-0.94	-0.28	-0.28	-0.28	-0.28	-0.54	-0.94	-0.94	-0.28	-0.94	-0.94	-0.94
57	0.47	0.47	0.47	0.47	0.47	-0.10	0.47	-0.10	-0.10	0.47	0.47	0.47	0.47	0.47	-0.10	-0.10	0.47	0.47	-0.10	0.47
58	-1.12	0.19	0.19	0.19	0.19	0.19	0.19	0.19	0.19	0.19	-1.12	0.19	0.19	0.19	-1.12	0.19	0.19	-1.12	0.19	0.19
59	1.18	0.71	1.18	0.71	0.71	0.71	1.18	1.18	0.71	0.71	1.18	1.18	1.18	0.71	0.44	0.44	1.18	0.71	0.71	0.71
60	-0.61	-0.61	-0.03	-0.03	-0.03	-0.61	-0.61	-0.61	-0.03	-0.03	-0.61	-0.61	-0.61	-0.61	-0.03	-0.03	-0.03	-0.03	-0.03	-0.61
61	1.18	1.18	1.18	0.71	1.18	1.18	1.18	0.71	0.71	1.18	0.71	1.18	1.18	1.18	1.18	1.18	1.18	1.18	1.18	1.18
62	1.50	1.50	1.50	1.50	1.50	1.50	1.50	1.50	1.50	1.50	1.50	1.50	1.50	1.50	1.50	1.50	1.50	1.50	1.50	1.50
63	-0.61	-0.61	-0.61	-0.61	-0.61	-0.61	-0.61	-0.61	-0.61	-1.80	-0.61	-0.61	-1.80	-0.61	-0.61	-0.61	-0.61	-0.61	-0.61	-0.61
64	0.36	1.07	0.36	1.07	1.07	1.07	1.07	0.36	1.07	0.36	0.36	0.36	0.36	0.36	1.07	0.36	1.07	1.07	1.07	0.36
65	0.35	0.35	-2.01	0.35	0.35	0.35	-0.83	0.35	0.55	0.35	0.35	-0.83	0.35	0.35	0.35	0.35	0.35	0.35	0.35	0.35
66	0.66	0.66	0.66	1.00	0.66	0.66	0.66	0.66	0.66	0.66	1.00	0.66	0.66	0.66	0.66	0.66	0.66	0.66	0.66	0.66
67	-0.57	-0.57	-0.57	-0.57	-0.57	-0.57	-0.57	-0.57	-0.57	-0.57	-0.57	-0.57	-0.57	-0.57	-0.57	-0.57	-0.57	-0.57	-0.57	-0.57
68	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.25	0.25	0.44	0.44	0.25	0.44	0.44	0.25	0.44	0.25	0.44	0.25
69	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.28	0.04	0.04	0.04	0.04	0.04	0.04	0.04	0.04
70	-0.68	-0.68	-0.68	-0.68	-0.68	-0.68	-0.68	-0.68	-0.68	-0.68	-0.68	-0.68	-0.68	-0.68	-0.68	-0.68	-0.68	-0.68	-0.68	-0.68
71	0.30	0.30	0.30	0.30	0.30	0.30	-0.62	-0.62	0.30	0.30	0.30	-0.29	0.30	0.30	0.30	0.30	0.30	0.30	0.30	0.30
72	0.63	0.63	0.63	0.63	0.63	0.63	0.63	0.63	0.63	0.63	0.63	0.63	0.63	0.63	0.63	0.63	0.63	0.63	0.63	0.63
73	0.16	0.16	0.16	0.16	0.16	0.16	-0.38	0.16	0.16	0.16	0.16	0.16	0.16	-0.38	0.16	0.16	0.47	0.16	0.16	0.16
74	1.30	1.30	1.30	1.30	1.30	1.30	1.30	1.30	1.30	1.30	1.30	1.30	1.30	1.30	1.30	1.30	1.30	1.30	1.30	1.30
75	1.10	1.10	1.10	1.10	-0.51	1.10	-0.11	-1.80	1.10	1.10	1.10	1.10	-0.51	1.10	-0.51	-0.11	-0.51	1.10	1.10	1.10
76	0.66	0.66	0.66	0.66	0.66	0.66	0.66	0.66	0.66	0.66	0.07	0.66	0.66	0.66	0.66	0.66	0.66	0.66	0.66	0.66
77	-2.12	-0.72	-0.72	0.08	0.47	0.08	-0.72	0.47	-2.12	0.47	0.08	0.08	0.47	-0.72	0.47	0.08	-2.12	0.08	0.08	0.47
78	0.25	0.25	0.25	0.25	0.25	0.25	0.25	0.25	0.25	0.25	0.25	0.25	0.25	0.25	0.25	0.25	0.25	0.25	0.25	0.25
79	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10
80	1.50	1.07	1.07	1.50	1.50	1.50	1.50	1.07	1.50	1.50	1.50	1.50	1.07	1.50	1.50	1.50	1.07	1.50	1.50	1.50
81	1.09	1.09	1.30	-0.30	1.09	1.09	1.09	1.09	1.09	1.09	-0.30	1.09	1.09	1.09	1.09	1.09	1.09	1.09	1.09	1.09
82	-1.01	-0.65	-0.65	-1.01	-1.01	-0.65	-0.65	-0.65	-0.65	-0.65	-0.65	-1.01	-1.01	-1.01	-1.01	-1.01	-1.01	-0.65	-0.65	-0.65
83	-0.25	0.49	0.49	0.49	-0.25	0.49	-0.25	0.49	-0.25	0.49	0.49	-0.25	-0.25	0.49	-0.25	-0.25	-0.25	-0.25	-0.25	0.49
90	0.20	0.20	0.20	0.20	0.20	1.04	1.04	0.20	0.20	0.20	0.20	0.20	0.20	0.20	1.04	0.20	0.20	0.20	0.20	0.20
91	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07
92	1.50	1.50	1.07	1.50	1.50	1.07	1.50	0.26	1.50	1.07	1.07	1.07	1.50	1.50	1.50	1.07	1.50	1.50	1.50	1.50
93	0.95	0.95	0.95	0.95	0.95	0.95	0.95	0.95	0.95	0.95	0.95	0.95	0.95	0.95	0.95	0.95	0.95	0.95	0.95	0.95
94	1.18	1.18	1.18	1.18	1.18	1.18	1.18	1.18	1.18	1.18	1.18	1.18	1.18	1.18	1.18	1.18	1.18	1.18	1.18	1.18
95	1.07	1.07	1.07	1.07	1.07	1.07	1.07	1.07	1.07	1.07	1.07	1.07	1.07	1.07	1.07	1.07	1.07	1.07	1.07	1.07
96	1.06	0.77	1.06	1.06	1.06	1.06	0.77	1.06	1.06	1.06	1.06	1.06	1.06	1.06	1.06	1.06	1.06	1.06	1.06	1.06
97	0.51	0.51	0.41	0.41	0.51	0.51	0.51	0.51	0.51	0.41	0.51	0.51	0.41	0.51	0.51	0.51	0.51	0.51	0.41	0.41
98	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10
99	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44
101	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10	1.10
102	0.44	0.76	0.76	0.44	0.76	0.44	0.76	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.44	0.76	0.44
103	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.66	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07	0.07
104	-0.43	-0.43	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.09	0.62	0.62	0.62	0.62	0.62	0.62	0.62	-0.43
105	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11
106	0.82	0.82	0.82	0.82	0.82	0.82	0.82	0.17	0.82	0.82	-0.91	0.17	0.82	0.82	-0.91	0.82	-0.34	0.82	0.82	0.82
107	0.16	0.16	0.16	0.16	0.16	0.16	0.16	0.16	0.16	0.16	0.16	0.16	0.16	0.16	0.16	0.16	0.16	0.16	0.16	0.16
108	0.71	0.71	0.71	1.30	1.30	1.30	0.71	-0.30	1.30	-0.30	1.30	0.71	0.71	1.30	1.30	1.30	0.71	1.30	0.71	1.30
109	1.11	1.11	0.55	1.11	1.11	1.11	0.55	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11	1.11
110	0.62	0.62	0.62	0.62	0.62	0.60	0.62	0.62	0.62	0.62	0.60	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62
111	0.29	0.44	0.44	0.44	-0.28	0.29	0.29	0.29	-0.28	0.29	0.29	0.29	0.44	0.29	0.29	0.44	0.29	0.29	0.44	0.29
112	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47	0.47
113	-0.22	-0.22	-1.35	-1.35	-0.22	-1.35	-0.22	-0.22	0.87	-0.22	-1.35	-0.22	-0.22	-1.35	-0.22	-1.35	-0.22	-0.22	-0.22	-0.22
114	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62	0.62
115	-0.46	0.16	0.16	0.16	-0.46	0.16	-0.46	-0.46	0.16	0.16	0.16	-0.46	0.16	0.16	0.16	0.16	-0.46	-0.46	-0.46	0.16
116	0.55	0.55	0.55	0.55	0.55	0.08	0.55	0.55	0.55	0.55	0.55	0.08	0.55	0.08	0.55	0.55	0.55	0.55	0.55	0.55
#Reported_Model_Average	0.384	0.459	0.450	0.440	0.486	0.461	0.421	0.416	0.428	0.470	0.451	0.410	0.470	0.418	0.406	0.469	0.375	0.456	0.476	0.443
#Overall_Average_Reported	0.439

Output from MolProbity

VdW violations from MAGE

JPEG image for MAGE VdW violation

Table of MAGE VdW violations for ordered residues across all models

#mage_clash
#Residue\Model	1	2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20
2.000	0	0	0	0	0	2	0	0	1	0	0	0	0	0	0	0	1	1	1	2
3.000	0	0	0	1	0	2	0	0	0	1	0	0	0	4	1	0	1	3	3	0
4.000	0	2	0	0	0	3	1	2	0	0	0	2	0	1	0	0	0	0	0	0
5.000	0	0	0	2	0	2	0	0	0	0	0	0	0	0	4	0	0	1	0	0
6.000	0	0	0	0	1	3	0	1	0	0	0	1	2	0	1	0	0	1	0	0
7.000	0	0	0	0	0	0	0	0	2	0	0	0	0	0	0	0	0	0	0	0
8.000	0	2	3	0	0	1	1	0	0	0	0	0	0	0	0	0	0	0	4	0
9.000	0	1	1	0	0	0	2	0	1	4	1	0	0	3	0	0	0	0	4	2
10.000	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
11.000	0	2	3	1	0	1	2	1	3	3	2	2	2	3	1	2	1	0	1	2
12.000	0	0	3	0	0	0	0	0	0	0	0	0	1	0	0	0	0	0	0	0
13.000	0	1	1	0	0	0	0	0	0	1	1	0	0	0	0	0	0	0	0	0
14.000	4	2	2	2	3	0	1	1	2	2	0	3	5	3	9	0	2	0	5	0
15.000	3	1	3	0	7	1	2	1	3	2	2	5	4	3	4	2	1	0	4	2
16.000	1	1	0	1	0	0	0	0	3	1	0	0	2	0	2	0	0	0	0	0
17.000	0	0	0	2	0	0	2	0	2	0	0	0	0	0	2	0	0	0	0	0
18.000	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
19.000	0	0	1	0	1	2	0	0	1	0	0	0	0	0	1	1	0	0	0	0
20.000	0	2	1	0	1	2	0	2	3	0	2	2	2	2	4	1	2	2	4	0
21.000	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
22.000	0	0	0	0	0	3	0	0	0	2	0	0	0	0	0	3	0	0	0	0
23.000	2	2	3	1	0	0	0	0	0	0	4	0	0	0	0	1	0	0	0	2
24.000	0	0	1	1	3	1	0	0	0	0	0	0	0	0	0	1	0	0	3	0
25.000	2	0	2	0	3	0	0	0	0	0	0	0	0	0	0	1	0	0	3	0
26.000	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
27.000	0	0	0	0	0	1	0	2	0	0	0	2	0	0	0	2	0	2	0	0
28.000	0	0	0	0	2	0	1	1	0	1	0	1	1	0	1	1	0	1	1	0
29.000	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0
30.000	0	0	0	0	2	0	0	0	0	0	0	1	3	0	0	0	0	0	0	0
31.000	0	0	1	0	1	0	0	0	3	0	0	0	0	0	0	0	0	1	0	0
32.000	0	0	0	1	2	0	1	0	0	0	0	2	5	0	0	0	0	0	1	0
33.000	1	5	3	1	1	1	2	2	1	2	0	1	2	3	0	0	2	0	3	1
34.000	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
35.000	0	0	0	0	1	0	0	0	2	0	2	0	0	3	2	0	0	0	0	0
36.000	4	4	1	4	4	4	5	1	4	0	3	2	4	3	5	5	5	0	3	2
40.000	3	0	0	0	0	3	0	1	0	2	0	3	0	0	0	0	0	0	0	0
41.000	0	0	3	0	2	2	0	1	1	0	0	1	0	0	0	1	0	1	1	0
42.000	2	0	0	0	3	2	5	0	0	2	0	4	0	2	0	0	0	1	4	2
43.000	4	0	4	0	0	6	1	6	5	5	5	1	3	5	4	5	2	4	5	5
44.000	1	4	2	0	2	0	1	2	1	7	1	1	2	0	1	5	0	2	3	1
45.000	1	1	1	2	1	1	0	1	2	2	2	2	0	0	2	1	2	3	4	5
46.000	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	3
47.000	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
48.000	2	1	0	0	0	2	1	2	1	0	2	0	0	0	0	2	1	0	0	1
49.000	0	0	0	0	1	1	0	0	0	0	0	0	1	2	0	0	1	1	0	0
50.000	0	0	0	0	0	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0
51.000	2	2	2	2	2	1	3	3	4	2	1	2	2	1	1	1	2	2	0	1
52.000	0	0	0	0	0	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0
53.000	2	1	0	2	3	3	3	4	4	4	3	2	3	3	1	4	3	4	0	2
57.000	1	0	3	1	0	1	0	1	0	0	0	0	0	0	0	1	1	0	0	0
58.000	0	1	0	0	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0
59.000	0	0	0	0	0	1	0	2	2	1	0	0	0	0	0	0	0	0	0	0
60.000	2	0	1	1	1	0	0	2	0	1	2	1	0	3	3	1	3	0	1	0
61.000	0	0	0	0	0	0	0	0	1	1	0	0	0	0	0	0	0	0	0	0
62.000	0	0	0	0	1	0	0	0	0	0	1	0	2	0	0	0	0	1	1	0
63.000	3	2	1	3	0	0	0	1	0	0	0	0	0	2	1	0	0	0	1	0
64.000	7	0	5	6	5	4	0	2	1	4	5	5	5	5	1	6	0	0	7	5
65.000	1	0	2	1	1	1	0	2	0	2	1	1	1	1	0	2	0	0	1	1
66.000	2	0	0	0	2	0	2	0	0	0	1	0	0	0	0	0	1	0	1	0
67.000	0	1	0	0	0	0	0	0	0	1	0	0	1	2	1	0	0	1	0	1
68.000	1	1	1	1	1	0	1	1	1	1	2	1	1	1	1	1	1	1	1	1
69.000	0	0	0	0	0	0	0	0	0	0	2	2	0	0	0	0	0	0	0	0
70.000	0	0	0	0	0	0	0	0	0	1	0	0	0	1	0	0	0	1	0	1
71.000	3	1	3	3	2	1	3	3	3	3	4	3	3	1	1	2	2	1	5	3
72.000	2	0	1	2	1	1	3	1	2	3	2	2	3	0	0	1	1	0	2	3
73.000	0	0	0	0	0	0	0	2	0	0	0	0	0	2	0	0	1	1	0	0
74.000	2	6	1	1	9	1	2	7	6	0	2	1	2	9	6	2	6	6	3	0
75.000	1	0	1	0	2	0	0	10	0	1	0	0	0	1	0	4	0	0	0	3
76.000	0	0	0	0	0	0	1	2	0	1	0	0	1	1	0	0	1	1	0	1
77.000	0	0	0	1	0	2	0	0	1	0	1	0	0	0	0	0	2	7	2	1
78.000	0	2	0	0	0	1	2	0	0	2	0	0	0	0	0	1	0	1	0	0
79.000	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
80.000	0	6	4	1	0	3	10	3	0	7	2	0	0	0	4	0	6	2	0	0
81.000	1	1	2	1	0	0	1	3	0	1	0	0	1	2	0	0	0	0	0	0
82.000	3	1	1	1	3	0	1	0	0	1	0	0	1	2	0	0	0	0	0	0
83.000	0	3	0	2	0	0	0	0	0	0	0	0	1	0	0	0	0	1	0	1
90.000	1	0	0	0	0	0	0	0	2	0	3	0	0	0	0	0	0	0	0	0
91.000	0	2	2	2	1	1	1	4	0	0	2	0	0	2	0	0	0	2	0	1
92.000	1	0	1	1	1	0	3	6	0	2	3	0	1	0	0	4	1	0	3	0
93.000	0	0	0	1	0	0	1	1	0	1	1	0	2	0	0	0	0	0	0	0
94.000	0	0	0	0	0	0	0	0	1	0	1	0	0	0	0	0	0	0	0	0
95.000	0	0	0	0	0	1	0	1	2	1	0	0	0	0	0	0	0	0	0	0
96.000	1	0	0	0	0	0	0	0	0	0	1	0	0	0	1	1	1	2	1	0
97.000	0	0	0	0	0	0	0	2	1	0	2	1	0	0	2	0	2	0	0	0
98.000	1	0	0	0	0	1	0	0	0	0	0	0	0	0	1	1	1	0	0	0
99.000	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0	0	0	1	0	1
101.000	0	0	0	0	1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
102.000	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0
103.000	0	0	2	0	0	0	0	1	0	0	0	0	0	0	0	0	0	0	1	0
104.000	0	0	0	0	3	0	0	1	0	0	0	0	0	0	0	0	0	0	1	0
105.000	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2	1	0
106.000	0	0	0	0	0	0	2	0	1	4	0	0	0	0	0	1	0	0	2	2
107.000	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
108.000	0	0	1	1	0	1	0	0	1	0	1	1	1	0	0	1	0	0	3	0
109.000	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0	0	0	0	0	0
110.000	0	0	0	0	2	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
111.000	0	0	0	0	0	1	0	0	0	0	0	0	0	0	0	0	0	1	0	0
112.000	0	0	0	0	0	1	0	0	0	0	1	0	0	0	0	1	0	0	4	0
113.000	0	0	1	0	0	0	0	0	3	0	0	1	1	0	0	0	2	0	0	0
114.000	0	0	0	0	0	1	0	0	0	0	0	0	0	0	0	0	0	2	0	0
115.000	4	1	0	0	4	0	4	4	0	0	0	4	1	1	1	0	4	1	4	0
116.000	2	0	2	2	0	4	2	1	0	1	1	1	1	0	0	2	0	0	1	0
#Reported_Model_Average	0.716	0.618	0.745	0.539	0.843	0.765	0.716	0.951	0.775	0.833	0.716	0.627	0.716	0.765	0.676	0.716	0.608	0.647	1.010	0.569
#Overall_Average_Reported	0.728

List of bad contacts calculated by MAGE for model $num_n

/farm/software/bin/probe

:  2060:A  66 VAL 3HG1 :A  64 LEU 2HD1 :   -0.670:        0
:  2060:A  65 LYS  N   :A  64 LEU 3HD1 :   -0.650:        0
:  2060:A  74 LEU 3HD1 :A  66 VAL 1HG1 :   -0.552:        0
:  2060:A  74 LEU  CD2 :A  92 ILE 1HG2 :   -0.519:        0
:  2060:A  64 LEU  N   :A  63 ASP  OD1 :   -0.488:        0
:  2060:A  64 LEU  C   :A  64 LEU 3HD1 :   -0.466:        0
:  2060:A  64 LEU  CD1 :A  64 LEU  C   :   -0.441:        0
:  2060:A  63 ASP  OD1 :A  63 ASP  C   :   -0.415:        0

:  2060:A 120 HIS  ND1 :A 120 HIS  N   :   -0.642:        0
:  2060:A 120 HIS  ND1 :A 121 HIS  N   :   -0.416:        0

:  2060:A  43 LEU 1HD2 :A  60 ASP  OD1 :   -0.636:        0
:  2060:A  43 LEU  C   :A  43 LEU 3HD2 :   -0.581:        0
:  2060:A  60 ASP  OD1 :A  45 ASP  OD1 :   -0.413:        0
:  2060:A  43 LEU 3HD2 :A  44 MET  N   :   -0.402:        0

:  2060:A  82 PRO  CB  :A  88 LYS 1HZ  :   -0.613:        0
:  2060:A  88 LYS  NZ  :A  82 PRO  CB  :   -0.473:        0
:  2060:A  88 LYS 1HZ  :A  82 PRO  CG  :   -0.437:        0
:  2060:A  88 LYS  CE  :A  75 ARG  CZ  :   -0.403:        0

:  2060:A 115 LEU  N   :A 115 LEU 2HD1 :   -0.574:        0
:  2060:A 115 LEU  N   :A 115 LEU  CD1 :   -0.461:        0

:  2060:A 118 LEU  N   :A 118 LEU 2HD1 :   -0.563:        0
:  2060:A 118 LEU  N   :A 118 LEU  CD1 :   -0.478:        0

:  2060:A  48 ALA 2HB  :A  57 LYS  O   :   -0.552:        0
:  2060:A  48 ALA 3HB  :A  55 GLY  O   :   -0.520:        0
:  2060:A  51 ILE  O   :A  81 TYR  CD1 :   -0.493:        0
:  2060:A  53 ILE 2HD1 :A  51 ILE  CD1 :   -0.475:        0
:  2060:A  53 ILE 2HG2 :A  55 GLY  H   :   -0.472:        0

:  2060:A  38 LYS  CB  :A  37 ASP  O   :   -0.549:        0
:  2060:A  38 LYS  C   :A  39 TRP  CG  :   -0.544:        0
:  2060:A  36 ASN  ND2 :A 116 THR  O   :   -0.534:        0
:  2060:A  33 HIS  O   :A  39 TRP  NE1 :   -0.533:        0
:  2060:A  37 ASP  OD1 :A  38 LYS  N   :   -0.529:        0
:  2060:A  40 TYR  CG  :A  39 TRP  O   :   -0.511:        0
:  2060:A  39 TRP  O   :A  40 TYR  CD2 :   -0.464:        0
:  2060:A  36 ASN  O   :A  37 ASP  O   :   -0.461:        0
:  2060:A 117 ARG  O   :A  36 ASN  ND2 :   -0.452:        0
:  2060:A 116 THR  C   :A  36 ASN  ND2 :   -0.428:        0
:  2060:A  39 TRP  CD2 :A  39 TRP  N   :   -0.419:        0
:  2060:A  37 ASP  C   :A  37 ASP  OD1 :   -0.418:        0
:  2060:A  40 TYR  CD2 :A  39 TRP  C   :   -0.407:        0

:  2060:A  85 HIS  CE1 :A  84 TYR  CZ  :   -0.520:        0

:  2060:A  72 GLY  N   :A  71 VAL 3HG1 :   -0.515:        0
:  2060:A  71 VAL 2HG1 :A  68 PRO  O   :   -0.441:        0
:  2060:A  72 GLY  N   :A  71 VAL  CG1 :   -0.435:        0

:  2060:A 100 LEU  CD2 :A 100 LEU  N   :   -0.489:        0
:  2060:A 100 LEU 2HD2 :A 100 LEU  N   :   -0.468:        0

:  2060:A  14 TYR  O   :A  15 ASP  C   :   -0.475:        0
:  2060:A  15 ASP  OD1 :A  14 TYR  O   :   -0.430:        0
:  2060:A  14 TYR  C   :A  15 ASP  CG  :   -0.421:        0
:  2060:A  16 THR  N   :A  14 TYR  O   :   -0.418:        0

:  2060:A  25 PHE  H   :A  23 GLU  C   :   -0.464:        0
:  2060:A  23 GLU  C   :A  25 PHE  N   :   -0.402:        0

:  2060:A  96 LEU  C   :A  98 GLY  H   :   -0.442:        0

:  2060:A  90 HIS  N   :A  89 GLU  CG  :   -0.410:        0

:  2060:A  42 LEU  N   :A  42 LEU 3HD2 :   -0.407:        0
#sum2 ::26.70 clashscore : 26.70 clashscore B<40 
#summary::2060 atoms:2060 atoms B<40:229608 potential dots:14350.0 A^2:55 bumps:55 bumps B<40:420.5 score

List of bad contacts calculated by MAGE for model $num_n

/farm/software/bin/probe

:  2060:A  74 LEU  H   :A  74 LEU 3HD2 :   -0.827:        0
:  2060:A  74 LEU  H   :A  74 LEU  CD2 :   -0.649:        0
:  2060:A  74 LEU 3HD2 :A  74 LEU  N   :   -0.583:        0

:  2060:A  80 ILE  N   :A  80 ILE 2HD1 :   -0.752:        0
:  2060:A  80 ILE  N   :A  80 ILE  CD1 :   -0.556:        0
:  2060:A  80 ILE  CD1 :A  78 PRO  O   :   -0.429:        0
:  2060:A  78 PRO  O   :A  80 ILE 2HD1 :   -0.407:        0

:  2060:A  33 HIS  N   :A  39 TRP  HE1 :   -0.675:        0
:  2060:A  39 TRP  NE1 :A  33 HIS  ND1 :   -0.628:        0
:  2060:A  33 HIS  ND1 :A  39 TRP  CD1 :   -0.610:        0
:  2060:A  33 HIS  CG  :A  39 TRP  NE1 :   -0.478:        0
:  2060:A  39 TRP  O   :A  39 TRP  CG  :   -0.444:        0
:  2060:A  14 TYR  CD1 :A  33 HIS  NE2 :   -0.411:        0
:  2060:A  10 ALA  O   :A  14 TYR  N   :   -0.404:        0

:  2060:A   4 GLN 1HE2 :A   8 ASP  CG  :   -0.590:        0
:  2060:A   4 GLN  OE1 :A   8 ASP  OD2 :   -0.401:        0

:  2060:A  38 LYS  N   :A  36 ASN  O   :   -0.589:        0
:  2060:A  36 ASN  N   :A  36 ASN  OD1 :   -0.457:        0
:  2060:A  36 ASN  ND2 :A 118 LEU 1HB  :   -0.415:        0

:  2060:A  83 ALA  O   :A  85 HIS  N   :   -0.574:        0
:  2060:A  83 ALA 3HB  :A  88 LYS  H   :   -0.501:        0
:  2060:A  84 TYR  N   :A  82 PRO  O   :   -0.501:        0
:  2060:A  83 ALA  C   :A  84 TYR  CG  :   -0.486:        0
:  2060:A  88 LYS  O   :A  89 GLU  CB  :   -0.461:        0
:  2060:A  88 LYS  O   :A  87 ASN  O   :   -0.434:        0
:  2060:A  84 TYR  CD1 :A  84 TYR  N   :   -0.427:        0
:  2060:A  87 ASN  CG  :A  91 TRP  CE3 :   -0.414:        0
:  2060:A  87 ASN  ND2 :A  91 TRP  CZ3 :   -0.401:        0

:  2060:A  11 GLN  O   :A  15 ASP  N   :   -0.567:        0
:  2060:A  16 THR  O   :A  11 GLN  NE2 :   -0.533:        0

:  2060:A 120 HIS  ND1 :A 120 HIS  N   :   -0.564:        0

:  2060:A  63 ASP  N   :A  63 ASP  OD1 :   -0.546:        0

:  2060:A  71 VAL 2HG1 :A  68 PRO  O   :   -0.512:        0

:  2060:A  45 ASP  OD2 :A  58 ARG  NH1 :   -0.510:        0

:  2060:A 115 LEU 2HD2 :A  67 GLN  CD  :   -0.495:        0

:  2060:A  51 ILE  O   :A  81 TYR  CD1 :   -0.481:        0
:  2060:A  53 ILE 2HD1 :A  51 ILE  CD1 :   -0.446:        0

:  2060:A  44 MET  SD  :A  44 MET  O   :   -0.468:        0
:  2060:A  44 MET  SD  :A  44 MET  C   :   -0.453:        0

:  2060:A   9 TYR  OH  :A  13 LYS  NZ  :   -0.462:        0

:  2060:A  23 GLU  OE1 :A  23 GLU  C   :   -0.442:        0

:  2060:A  48 ALA 3HB  :A  55 GLY  O   :   -0.425:        0

:  2060:A  20 HIS  O   :A  20 HIS  CD2 :   -0.424:        0

:  2060:A 124 HIS  O   :A 125 HIS  CG  :   -0.423:        0

:  2060:A  37 ASP  OD1 :A  37 ASP  O   :   -0.412:        0
#sum2 ::21.84 clashscore : 21.84 clashscore B<40 
#summary::2060 atoms:2060 atoms B<40:229624 potential dots:14350.0 A^2:45 bumps:45 bumps B<40:426.1 score

List of bad contacts calculated by MAGE for model $num_n

/farm/software/bin/probe

:  2060:A  80 ILE  N   :A  80 ILE 2HD1 :   -0.730:        0
:  2060:A  80 ILE  N   :A  80 ILE  CD1 :   -0.586:        0

:  2060:A  23 GLU  CD  :A  23 GLU  H   :   -0.692:        0
:  2060:A  24 LYS  C   :A  25 PHE  CD1 :   -0.465:        0
:  2060:A  25 PHE  H   :A  23 GLU  C   :   -0.424:        0

:  2060:A  43 LEU  C   :A  43 LEU 3HD2 :   -0.687:        0
:  2060:A  43 LEU  CD2 :A  43 LEU  C   :   -0.491:        0

:  2060:A  39 TRP  CZ3 :A  41 ALA 2HB  :   -0.677:        0
:  2060:A  39 TRP  NE1 :A  33 HIS  CD2 :   -0.619:        0
:  2060:A  41 ALA 2HB  :A  39 TRP  CH2 :   -0.603:        0
:  2060:A  31 PHE  O   :A  41 ALA 3HB  :   -0.541:        0
:  2060:A  33 HIS  CE1 :A  14 TYR  CG  :   -0.496:        0
:  2060:A  14 TYR  CD1 :A  33 HIS  CE1 :   -0.480:        0

:  2060:A  87 ASN  C   :A  89 GLU  H   :   -0.657:        0
:  2060:A  87 ASN  ND2 :A  91 TRP  CE3 :   -0.609:        0
:  2060:A  91 TRP  CZ3 :A  87 ASN  ND2 :   -0.547:        0
:  2060:A  89 GLU  N   :A  87 ASN  O   :   -0.496:        0
:  2060:A  87 ASN  C   :A  89 GLU  N   :   -0.475:        0

:  2060:A  65 LYS  N   :A  64 LEU 3HD1 :   -0.638:        0
:  2060:A  64 LEU  N   :A  63 ASP  OD1 :   -0.529:        0
:  2060:A  64 LEU  C   :A  64 LEU  CD1 :   -0.411:        0
:  2060:A  64 LEU 3HD1 :A  65 LYS  H   :   -0.402:        0

:  2060:A 108 LEU 2HD2 :A  74 LEU 2HD1 :   -0.577:        0

:  2060:A  92 ILE 1HD1 :A  71 VAL 3HG2 :   -0.573:        0
:  2060:A  72 GLY  N   :A  71 VAL 3HG1 :   -0.454:        0
:  2060:A  71 VAL 2HG1 :A  68 PRO  O   :   -0.434:        0

:  2060:A 120 HIS  ND1 :A 121 HIS  N   :   -0.562:        0
:  2060:A 122 HIS  H   :A 120 HIS  C   :   -0.538:        0
:  2060:A 120 HIS  CG  :A 121 HIS  N   :   -0.517:        0
:  2060:A 120 HIS  C   :A 122 HIS  N   :   -0.400:        0

:  2060:A  11 GLN  O   :A  15 ASP  N   :   -0.560:        0
:  2060:A  11 GLN  O   :A  15 ASP  CA  :   -0.429:        0
:  2060:A  15 ASP  H   :A  11 GLN  C   :   -0.416:        0

:  2060:A  57 LYS  N   :A  55 GLY  O   :   -0.535:        0
:  2060:A  55 GLY  C   :A  57 LYS  N   :   -0.497:        0
:  2060:A  56 ASP  CG  :A  55 GLY  O   :   -0.445:        0
:  2060:A  55 GLY  C   :A  56 ASP  OD1 :   -0.424:        0
:  2060:A  55 GLY  O   :A  56 ASP  C   :   -0.417:        0
:  2060:A  55 GLY  C   :A  57 LYS  H   :   -0.416:        0

:  2060:A   8 ASP  OD2 :A  12 LYS  NZ  :   -0.495:        0
:  2060:A  12 LYS  NZ  :A   8 ASP  CG  :   -0.456:        0
:  2060:A  12 LYS 2HZ  :A   8 ASP  CG  :   -0.400:        0

:  2060:A 119 GLU  H   :A 117 ARG 1HG  :   -0.489:        0
:  2060:A 113 PHE  O   :A 117 ARG  N   :   -0.456:        0
:  2060:A  36 ASN  ND2 :A 116 THR  O   :   -0.442:        0
:  2060:A 116 THR  O   :A 117 ARG  C   :   -0.440:        0

:  2060:A  85 HIS  CE1 :A  84 TYR  CE1 :   -0.485:        0

:  2060:A  13 LYS  NZ  :A   9 TYR  OH  :   -0.472:        0

:  2060:A  51 ILE  O   :A  81 TYR  CD1 :   -0.471:        0
:  2060:A  81 TYR  CE1 :A  51 ILE  O   :   -0.437:        0

:  2060:A  44 MET  SD  :A  44 MET  C   :   -0.447:        0

:  2060:A  37 ASP  O   :A  38 LYS  O   :   -0.446:        0

:  2060:A 103 LYS 1HD  :A 103 LYS  N   :   -0.417:        0

:  2060:A  45 ASP  OD1 :A  60 ASP  OD1 :   -0.402:        0

:  2060:A  19 ASP  C   :A  20 HIS  CD2 :   -0.400:        0

:  2060:A  75 ARG  HE  :A  82 PRO 2HB  :   -0.400:        0
#sum2 ::27.18 clashscore : 27.18 clashscore B<40 
#summary::2060 atoms:2060 atoms B<40:229458 potential dots:14340.0 A^2:56 bumps:56 bumps B<40:399.8 score

List of bad contacts calculated by MAGE for model $num_n

/farm/software/bin/probe

:  2060:A  14 TYR  CD1 :A  14 TYR  N   :   -0.607:        0

:  2060:A  65 LYS  N   :A  64 LEU 3HD1 :   -0.597:        0
:  2060:A  64 LEU  N   :A  63 ASP  OD1 :   -0.488:        0
:  2060:A  64 LEU  CD1 :A  64 LEU  C   :   -0.438:        0
:  2060:A  63 ASP  OD1 :A  63 ASP  C   :   -0.425:        0
:  2060:A  64 LEU 3HD1 :A  64 LEU  C   :   -0.420:        0

:  2060:A 108 LEU 2HD2 :A  74 LEU 2HD1 :   -0.553:        0

:  2060:A  91 TRP  CZ3 :A  87 ASN  ND2 :   -0.546:        0
:  2060:A  87 ASN  ND2 :A  91 TRP  CH2 :   -0.542:        0

:  2060:A  16 THR  O   :A  11 GLN  NE2 :   -0.537:        0

:  2060:A  53 ILE 2HD1 :A  51 ILE  CD1 :   -0.525:        0
:  2060:A  53 ILE 2HD1 :A  51 ILE 2HD1 :   -0.481:        0

:  2060:A  71 VAL 2HG1 :A  68 PRO  O   :   -0.516:        0
:  2060:A  72 GLY  N   :A  71 VAL 3HG1 :   -0.487:        0
:  2060:A  72 GLY  N   :A  71 VAL  CG1 :   -0.479:        0

:  2060:A  36 ASN  C   :A  38 LYS  H   :   -0.515:        0
:  2060:A  38 LYS  N   :A  36 ASN  C   :   -0.506:        0
:  2060:A  38 LYS  N   :A  36 ASN  O   :   -0.505:        0
:  2060:A 117 ARG  O   :A  36 ASN  ND2 :   -0.475:        0
:  2060:A  33 HIS  ND1 :A  39 TRP  CD1 :   -0.458:        0
:  2060:A 116 THR  O   :A 117 ARG  O   :   -0.453:        0
:  2060:A  38 LYS  O   :A  39 TRP  O   :   -0.449:        0
:  2060:A 116 THR  O   :A 117 ARG  C   :   -0.423:        0

:  2060:A  80 ILE 2HD1 :A  77 LYS 1HB  :   -0.492:        0

:  2060:A  17 LYS 3HZ  :A  17 LYS 2HB  :   -0.480:        0

:  2060:A 125 HIS  O   :A 125 HIS  CG  :   -0.472:        0
:  2060:A 125 HIS  ND1 :A 125 HIS  N   :   -0.403:        0

:  2060:A  92 ILE 3HD1 :A  88 LYS  O   :   -0.468:        0
:  2060:A  88 LYS  HA  :A  83 ALA 3HB  :   -0.448:        0
:  2060:A  83 ALA  O   :A  82 PRO  O   :   -0.426:        0

:  2060:A  60 ASP  OD1 :A   3 ARG  NH2 :   -0.458:        0

:  2060:A  24 LYS  N   :A  23 GLU  CG  :   -0.455:        0

:  2060:A  37 ASP  O   :A  32 ARG  NH2 :   -0.439:        0

:  2060:A  45 ASP  O   :A  45 ASP  OD1 :   -0.438:        0

:  2060:A  56 ASP  OD1 :A  56 ASP  O   :   -0.424:        0

:  2060:A  55 GLY  C   :A  57 LYS  N   :   -0.423:        0

:  2060:A   5 GLN  CD  :A   5 GLN  N   :   -0.422:        0

:  2060:A 100 LEU  N   :A 100 LEU  CD2 :   -0.414:        0

:  2060:A  81 TYR  O   :A  93 THR  OG1 :   -0.404:        0
#sum2 ::18.93 clashscore : 18.93 clashscore B<40 
#summary::2060 atoms:2060 atoms B<40:229604 potential dots:14350.0 A^2:39 bumps:39 bumps B<40:460.5 score

List of bad contacts calculated by MAGE for model $num_n

/farm/software/bin/probe

:  2060:A  53 ILE 2HD1 :A  51 ILE 2HD1 :   -0.913:        0
:  2060:A  53 ILE  O   :A  55 GLY  N   :   -0.562:        0
:  2060:A  53 ILE 2HD1 :A  51 ILE  CD1 :   -0.523:        0

:  2060:A  74 LEU  H   :A  74 LEU 3HD2 :   -0.731:        0
:  2060:A  74 LEU 3HD1 :A  66 VAL 1HG1 :   -0.619:        0
:  2060:A  74 LEU  H   :A  74 LEU  CD2 :   -0.608:        0
:  2060:A  74 LEU 3HD2 :A  74 LEU  N   :   -0.564:        0
:  2060:A  82 PRO  CB  :A  88 LYS 2HZ  :   -0.520:        0
:  2060:A  74 LEU  CD1 :A  66 VAL 1HG1 :   -0.516:        0
:  2060:A  88 LYS  O   :A  92 ILE  CD1 :   -0.433:        0
:  2060:A  82 PRO 1HB  :A  88 LYS 2HZ  :   -0.427:        0
:  2060:A  75 ARG  HE  :A  82 PRO 2HB  :   -0.420:        0
:  2060:A  75 ARG  N   :A  74 LEU  HG  :   -0.402:        0

:  2060:A  28 TYR  CE2 :A  44 MET  SD  :   -0.592:        0
:  2060:A  28 TYR  CZ  :A  44 MET  SD  :   -0.459:        0

:  2060:A  65 LYS  N   :A  64 LEU 3HD1 :   -0.546:        0
:  2060:A  64 LEU  C   :A  64 LEU  CD1 :   -0.453:        0
:  2060:A  64 LEU  C   :A  64 LEU 3HD1 :   -0.400:        0

:  2060:A  36 ASN  N   :A  36 ASN  OD1 :   -0.541:        0
:  2060:A  35 ASP  C   :A  36 ASN  OD1 :   -0.400:        0
:  2060:A  39 TRP  HE1 :A  36 ASN 1HB  :   -0.400:        0

:  2060:A  37 ASP  N   :A  33 HIS  O   :   -0.523:        0

:  2060:A  19 ASP  OD1 :A  20 HIS  N   :   -0.517:        0

:  2060:A  24 LYS  C   :A  25 PHE  CD1 :   -0.515:        0
:  2060:A  24 LYS  C   :A  25 PHE  CG  :   -0.468:        0
:  2060:A  25 PHE  CG  :A  24 LYS  O   :   -0.434:        0

:  2060:A  41 ALA  C   :A  42 LEU 2HD2 :   -0.505:        0
:  2060:A  31 PHE  O   :A  41 ALA 3HB  :   -0.501:        0
:  2060:A  42 LEU  N   :A  42 LEU  CD2 :   -0.419:        0

:  2060:A  56 ASP  N   :A  56 ASP  OD1 :   -0.496:        0
:  2060:A  56 ASP  OD1 :A  49 GLU  OE2 :   -0.436:        0

:  2060:A 125 HIS  CG  :A 125 HIS  O2  :   -0.488:        0
:  2060:A 125 HIS  O2  :A 125 HIS  CD2 :   -0.411:        0
:  2060:A 125 HIS  CD2 :A 125 HIS  C   :   -0.410:        0

:  2060:A 115 LEU  N   :A 115 LEU 2HD1 :   -0.480:        0
:  2060:A 115 LEU  N   :A 115 LEU  CD1 :   -0.438:        0

:  2060:A  14 TYR  O   :A  15 ASP  C   :   -0.452:        0
:  2060:A  15 ASP  OD1 :A  14 TYR  O   :   -0.452:        0
:  2060:A  15 ASP  O   :A  15 ASP  OD1 :   -0.442:        0
:  2060:A  14 TYR  O   :A  15 ASP  CG  :   -0.428:        0
:  2060:A  15 ASP  OD1 :A  15 ASP  C   :   -0.424:        0

:  2060:A  91 TRP  CE3 :A  87 ASN  CB  :   -0.449:        0

:  2060:A 104 GLU  OE1 :A 104 GLU  N   :   -0.448:        0
:  2060:A 101 GLY  H   :A 104 GLU  CD  :   -0.410:        0

:  2060:A 124 HIS  O   :A 123 HIS  CD2 :   -0.445:        0

:  2060:A  30 VAL  CG1 :A  32 ARG  NH1 :   -0.434:        0
:  2060:A  30 VAL 1HG1 :A  32 ARG  NH1 :   -0.402:        0

:  2060:A 120 HIS  O   :A 120 HIS  CG  :   -0.429:        0

:  2060:A  62 ILE  CD1 :A   6 PHE  CE1 :   -0.429:        0

:  2060:A  60 ASP  OD1 :A  45 ASP  OD1 :   -0.425:        0

:  2060:A  72 GLY  N   :A  71 VAL 3HG1 :   -0.424:        0
:  2060:A  71 VAL 2HG1 :A  68 PRO  O   :   -0.412:        0

:  2060:A 110 GLU  C   :A 110 GLU  CD  :   -0.411:        0
#sum2 ::25.73 clashscore : 25.73 clashscore B<40 
#summary::2060 atoms:2060 atoms B<40:229597 potential dots:14350.0 A^2:53 bumps:53 bumps B<40:420.9 score

List of bad contacts calculated by MAGE for model $num_n

/farm/software/bin/probe

:  2060:A  43 LEU  C   :A  43 LEU 3HD2 :   -0.687:        0
:  2060:A  43 LEU 1HD2 :A   3 ARG  HE  :   -0.608:        0
:  2060:A  27 ASP  O   :A   3 ARG  NH2 :   -0.472:        0
:  2060:A  43 LEU  C   :A  43 LEU  CD2 :   -0.470:        0
:  2060:A   6 PHE  CD1 :A   6 PHE  C   :   -0.418:        0
:  2060:A  43 LEU 2HD1 :A   6 PHE  CD1 :   -0.402:        0

:  2060:A  65 LYS  N   :A  64 LEU 3HD1 :   -0.628:        0
:  2060:A  64 LEU 1HD1 :A 112 SER  OG  :   -0.461:        0
:  2060:A  64 LEU  C   :A  64 LEU  CD1 :   -0.420:        0

:  2060:A  80 ILE 2HD1 :A  77 LYS 1HB  :   -0.627:        0
:  2060:A  80 ILE 2HD1 :A  77 LYS  CB  :   -0.503:        0
:  2060:A  78 PRO  C   :A  80 ILE  H   :   -0.471:        0

:  2060:A   4 GLN 1HE2 :A   8 ASP  CG  :   -0.615:        0
:  2060:A   4 GLN  C   :A   4 GLN  CD  :   -0.416:        0

:  2060:A  41 ALA  C   :A  42 LEU 2HD2 :   -0.572:        0
:  2060:A  42 LEU 2HD2 :A  41 ALA  O   :   -0.426:        0

:  2060:A 100 LEU  CD2 :A 100 LEU  N   :   -0.571:        0
:  2060:A 100 LEU 2HD2 :A 100 LEU  N   :   -0.567:        0
:  2060:A  98 GLY  C   :A 100 LEU  H   :   -0.448:        0

:  2060:A  38 LYS  N   :A  36 ASN  O   :   -0.561:        0
:  2060:A  36 ASN  ND2 :A 116 THR  O   :   -0.487:        0
:  2060:A  36 ASN 1HD2 :A 116 THR  CB  :   -0.438:        0
:  2060:A 116 THR  HB  :A  36 ASN 1HD2 :   -0.424:        0
:  2060:A 117 ARG  C   :A 116 THR  O   :   -0.424:        0

:  2060:A  39 TRP  O   :A  39 TRP  CD1 :   -0.540:        0
:  2060:A  39 TRP  O   :A  40 TYR  CD2 :   -0.525:        0
:  2060:A  39 TRP  CD1 :A  39 TRP  C   :   -0.517:        0
:  2060:A  91 TRP  HE1 :A  40 TYR  CB  :   -0.471:        0
:  2060:A  33 HIS  H   :A  39 TRP 1HB  :   -0.452:        0
:  2060:A  40 TYR  CG  :A  39 TRP  O   :   -0.413:        0

:  2060:A  48 ALA 3HB  :A  55 GLY  O   :   -0.539:        0
:  2060:A  53 ILE 2HG2 :A  55 GLY  H   :   -0.538:        0
:  2060:A  53 ILE 2HD1 :A  51 ILE  CD1 :   -0.505:        0
:  2060:A  48 ALA 2HB  :A  57 LYS  O   :   -0.462:        0
:  2060:A  54 ASN  O   :A  55 GLY  C   :   -0.441:        0
:  2060:A  55 GLY  N   :A  53 ILE 2HG2 :   -0.433:        0
:  2060:A  54 ASN  O   :A  49 GLU  OE2 :   -0.425:        0

:  2060:A  58 ARG  NH2 :A  45 ASP  OD2 :   -0.523:        0

:  2060:A  11 GLN  O   :A  15 ASP  N   :   -0.521:        0

:  2060:A 108 LEU 2HD2 :A  74 LEU 2HD1 :   -0.503:        0

:  2060:A 125 HIS  O   :A 125 HIS  CG  :   -0.498:        0

:  2060:A  20 HIS  ND1 :A  20 HIS  N   :   -0.480:        0

:  2060:A  22 TRP  CD1 :A  22 TRP  N   :   -0.476:        0
:  2060:A  22 TRP  C   :A  24 LYS  N   :   -0.416:        0

:  2060:A  85 HIS  O   :A  86 MET  C   :   -0.453:        0
:  2060:A  85 HIS  O   :A  86 MET  O   :   -0.401:        0

:  2060:A   5 GLN  OE1 :A   2 ASN  OD1 :   -0.438:        0
:  2060:A   5 GLN  OE1 :A   2 ASN  CG  :   -0.408:        0

:  2060:A  59 VAL  HB  :A  95 LEU 1HD1 :   -0.422:        0

:  2060:A  19 ASP  C   :A  19 ASP  OD1 :   -0.420:        0

:  2060:A 114 GLN 2HE2 :A 111 ASP  HA  :   -0.418:        0

:  2060:A  72 GLY  N   :A  71 VAL 3HG1 :   -0.403:        0
#sum2 ::25.24 clashscore : 25.24 clashscore B<40 
#summary::2060 atoms:2060 atoms B<40:229510 potential dots:14340.0 A^2:52 bumps:52 bumps B<40:420.9 score

List of bad contacts calculated by MAGE for model $num_n

/farm/software/bin/probe

:  2060:A  91 TRP  C   :A  92 ILE 2HD1 :   -0.905:        0
:  2060:A  92 ILE 2HD1 :A  92 ILE  N   :   -0.481:        0

:  2060:A  80 ILE  N   :A  80 ILE 2HD1 :   -0.781:        0
:  2060:A  80 ILE  N   :A  80 ILE  CD1 :   -0.582:        0
:  2060:A  80 ILE 2HD1 :A  80 ILE  H   :   -0.483:        0
:  2060:A  80 ILE  H   :A  80 ILE  CD1 :   -0.436:        0
:  2060:A  78 PRO  O   :A  80 ILE 2HD1 :   -0.424:        0
:  2060:A  80 ILE  CD1 :A  78 PRO  O   :   -0.409:        0

:  2060:A  74 LEU 3HD1 :A  66 VAL 1HG1 :   -0.669:        0
:  2060:A  74 LEU 3HD1 :A  66 VAL  CG1 :   -0.435:        0

:  2060:A  71 VAL 2HG1 :A  68 PRO  O   :   -0.615:        0
:  2060:A  72 GLY  N   :A  71 VAL 3HG1 :   -0.554:        0
:  2060:A  72 GLY  O   :A  76 LYS  CB  :   -0.433:        0
:  2060:A  72 GLY  N   :A  71 VAL  CG1 :   -0.424:        0

:  2060:A  14 TYR  CG  :A  33 HIS  NE2 :   -0.592:        0
:  2060:A  39 TRP  O   :A  39 TRP  CD1 :   -0.561:        0
:  2060:A  39 TRP  CD1 :A  32 ARG  CB  :   -0.506:        0
:  2060:A  39 TRP  CD1 :A  39 TRP  C   :   -0.498:        0
:  2060:A  33 HIS  H   :A  39 TRP  CB  :   -0.463:        0
:  2060:A  39 TRP  CE3 :A  37 ASP  O   :   -0.403:        0

:  2060:A  86 MET  N   :A  85 HIS  CG  :   -0.581:        0

:  2060:A   4 GLN 1HE2 :A   8 ASP  CG  :   -0.580:        0

:  2060:A  38 LYS  N   :A  36 ASN  O   :   -0.573:        0
:  2060:A 118 LEU  CD2 :A  36 ASN 2HD2 :   -0.543:        0
:  2060:A  36 ASN 2HD2 :A 118 LEU 1HD2 :   -0.485:        0
:  2060:A  36 ASN 2HD2 :A 118 LEU  CG  :   -0.448:        0
:  2060:A  36 ASN  ND2 :A 118 LEU 1HD2 :   -0.401:        0

:  2060:A  53 ILE 2HG2 :A  55 GLY  H   :   -0.562:        0
:  2060:A  48 ALA 3HB  :A  55 GLY  O   :   -0.478:        0
:  2060:A  53 ILE 2HD1 :A  51 ILE  CD1 :   -0.459:        0
:  2060:A  51 ILE  O   :A  81 TYR  CD1 :   -0.456:        0
:  2060:A  53 ILE 2HD1 :A  51 ILE 1HD1 :   -0.431:        0

:  2060:A  43 LEU  N   :A  42 LEU 3HD1 :   -0.554:        0
:  2060:A  42 LEU 3HD1 :A  42 LEU  C   :   -0.476:        0
:  2060:A  42 LEU  CD1 :A  42 LEU  C   :   -0.475:        0

:  2060:A  11 GLN  O   :A  15 ASP  N   :   -0.543:        0
:  2060:A  11 GLN  O   :A  15 ASP  CA  :   -0.405:        0

:  2060:A   9 TYR  CD1 :A 106 HIS  NE2 :   -0.518:        0
:  2060:A   9 TYR  CE1 :A 106 HIS  CD2 :   -0.428:        0

:  2060:A 115 LEU  N   :A 115 LEU  CD1 :   -0.503:        0
:  2060:A 115 LEU  N   :A 115 LEU 2HD1 :   -0.493:        0

:  2060:A  17 LYS  N   :A  17 LYS  CD  :   -0.481:        0

:  2060:A  84 TYR  O   :A  84 TYR  CG  :   -0.457:        0

:  2060:A 116 THR  O   :A 117 ARG  C   :   -0.442:        0
:  2060:A 116 THR  O   :A 117 ARG  O   :   -0.416:        0

:  2060:A  28 TYR  CE2 :A  44 MET  CB  :   -0.413:        0

:  2060:A  82 PRO  O   :A  93 THR  OG1 :   -0.406:        0
#sum2 ::22.82 clashscore : 22.82 clashscore B<40 
#summary::2060 atoms:2060 atoms B<40:229638 potential dots:14350.0 A^2:47 bumps:47 bumps B<40:422.9 score

List of bad contacts calculated by MAGE for model $num_n

/farm/software/bin/probe

:  2060:A  74 LEU  H   :A  74 LEU 3HD2 :   -1.002:        0
:  2060:A  75 ARG  CZ  :A  92 ILE 1HG2 :   -0.907:        0
:  2060:A  74 LEU  H   :A  74 LEU  CD2 :   -0.722:        0
:  2060:A  75 ARG 1HH2 :A  80 ILE  CG2 :   -0.654:        0
:  2060:A  74 LEU  CD1 :A  75 ARG 2HH2 :   -0.645:        0
:  2060:A  75 ARG  NE  :A  92 ILE 1HG2 :   -0.619:        0
:  2060:A  86 MET  H   :A  84 TYR  C   :   -0.548:        0
:  2060:A  72 GLY  N   :A  71 VAL 3HG1 :   -0.538:        0
:  2060:A  75 ARG  NH1 :A  71 VAL  O   :   -0.531:        0
:  2060:A  92 ILE 1HG2 :A  75 ARG  NH2 :   -0.529:        0
:  2060:A  75 ARG  NH2 :A  80 ILE 1HG2 :   -0.504:        0
:  2060:A  71 VAL 2HG1 :A  68 PRO  O   :   -0.468:        0
:  2060:A  74 LEU 3HD2 :A  74 LEU  N   :   -0.460:        0
:  2060:A  80 ILE  CG2 :A  75 ARG  NH2 :   -0.450:        0
:  2060:A  91 TRP  CD1 :A  91 TRP  N   :   -0.439:        0
:  2060:A  91 TRP  O   :A  87 ASN  O   :   -0.431:        0
:  2060:A  87 ASN  OD1 :A  89 GLU  N   :   -0.426:        0
:  2060:A  92 ILE 3HD1 :A  75 ARG  CZ  :   -0.419:        0
:  2060:A  91 TRP  C   :A  92 ILE  CG1 :   -0.415:        0
:  2060:A  84 TYR  O   :A  86 MET  N   :   -0.414:        0
:  2060:A  86 MET  O   :A  87 ASN  C   :   -0.413:        0
:  2060:A  92 ILE 3HD1 :A  75 ARG  NH1 :   -0.410:        0

:  2060:A  65 LYS  N   :A  64 LEU 3HD1 :   -0.673:        0
:  2060:A  65 LYS  H   :A  64 LEU 3HD1 :   -0.472:        0

:  2060:A  60 ASP  H   :A  97 ASN  ND2 :   -0.666:        0
:  2060:A  97 ASN 2HD2 :A  60 ASP  H   :   -0.574:        0

:  2060:A  43 LEU  C   :A  43 LEU 3HD2 :   -0.633:        0
:  2060:A  28 TYR  CE2 :A  44 MET  SD  :   -0.573:        0
:  2060:A  43 LEU 3HD2 :A  44 MET  N   :   -0.461:        0
:  2060:A  43 LEU  CD2 :A  43 LEU  C   :   -0.446:        0
:  2060:A   6 PHE  CD2 :A  43 LEU 2HD1 :   -0.403:        0

:  2060:A 100 LEU 2HD1 :A 100 LEU  C   :   -0.595:        0
:  2060:A 100 LEU  O   :A 100 LEU 2HD1 :   -0.552:        0
:  2060:A 100 LEU  CD1 :A 100 LEU  C   :   -0.442:        0
:  2060:A 100 LEU  H   :A 100 LEU  HG  :   -0.412:        0

:  2060:A 115 LEU  N   :A 115 LEU 2HD1 :   -0.564:        0
:  2060:A 115 LEU  N   :A 115 LEU  CD1 :   -0.525:        0

:  2060:A  55 GLY  H   :A  53 ILE  C   :   -0.563:        0
:  2060:A  48 ALA 3HB  :A  55 GLY  O   :   -0.559:        0
:  2060:A  48 ALA 2HB  :A  57 LYS  O   :   -0.530:        0
:  2060:A  51 ILE  O   :A  81 TYR  CD2 :   -0.477:        0
:  2060:A  53 ILE 2HG2 :A  55 GLY  H   :   -0.444:        0
:  2060:A  93 THR  O   :A  81 TYR  O   :   -0.442:        0
:  2060:A  81 TYR  CE2 :A  51 ILE  O   :   -0.410:        0
:  2060:A  53 ILE  C   :A  55 GLY  N   :   -0.406:        0
:  2060:A  51 ILE  CD1 :A  53 ILE 2HD1 :   -0.402:        0

:  2060:A 125 HIS  CG  :A 125 HIS  O2  :   -0.545:        0
:  2060:A 125 HIS  O2  :A 125 HIS  CD2 :   -0.525:        0

:  2060:A  14 TYR  CE1 :A  33 HIS  CE1 :   -0.538:        0

:  2060:A  63 ASP  OD2 :A  40 TYR  CE2 :   -0.538:        0

:  2060:A  38 LYS  C   :A  37 ASP  O   :   -0.503:        0
:  2060:A  38 LYS  HA  :A  33 HIS  H   :   -0.467:        0

:  2060:A  11 GLN  O   :A  15 ASP  N   :   -0.535:        0

:  2060:A  27 ASP  OD1 :A  27 ASP  N   :   -0.515:        0

:  2060:A 104 GLU  OE2 :A 103 LYS  NZ  :   -0.497:        0

:  2060:A  73 SER  O   :A  76 LYS  NZ  :   -0.483:        0
:  2060:A  73 SER  O   :A  76 LYS  CE  :   -0.481:        0

:  2060:A 116 THR  O   :A  36 ASN  ND2 :   -0.472:        0

:  2060:A  59 VAL  HB  :A  95 LEU 1HD1 :   -0.449:        0
:  2060:A  59 VAL  O   :A  45 ASP  OD1 :   -0.432:        0

:  2060:A  20 HIS  ND1 :A  20 HIS  N   :   -0.433:        0

:  2060:A  41 ALA 2HB  :A  39 TRP  CZ2 :   -0.409:        0

:  2060:A   4 GLN  C   :A   4 GLN  CD  :   -0.407:        0
#sum2 ::30.58 clashscore : 30.58 clashscore B<40 
#summary::2060 atoms:2060 atoms B<40:229596 potential dots:14350.0 A^2:63 bumps:63 bumps B<40:329.3 score

List of bad contacts calculated by MAGE for model $num_n

/farm/software/bin/probe

:  2060:A  43 LEU  C   :A  43 LEU 3HD2 :   -0.668:        0
:  2060:A  43 LEU 3HD2 :A  44 MET  N   :   -0.536:        0
:  2060:A  43 LEU  CD2 :A  43 LEU  C   :   -0.472:        0

:  2060:A  55 GLY  H   :A  53 ILE  C   :   -0.616:        0
:  2060:A  48 ALA 3HB  :A  55 GLY  O   :   -0.571:        0
:  2060:A  53 ILE 2HD1 :A  51 ILE  CD1 :   -0.514:        0
:  2060:A  53 ILE  C   :A  55 GLY  N   :   -0.437:        0
:  2060:A  53 ILE  O   :A  55 GLY  N   :   -0.404:        0
:  2060:A  51 ILE  H   :A  51 ILE 1HG1 :   -0.402:        0
:  2060:A  51 ILE  CG2 :A  84 TYR  OH  :   -0.400:        0

:  2060:A  20 HIS  N   :A  20 HIS  ND1 :   -0.588:        0
:  2060:A  19 ASP  OD1 :A  20 HIS  N   :   -0.520:        0

:  2060:A  74 LEU  H   :A  74 LEU 3HD2 :   -0.584:        0
:  2060:A  74 LEU  H   :A  74 LEU  CD2 :   -0.526:        0
:  2060:A  74 LEU 3HD2 :A  74 LEU  N   :   -0.473:        0

:  2060:A  11 GLN  O   :A  15 ASP  N   :   -0.545:        0
:  2060:A  15 ASP  H   :A  11 GLN  C   :   -0.430:        0
:  2060:A  15 ASP  OD1 :A  11 GLN  O   :   -0.414:        0

:  2060:A  14 TYR  CE1 :A 113 PHE  CD1 :   -0.525:        0
:  2060:A 113 PHE  O   :A 117 ARG  N   :   -0.439:        0
:  2060:A 113 PHE  CE1 :A  14 TYR  CE1 :   -0.430:        0

:  2060:A  16 THR 2HG2 :A  17 LYS  N   :   -0.520:        0
:  2060:A  33 HIS  NE2 :A  16 THR  OG1 :   -0.505:        0
:  2060:A  17 LYS  N   :A  16 THR  CG2 :   -0.416:        0

:  2060:A  36 ASN  C   :A  38 LYS  H   :   -0.514:        0
:  2060:A  38 LYS  N   :A  36 ASN  C   :   -0.456:        0
:  2060:A  36 ASN  OD1 :A  36 ASN  C   :   -0.434:        0

:  2060:A  72 GLY  N   :A  71 VAL 3HG1 :   -0.504:        0
:  2060:A  71 VAL 2HG1 :A  68 PRO  O   :   -0.494:        0
:  2060:A  72 GLY  N   :A  71 VAL  CG1 :   -0.413:        0

:  2060:A  50 LYS  C   :A  52 GLY  H   :   -0.491:        0

:  2060:A  31 PHE  N   :A  31 PHE  CD1 :   -0.452:        0
:  2060:A  41 ALA 3HB  :A  31 PHE 1HB  :   -0.401:        0

:  2060:A  59 VAL  HB  :A  95 LEU 1HD1 :   -0.449:        0
:  2060:A  59 VAL  HA  :A  97 ASN 2HD2 :   -0.441:        0
:  2060:A  61 VAL 2HG1 :A  95 LEU 2HD1 :   -0.416:        0

:  2060:A  45 ASP  O   :A  45 ASP  OD1 :   -0.446:        0

:  2060:A   2 ASN  N   :A   1 MET  CG  :   -0.435:        0

:  2060:A   7 ILE  N   :A   7 ILE 2HD1 :   -0.427:        0

:  2060:A  54 ASN  C   :A  54 ASN  OD1 :   -0.419:        0

:  2060:A 108 LEU 1HD1 :A  77 LYS 1HZ  :   -0.418:        0

:  2060:A   9 TYR  CE1 :A 106 HIS  CE1 :   -0.417:        0

:  2060:A  94 VAL 1HG2 :A  64 LEU 1HD2 :   -0.416:        0

:  2060:A  90 HIS  CD2 :A  90 HIS  N   :   -0.410:        0

:  2060:A 125 HIS  CD2 :A 125 HIS  N   :   -0.406:        0

:  2060:A  35 ASP  C   :A  35 ASP  OD1 :   -0.405:        0
#sum2 ::22.33 clashscore : 22.33 clashscore B<40 
#summary::2060 atoms:2060 atoms B<40:229588 potential dots:14350.0 A^2:46 bumps:46 bumps B<40:469.6 score

List of bad contacts calculated by MAGE for model $num_n

/farm/software/bin/probe

:  2060:A  43 LEU  C   :A  43 LEU 3HD2 :   -0.716:        0
:  2060:A  43 LEU 3HD2 :A  44 MET  N   :   -0.557:        0
:  2060:A  44 MET  SD  :A  61 VAL  CG2 :   -0.514:        0
:  2060:A  43 LEU  CD2 :A  43 LEU  C   :   -0.487:        0
:  2060:A  28 TYR  CZ  :A  44 MET  CB  :   -0.444:        0
:  2060:A  44 MET  SD  :A  44 MET  O   :   -0.440:        0
:  2060:A  44 MET  C   :A  44 MET  SD  :   -0.425:        0

:  2060:A  80 ILE  N   :A  80 ILE 2HD1 :   -0.708:        0
:  2060:A  80 ILE 1HD1 :A 100 LEU 1HD1 :   -0.592:        0
:  2060:A 100 LEU  CD2 :A 100 LEU  N   :   -0.552:        0
:  2060:A 100 LEU 2HD2 :A 100 LEU  N   :   -0.534:        0
:  2060:A  80 ILE  N   :A  80 ILE  CD1 :   -0.521:        0
:  2060:A  78 PRO  O   :A  80 ILE 2HD1 :   -0.420:        0
:  2060:A  80 ILE  CD1 :A  78 PRO  O   :   -0.418:        0

:  2060:A  53 ILE 2HD1 :A  51 ILE 2HD1 :   -0.682:        0
:  2060:A  53 ILE 2HD1 :A  51 ILE  CD1 :   -0.573:        0
:  2060:A  53 ILE 1HD1 :A  81 TYR  CZ  :   -0.541:        0
:  2060:A  53 ILE  O   :A  55 GLY  N   :   -0.518:        0

:  2060:A  65 LYS  N   :A  64 LEU 3HD1 :   -0.673:        0
:  2060:A  64 LEU  C   :A  64 LEU  CD1 :   -0.431:        0
:  2060:A  64 LEU 3HD1 :A  65 LYS  H   :   -0.429:        0

:  2060:A   9 TYR  CE1 :A 106 HIS  CD2 :   -0.634:        0
:  2060:A   9 TYR  CD1 :A 106 HIS  NE2 :   -0.527:        0
:  2060:A 106 HIS  CG  :A   9 TYR  CE1 :   -0.518:        0
:  2060:A 106 HIS  CD2 :A   9 TYR  CD1 :   -0.404:        0

:  2060:A  85 HIS  CE1 :A  84 TYR  CZ  :   -0.630:        0
:  2060:A  85 HIS  CE1 :A  84 TYR  CE1 :   -0.563:        0
:  2060:A  84 TYR  CZ  :A  85 HIS  NE2 :   -0.502:        0

:  2060:A  14 TYR  CD1 :A  33 HIS  NE2 :   -0.621:        0
:  2060:A  39 TRP  CD2 :A  39 TRP  N   :   -0.614:        0
:  2060:A  39 TRP  CE3 :A  39 TRP  N   :   -0.577:        0
:  2060:A  38 LYS  C   :A  39 TRP  CG  :   -0.548:        0
:  2060:A  33 HIS  O   :A  39 TRP  NE1 :   -0.500:        0
:  2060:A  14 TYR  CZ  :A  13 LYS  NZ  :   -0.479:        0

:  2060:A  11 GLN 1HE2 :A  16 THR  C   :   -0.585:        0
:  2060:A  11 GLN  O   :A  15 ASP  N   :   -0.528:        0
:  2060:A  11 GLN 2HE2 :A  15 ASP  C   :   -0.471:        0

:  2060:A 118 LEU  N   :A 118 LEU 2HD1 :   -0.569:        0
:  2060:A 118 LEU  N   :A 118 LEU  CD1 :   -0.442:        0
:  2060:A 118 LEU  H   :A 116 THR  C   :   -0.408:        0

:  2060:A  89 GLU  N   :A  89 GLU  OE1 :   -0.550:        0

:  2060:A  71 VAL 2HG1 :A  68 PRO  O   :   -0.492:        0
:  2060:A  72 GLY  N   :A  71 VAL 3HG1 :   -0.473:        0
:  2060:A  76 LYS  CG  :A  72 GLY  O   :   -0.465:        0
:  2060:A  72 GLY  N   :A  71 VAL  CG1 :   -0.451:        0

:  2060:A  40 TYR  CE2 :A  42 LEU  CD2 :   -0.482:        0
:  2060:A  42 LEU 1HD2 :A  40 TYR  CE2 :   -0.426:        0

:  2060:A  92 ILE 1HD1 :A  88 LYS  O   :   -0.460:        0
:  2060:A  93 THR  N   :A  92 ILE 2HG2 :   -0.434:        0

:  2060:A  87 ASN  O   :A  86 MET  O   :   -0.457:        0
:  2060:A  87 ASN  CG  :A  86 MET  O   :   -0.456:        0
:  2060:A  86 MET  O   :A  87 ASN  OD1 :   -0.427:        0
:  2060:A  86 MET  CG  :A  87 ASN  N   :   -0.417:        0
:  2060:A  86 MET  O   :A  87 ASN  C   :   -0.407:        0
:  2060:A  87 ASN  CG  :A  86 MET  C   :   -0.400:        0

:  2060:A 124 HIS  O   :A 125 HIS  CG  :   -0.445:        0
:  2060:A 124 HIS  CD2 :A 125 HIS  N   :   -0.432:        0
:  2060:A 124 HIS  CG  :A 125 HIS  N   :   -0.426:        0
:  2060:A 123 HIS  O   :A 124 HIS  C   :   -0.416:        0

:  2060:A   3 ARG 1HH2 :A  60 ASP  CG  :   -0.436:        0

:  2060:A  45 ASP  O   :A  45 ASP  OD1 :   -0.429:        0

:  2060:A  70 LEU 1HB  :A  67 GLN  H   :   -0.427:        0

:  2060:A  59 VAL  HB  :A  95 LEU 1HD1 :   -0.427:        0

:  2060:A  82 PRO 2HG  :A  75 ARG  HE  :   -0.418:        0

:  2060:A  52 GLY  H   :A  50 LYS  C   :   -0.409:        0

:  2060:A  22 TRP  CD1 :A  22 TRP  N   :   -0.403:        0
#sum2 ::32.04 clashscore : 32.04 clashscore B<40 
#summary::2060 atoms:2060 atoms B<40:229977 potential dots:14370.0 A^2:66 bumps:66 bumps B<40:376.8 score

List of bad contacts calculated by MAGE for model $num_n

/farm/software/bin/probe

:  2060:A  48 ALA 3HB  :A  55 GLY  O   :   -0.838:        0
:  2060:A  48 ALA 1HB  :A  53 ILE  HB  :   -0.632:        0
:  2060:A  53 ILE 2HD1 :A  51 ILE  CD1 :   -0.522:        0
:  2060:A  55 GLY  C   :A  54 ASN  O   :   -0.464:        0
:  2060:A  53 ILE 2HG2 :A  55 GLY  H   :   -0.418:        0

:  2060:A  92 ILE 3HD1 :A  91 TRP  O   :   -0.832:        0
:  2060:A  91 TRP  C   :A  92 ILE 3HD1 :   -0.643:        0
:  2060:A  88 LYS  O   :A  92 ILE  CD1 :   -0.417:        0

:  2060:A  23 GLU  CD  :A  23 GLU  H   :   -0.693:        0
:  2060:A  23 GLU  CD  :A  23 GLU  N   :   -0.420:        0

:  2060:A  60 ASP  H   :A  97 ASN  ND2 :   -0.674:        0
:  2060:A  97 ASN 2HD2 :A  60 ASP  H   :   -0.468:        0

:  2060:A  71 VAL 2HG1 :A  68 PRO  O   :   -0.643:        0
:  2060:A  72 GLY  N   :A  71 VAL 3HG1 :   -0.508:        0
:  2060:A  72 GLY  N   :A  71 VAL  CG1 :   -0.484:        0
:  2060:A  68 PRO  O   :A  71 VAL  CG1 :   -0.432:        0

:  2060:A  43 LEU  C   :A  43 LEU 3HD2 :   -0.641:        0
:  2060:A  43 LEU 3HD2 :A  44 MET  N   :   -0.528:        0
:  2060:A  43 LEU  C   :A  43 LEU  CD2 :   -0.451:        0

:  2060:A 125 HIS  CD2 :A 124 HIS  CD2 :   -0.612:        0
:  2060:A 125 HIS  NE2 :A 124 HIS  NE2 :   -0.577:        0
:  2060:A 124 HIS  ND1 :A 124 HIS  N   :   -0.566:        0
:  2060:A 125 HIS  ND1 :A 125 HIS  C   :   -0.526:        0
:  2060:A 124 HIS  NE2 :A 125 HIS  CE1 :   -0.473:        0
:  2060:A 124 HIS  ND1 :A 125 HIS  N   :   -0.411:        0

:  2060:A  65 LYS  N   :A  64 LEU 3HD1 :   -0.600:        0
:  2060:A  64 LEU  CD1 :A  64 LEU  C   :   -0.447:        0
:  2060:A  64 LEU  C   :A  64 LEU 3HD1 :   -0.432:        0

:  2060:A  80 ILE 2HD1 :A  77 LYS 1HB  :   -0.590:        0
:  2060:A  80 ILE 3HG2 :A  94 VAL 2HG2 :   -0.546:        0

:  2060:A  93 THR 1HG2 :A  84 TYR  CZ  :   -0.582:        0

:  2060:A  38 LYS  N   :A  36 ASN  O   :   -0.558:        0
:  2060:A  38 LYS  N   :A  36 ASN  C   :   -0.504:        0
:  2060:A  36 ASN  C   :A  38 LYS  H   :   -0.476:        0

:  2060:A  11 GLN  O   :A  15 ASP  N   :   -0.549:        0
:  2060:A  11 GLN  C   :A  15 ASP  H   :   -0.528:        0

:  2060:A 100 LEU  C   :A  99 PRO  O   :   -0.542:        0

:  2060:A   9 TYR  CE2 :A  13 LYS  NZ  :   -0.531:        0

:  2060:A  90 HIS  ND1 :A  87 ASN  CG  :   -0.512:        0
:  2060:A  90 HIS  CD2 :A  90 HIS  N   :   -0.460:        0
:  2060:A  86 MET  CG  :A  87 ASN  H   :   -0.454:        0

:  2060:A  96 LEU 1HD1 :A  62 ILE 3HG2 :   -0.511:        0

:  2060:A 108 LEU 2HD2 :A  74 LEU 2HD1 :   -0.495:        0
:  2060:A  74 LEU 3HD1 :A  66 VAL 1HG1 :   -0.457:        0

:  2060:A  20 HIS  O   :A  20 HIS  CG  :   -0.489:        0

:  2060:A  39 TRP  CD1 :A  39 TRP  C   :   -0.458:        0

:  2060:A  45 ASP  O   :A  45 ASP  OD1 :   -0.446:        0

:  2060:A  35 ASP  C   :A  35 ASP  OD1 :   -0.421:        0

:  2060:A  69 GLU 1HG  :A  69 GLU  H   :   -0.410:        0

:  2060:A 112 SER  O   :A 116 THR 3HG2 :   -0.410:        0
#sum2 ::24.27 clashscore : 24.27 clashscore B<40 
#summary::2060 atoms:2060 atoms B<40:229868 potential dots:14370.0 A^2:50 bumps:50 bumps B<40:394.5 score

List of bad contacts calculated by MAGE for model $num_n

/farm/software/bin/probe

:  2060:A  65 LYS  N   :A  64 LEU 3HD1 :   -0.703:        0
:  2060:A  64 LEU  C   :A  64 LEU 3HD1 :   -0.427:        0
:  2060:A  64 LEU  CD1 :A  64 LEU  C   :   -0.422:        0

:  2060:A  38 LYS  N   :A  36 ASN  O   :   -0.577:        0
:  2060:A  36 ASN  ND2 :A 116 THR  O   :   -0.504:        0

:  2060:A  72 GLY  N   :A  71 VAL 3HG1 :   -0.570:        0
:  2060:A  71 VAL 2HG1 :A  68 PRO  O   :   -0.478:        0
:  2060:A  72 GLY  N   :A  71 VAL  CG1 :   -0.458:        0

:  2060:A  69 GLU  OE1 :A  69 GLU  N   :   -0.550:        0

:  2060:A  88 LYS  N   :A  86 MET  O   :   -0.546:        0
:  2060:A  86 MET  N   :A  85 HIS  CG  :   -0.505:        0
:  2060:A  86 MET  N   :A  85 HIS  CD2 :   -0.462:        0
:  2060:A  85 HIS  O   :A  86 MET  O   :   -0.407:        0

:  2060:A  41 ALA  C   :A  42 LEU 2HD2 :   -0.544:        0
:  2060:A  30 VAL 2HG2 :A  42 LEU 3HD1 :   -0.428:        0
:  2060:A  42 LEU  N   :A  42 LEU  CD2 :   -0.403:        0

:  2060:A 125 HIS  CG  :A 125 HIS  O2  :   -0.542:        0

:  2060:A  39 TRP  CD1 :A  32 ARG  CB  :   -0.542:        0
:  2060:A  40 TYR  CG  :A  39 TRP  O   :   -0.509:        0
:  2060:A  39 TRP  CE3 :A  37 ASP  O   :   -0.496:        0
:  2060:A  33 HIS  H   :A  39 TRP  CB  :   -0.436:        0
:  2060:A  32 ARG  CB  :A  39 TRP  NE1 :   -0.427:        0
:  2060:A  39 TRP  C   :A  40 TYR  CG  :   -0.422:        0

:  2060:A 125 HIS  O2  :A 125 HIS  CD2 :   -0.419:        0

:  2060:A  39 TRP  CD1 :A  39 TRP  C   :   -0.417:        0
:  2060:A  39 TRP  CD1 :A  39 TRP  O   :   -0.408:        0
:  2060:A  40 TYR  CD2 :A  39 TRP  C   :   -0.407:        0

:  2060:A 115 LEU  N   :A 115 LEU 2HD1 :   -0.523:        0
:  2060:A 115 LEU  N   :A 115 LEU  CD1 :   -0.420:        0

:  2060:A  28 TYR  CE2 :A  44 MET  SD  :   -0.521:        0

:  2060:A  11 GLN  O   :A  15 ASP  N   :   -0.509:        0
:  2060:A  14 TYR  O   :A  15 ASP  CG  :   -0.470:        0
:  2060:A  15 ASP  H   :A  11 GLN  C   :   -0.460:        0
:  2060:A  14 TYR  O   :A  15 ASP  C   :   -0.438:        0
:  2060:A  15 ASP  OD1 :A  14 TYR  O   :   -0.419:        0

:  2060:A  53 ILE 2HD1 :A  51 ILE  CD1 :   -0.494:        0
:  2060:A  53 ILE 2HD1 :A  51 ILE 1HD1 :   -0.446:        0

:  2060:A 123 HIS  ND1 :A 124 HIS  NE2 :   -0.490:        0
:  2060:A 123 HIS  ND1 :A 124 HIS  CD2 :   -0.411:        0

:  2060:A 113 PHE  O   :A 117 ARG  N   :   -0.478:        0

:  2060:A 108 LEU 2HD2 :A  74 LEU 2HD1 :   -0.472:        0

:  2060:A  20 HIS  CD2 :A  20 HIS  N   :   -0.464:        0

:  2060:A   6 PHE  CD2 :A  43 LEU  CD1 :   -0.455:        0

:  2060:A  60 ASP  H   :A  97 ASN  ND2 :   -0.450:        0

:  2060:A  89 GLU  H   :A  87 ASN  C   :   -0.446:        0

:  2060:A  27 ASP  OD1 :A  27 ASP  N   :   -0.438:        0

:  2060:A 100 LEU  N   :A 100 LEU  CD2 :   -0.423:        0
:  2060:A 100 LEU  N   :A 100 LEU 2HD2 :   -0.400:        0

:  2060:A   4 GLN  C   :A   4 GLN  CD  :   -0.403:        0

:  2060:A  45 ASP  O   :A  45 ASP  OD1 :   -0.402:        0
#sum2 ::24.27 clashscore : 24.27 clashscore B<40 
#summary::2060 atoms:2060 atoms B<40:229671 potential dots:14350.0 A^2:50 bumps:50 bumps B<40:426.5 score

List of bad contacts calculated by MAGE for model $num_n

/farm/software/bin/probe

:  2060:A  33 HIS  N   :A  39 TRP  HE1 :   -0.726:        0
:  2060:A  38 LYS  N   :A  36 ASN  O   :   -0.594:        0
:  2060:A  36 ASN  N   :A  36 ASN  OD1 :   -0.504:        0
:  2060:A  36 ASN  O   :A  37 ASP  C   :   -0.435:        0
:  2060:A  37 ASP  OD1 :A  33 HIS  O   :   -0.416:        0

:  2060:A  65 LYS  N   :A  64 LEU 3HD1 :   -0.633:        0
:  2060:A  64 LEU  CD1 :A  64 LEU  C   :   -0.438:        0
:  2060:A  64 LEU 3HD1 :A  64 LEU  C   :   -0.421:        0

:  2060:A  28 TYR  CE2 :A  44 MET  SD  :   -0.592:        0
:  2060:A  43 LEU  C   :A  43 LEU 3HD2 :   -0.563:        0
:  2060:A  43 LEU 3HD2 :A  44 MET  N   :   -0.449:        0

:  2060:A  32 ARG  HE  :A  30 VAL  CG1 :   -0.584:        0
:  2060:A  32 ARG  CD  :A  32 ARG  N   :   -0.574:        0
:  2060:A  30 VAL  CG1 :A  32 ARG  NE  :   -0.412:        0
:  2060:A  30 VAL  CB  :A  32 ARG  HE  :   -0.400:        0

:  2060:A  53 ILE 2HD1 :A  51 ILE 2HD1 :   -0.561:        0
:  2060:A  53 ILE 2HD1 :A  51 ILE  CD1 :   -0.529:        0
:  2060:A  53 ILE 1HD1 :A  81 TYR  CE1 :   -0.401:        0

:  2060:A  71 VAL 2HG1 :A  68 PRO  O   :   -0.537:        0
:  2060:A  72 GLY  N   :A  71 VAL 3HG1 :   -0.527:        0
:  2060:A  72 GLY  N   :A  71 VAL  CG1 :   -0.490:        0
:  2060:A  76 LYS  CG  :A  72 GLY  O   :   -0.480:        0

:  2060:A 113 PHE  O   :A 117 ARG  N   :   -0.521:        0
:  2060:A 116 THR  O   :A 117 ARG  C   :   -0.440:        0

:  2060:A  84 TYR  O   :A  84 TYR  CG  :   -0.507:        0

:  2060:A 108 LEU 2HD2 :A  74 LEU 2HD1 :   -0.502:        0
:  2060:A  74 LEU  CD2 :A  92 ILE 1HG2 :   -0.500:        0

:  2060:A  11 GLN  O   :A  15 ASP  N   :   -0.475:        0
:  2060:A  15 ASP  C   :A  14 TYR  O   :   -0.464:        0
:  2060:A  15 ASP  OD1 :A  14 TYR  C   :   -0.447:        0
:  2060:A  16 THR  N   :A  14 TYR  O   :   -0.445:        0
:  2060:A  14 TYR  C   :A  15 ASP  CG  :   -0.428:        0
:  2060:A  14 TYR  C   :A  16 THR  N   :   -0.421:        0
:  2060:A  11 GLN 2HG  :A  12 LYS  N   :   -0.401:        0

:  2060:A  20 HIS  O   :A  20 HIS  CG  :   -0.471:        0

:  2060:A 125 HIS  O   :A 125 HIS  CG  :   -0.461:        0

:  2060:A  62 ILE  CD1 :A   6 PHE  CE1 :   -0.459:        0
:  2060:A   6 PHE  CE1 :A  62 ILE 3HD1 :   -0.434:        0

:  2060:A 100 LEU  N   :A 100 LEU  CD2 :   -0.458:        0
:  2060:A 100 LEU 2HD2 :A 100 LEU  N   :   -0.440:        0

:  2060:A 115 LEU 2HD2 :A  67 GLN 2HG  :   -0.449:        0

:  2060:A  83 ALA  HA  :A  93 THR 3HG2 :   -0.441:        0
:  2060:A  82 PRO  O   :A  93 THR  OG1 :   -0.423:        0

:  2060:A  56 ASP  OD1 :A  49 GLU  OE2 :   -0.419:        0
#sum2 ::21.36 clashscore : 21.36 clashscore B<40 
#summary::2060 atoms:2060 atoms B<40:229440 potential dots:14340.0 A^2:44 bumps:44 bumps B<40:444 score

List of bad contacts calculated by MAGE for model $num_n

/farm/software/bin/probe

:  2060:A  53 ILE 1HD1 :A  81 TYR  CZ  :   -0.690:        0
:  2060:A  53 ILE 1HD1 :A  81 TYR  CE1 :   -0.448:        0
:  2060:A  53 ILE 2HD1 :A  51 ILE  CD1 :   -0.442:        0

:  2060:A  74 LEU  H   :A  74 LEU 3HD2 :   -0.627:        0
:  2060:A  74 LEU  H   :A  74 LEU  CD2 :   -0.598:        0
:  2060:A  74 LEU 3HD2 :A  74 LEU  N   :   -0.512:        0
:  2060:A  76 LYS  CD  :A  73 SER  O   :   -0.512:        0
:  2060:A  74 LEU  N   :A  73 SER  OG  :   -0.437:        0
:  2060:A  74 LEU  CD2 :A  74 LEU  N   :   -0.420:        0

:  2060:A  91 TRP  CZ3 :A  87 ASN  ND2 :   -0.622:        0
:  2060:A  89 GLU  N   :A  87 ASN  O   :   -0.553:        0
:  2060:A  87 ASN  ND2 :A  91 TRP  CH2 :   -0.426:        0

:  2060:A  14 TYR  CE1 :A  33 HIS  NE2 :   -0.606:        0
:  2060:A  14 TYR  CE1 :A  33 HIS  CD2 :   -0.576:        0
:  2060:A  33 HIS  NE2 :A  14 TYR  CZ  :   -0.548:        0

:  2060:A  65 LYS  N   :A  64 LEU 3HD1 :   -0.591:        0
:  2060:A  64 LEU  CD1 :A  64 LEU  C   :   -0.452:        0
:  2060:A  64 LEU  C   :A  64 LEU 3HD1 :   -0.405:        0

:  2060:A  38 LYS  N   :A  36 ASN  O   :   -0.573:        0
:  2060:A  35 ASP  OD1 :A  35 ASP  N   :   -0.461:        0
:  2060:A  36 ASN  O   :A  37 ASP  C   :   -0.457:        0
:  2060:A 118 LEU 2HD2 :A  35 ASP  O   :   -0.433:        0
:  2060:A  39 TRP  O   :A  39 TRP  CE3 :   -0.432:        0
:  2060:A  36 ASN 2HD2 :A 118 LEU 3HD2 :   -0.412:        0
:  2060:A  39 TRP  CD1 :A  37 ASP  O   :   -0.412:        0

:  2060:A  11 GLN  O   :A  15 ASP  N   :   -0.571:        0
:  2060:A  15 ASP  H   :A  11 GLN  C   :   -0.465:        0
:  2060:A  15 ASP  OD1 :A  11 GLN  O   :   -0.421:        0

:  2060:A  43 LEU  C   :A  43 LEU 3HD2 :   -0.520:        0
:  2060:A  60 ASP  OD2 :A  43 LEU 1HD2 :   -0.505:        0
:  2060:A  43 LEU 1HD2 :A  60 ASP  OD1 :   -0.504:        0
:  2060:A  60 ASP  CG  :A  43 LEU 1HD2 :   -0.486:        0

:  2060:A 125 HIS  O   :A 125 HIS  CG  :   -0.501:        0

:  2060:A  85 HIS  O   :A  85 HIS  CG  :   -0.495:        0
:  2060:A  85 HIS  CD2 :A  85 HIS  O   :   -0.471:        0
:  2060:A  84 TYR  O   :A  85 HIS  C   :   -0.407:        0

:  2060:A   3 ARG  NH2 :A   1 MET  O   :   -0.492:        0
:  2060:A   3 ARG  CA  :A   3 ARG  NE  :   -0.461:        0
:  2060:A   3 ARG  O   :A   4 GLN  C   :   -0.432:        0

:  2060:A 115 LEU 1HD2 :A  67 GLN 2HG  :   -0.491:        0
:  2060:A  67 GLN 2HE2 :A  70 LEU 2HD1 :   -0.484:        0

:  2060:A   9 TYR  CE1 :A 109 ILE 1HG2 :   -0.466:        0
:  2060:A   9 TYR  CD1 :A   9 TYR  C   :   -0.446:        0

:  2060:A  88 LYS  NZ  :A  82 PRO  CB  :   -0.452:        0
:  2060:A  88 LYS  NZ  :A  75 ARG 1HH2 :   -0.426:        0
:  2060:A  82 PRO 1HB  :A  88 LYS 2HZ  :   -0.409:        0

:  2060:A  71 VAL 2HG1 :A  68 PRO  O   :   -0.451:        0

:  2060:A  42 LEU  N   :A  42 LEU 3HD2 :   -0.435:        0

:  2060:A  63 ASP  OD1 :A  63 ASP  C   :   -0.433:        0

:  2060:A  49 GLU  OE1 :A  49 GLU  C   :   -0.431:        0

:  2060:A  20 HIS  ND1 :A  20 HIS  N   :   -0.426:        0

:  2060:A  56 ASP  N   :A  56 ASP  OD1 :   -0.403:        0
#sum2 ::25.24 clashscore : 25.24 clashscore B<40 
#summary::2060 atoms:2060 atoms B<40:229379 potential dots:14340.0 A^2:52 bumps:52 bumps B<40:407.4 score

List of bad contacts calculated by MAGE for model $num_n

/farm/software/bin/probe

:  2060:A  80 ILE  N   :A  80 ILE 2HD1 :   -0.720:        0
:  2060:A  80 ILE  N   :A  80 ILE  CD1 :   -0.574:        0

:  2060:A  74 LEU  H   :A  74 LEU 3HD2 :   -0.691:        0
:  2060:A  74 LEU  H   :A  74 LEU  CD2 :   -0.577:        0
:  2060:A  74 LEU 3HD2 :A  74 LEU  N   :   -0.494:        0

:  2060:A 119 GLU  H   :A 119 GLU  CD  :   -0.683:        0

:  2060:A  60 ASP  H   :A  97 ASN  ND2 :   -0.677:        0
:  2060:A  45 ASP  OD2 :A   3 ARG  NH1 :   -0.493:        0
:  2060:A  97 ASN 2HD2 :A  60 ASP  H   :   -0.488:        0
:  2060:A  60 ASP  OD1 :A  45 ASP  OD1 :   -0.418:        0

:  2060:A  43 LEU  C   :A  43 LEU 3HD2 :   -0.563:        0
:  2060:A  43 LEU 3HD2 :A  44 MET  N   :   -0.417:        0
:  2060:A   6 PHE  CD1 :A  43 LEU 2HD1 :   -0.411:        0

:  2060:A  14 TYR  CZ  :A  39 TRP  CE2 :   -0.543:        0
:  2060:A  11 GLN  O   :A  15 ASP  N   :   -0.521:        0
:  2060:A  39 TRP  CH2 :A  14 TYR  OH  :   -0.511:        0
:  2060:A  14 TYR  CZ  :A  39 TRP  CZ2 :   -0.492:        0
:  2060:A  15 ASP  C   :A  14 TYR  O   :   -0.488:        0
:  2060:A  39 TRP  CZ2 :A  14 TYR  CE2 :   -0.466:        0
:  2060:A  16 THR  N   :A  14 TYR  O   :   -0.459:        0
:  2060:A  15 ASP  OD1 :A  14 TYR  C   :   -0.438:        0
:  2060:A  14 TYR  C   :A  15 ASP  CG  :   -0.418:        0
:  2060:A  14 TYR  C   :A  16 THR  N   :   -0.416:        0

:  2060:A 120 HIS  ND1 :A 121 HIS  N   :   -0.539:        0
:  2060:A 120 HIS  H   :A 118 LEU  C   :   -0.416:        0

:  2060:A  20 HIS  N   :A  20 HIS  CD2 :   -0.530:        0
:  2060:A  28 TYR  O   :A  20 HIS  ND1 :   -0.475:        0
:  2060:A  20 HIS  CD2 :A  19 ASP  C   :   -0.473:        0

:  2060:A   5 GLN  OE1 :A   5 GLN  N   :   -0.526:        0
:  2060:A   5 GLN  OE1 :A   5 GLN  CA  :   -0.480:        0

:  2060:A  64 LEU  N   :A  63 ASP  OD1 :   -0.519:        0

:  2060:A  71 VAL 2HG1 :A  68 PRO  O   :   -0.497:        0

:  2060:A 100 LEU  H   :A 100 LEU 3HD2 :   -0.475:        0

:  2060:A  36 ASN  OD1 :A  37 ASP  N   :   -0.455:        0
:  2060:A  36 ASN  C   :A  38 LYS  H   :   -0.445:        0
:  2060:A  36 ASN  C   :A  38 LYS  N   :   -0.405:        0
:  2060:A  36 ASN  OD1 :A  36 ASN  C   :   -0.404:        0

:  2060:A 115 LEU 2HD2 :A  67 GLN 2HG  :   -0.443:        0

:  2060:A  96 LEU  C   :A  98 GLY  H   :   -0.440:        0

:  2060:A  17 LYS  CD  :A  17 LYS  H   :   -0.422:        0

:  2060:A  53 ILE 2HD1 :A  51 ILE  CD1 :   -0.417:        0

:  2060:A  35 ASP  OD1 :A  35 ASP  C   :   -0.409:        0

:  2060:A  84 TYR  CD1 :A  84 TYR  C   :   -0.403:        0
#sum2 ::20.87 clashscore : 20.87 clashscore B<40 
#summary::2060 atoms:2060 atoms B<40:229618 potential dots:14350.0 A^2:43 bumps:43 bumps B<40:467.7 score

List of bad contacts calculated by MAGE for model $num_n

/farm/software/bin/probe

:  2060:A 118 LEU 1HD2 :A  36 ASN  ND2 :   -0.710:        0
:  2060:A  36 ASN  C   :A  38 LYS  H   :   -0.577:        0
:  2060:A 118 LEU  CD2 :A  36 ASN  ND2 :   -0.569:        0
:  2060:A 118 LEU 1HD2 :A  36 ASN  CG  :   -0.516:        0
:  2060:A  36 ASN  C   :A  38 LYS  N   :   -0.425:        0

:  2060:A  43 LEU  C   :A  43 LEU 3HD2 :   -0.700:        0
:  2060:A  43 LEU 3HD2 :A  44 MET  N   :   -0.559:        0
:  2060:A  43 LEU  C   :A  43 LEU  CD2 :   -0.508:        0
:  2060:A  44 MET  SD  :A  46 ILE 3HG2 :   -0.476:        0
:  2060:A  44 MET  SD  :A  44 MET  C   :   -0.448:        0
:  2060:A  28 TYR  CD2 :A  44 MET  CB  :   -0.413:        0

:  2060:A  65 LYS  N   :A  64 LEU 3HD1 :   -0.664:        0
:  2060:A  64 LEU 3HD1 :A  65 LYS  H   :   -0.418:        0
:  2060:A  64 LEU 2HD2 :A  64 LEU  HA  :   -0.413:        0
:  2060:A  64 LEU  C   :A  64 LEU  CD1 :   -0.408:        0

:  2060:A  92 ILE  CD1 :A  75 ARG 1HH2 :   -0.613:        0
:  2060:A  74 LEU  CD2 :A  92 ILE 1HG2 :   -0.581:        0
:  2060:A  75 ARG  HE  :A  92 ILE 2HD1 :   -0.464:        0
:  2060:A  92 ILE  CD1 :A  75 ARG  NH2 :   -0.432:        0
:  2060:A 108 LEU 2HD2 :A  74 LEU 2HD1 :   -0.402:        0
:  2060:A  88 LYS 1HG  :A  75 ARG  NH2 :   -0.400:        0

:  2060:A  55 GLY  H   :A  53 ILE  C   :   -0.595:        0
:  2060:A  48 ALA 3HB  :A  55 GLY  O   :   -0.566:        0
:  2060:A  48 ALA 2HB  :A  57 LYS  O   :   -0.546:        0
:  2060:A  53 ILE 2HD1 :A  51 ILE  CD1 :   -0.463:        0
:  2060:A  53 ILE 2HG2 :A  55 GLY  H   :   -0.459:        0
:  2060:A  53 ILE  C   :A  55 GLY  N   :   -0.437:        0

:  2060:A  27 ASP  OD1 :A  27 ASP  N   :   -0.552:        0

:  2060:A  11 GLN  O   :A  15 ASP  N   :   -0.528:        0
:  2060:A  11 GLN  O   :A  15 ASP  CA  :   -0.429:        0

:  2060:A 120 HIS  O   :A 122 HIS  N   :   -0.525:        0
:  2060:A 122 HIS  H   :A 120 HIS  C   :   -0.522:        0
:  2060:A 120 HIS  C   :A 122 HIS  N   :   -0.509:        0

:  2060:A 112 SER  O   :A 116 THR 3HG2 :   -0.524:        0
:  2060:A 116 THR 1HG2 :A  39 TRP  CE3 :   -0.509:        0
:  2060:A  39 TRP  CD1 :A  39 TRP  C   :   -0.443:        0
:  2060:A  41 ALA 2HB  :A  39 TRP  HE1 :   -0.430:        0

:  2060:A 100 LEU  CD2 :A 100 LEU  N   :   -0.491:        0
:  2060:A 100 LEU 2HD2 :A 100 LEU  N   :   -0.477:        0
:  2060:A 100 LEU 1HD2 :A  78 PRO  O   :   -0.415:        0

:  2060:A  72 GLY  N   :A  71 VAL 3HG1 :   -0.480:        0
:  2060:A  71 VAL 2HG1 :A  68 PRO  O   :   -0.451:        0

:  2060:A  19 ASP  OD1 :A  20 HIS  N   :   -0.467:        0

:  2060:A  96 LEU  C   :A  98 GLY  H   :   -0.464:        0

:  2060:A 106 HIS  ND1 :A 102 ALA  O   :   -0.463:        0

:  2060:A  87 ASN  O   :A  86 MET  O   :   -0.443:        0
:  2060:A  85 HIS  O   :A  86 MET  O   :   -0.432:        0
:  2060:A  85 HIS  ND1 :A  84 TYR  CD2 :   -0.421:        0
:  2060:A  84 TYR  CD1 :A  84 TYR  N   :   -0.411:        0

:  2060:A  22 TRP  C   :A  24 LYS  N   :   -0.434:        0
:  2060:A  22 TRP  N   :A  22 TRP  CD1 :   -0.432:        0

:  2060:A  25 PHE  H   :A  23 GLU  C   :   -0.422:        0

:  2060:A  60 ASP  OD1 :A  45 ASP  OD1 :   -0.419:        0
#sum2 ::25.73 clashscore : 25.73 clashscore B<40 
#summary::2060 atoms:2060 atoms B<40:229404 potential dots:14340.0 A^2:53 bumps:53 bumps B<40:416.6 score

List of bad contacts calculated by MAGE for model $num_n

/farm/software/bin/probe

:  2060:A  60 ASP  H   :A  97 ASN  ND2 :   -0.677:        0
:  2060:A   3 ARG  NH2 :A  45 ASP  OD1 :   -0.512:        0
:  2060:A  60 ASP  OD1 :A  45 ASP  OD1 :   -0.437:        0
:  2060:A  60 ASP  H   :A  97 ASN 2HD2 :   -0.430:        0

:  2060:A 118 LEU 1HD2 :A  36 ASN  ND2 :   -0.651:        0
:  2060:A  33 HIS  ND1 :A  39 TRP  CD1 :   -0.594:        0
:  2060:A  38 LYS  N   :A  36 ASN  O   :   -0.561:        0
:  2060:A  36 ASN 2HD2 :A 118 LEU 1HD2 :   -0.499:        0
:  2060:A 118 LEU  CD2 :A  36 ASN  ND2 :   -0.443:        0
:  2060:A 118 LEU  CD2 :A  36 ASN 2HD2 :   -0.443:        0
:  2060:A 119 GLU  C   :A 118 LEU  O   :   -0.441:        0
:  2060:A  39 TRP  NE1 :A  33 HIS  CE1 :   -0.437:        0
:  2060:A  39 TRP  C   :A  38 LYS  O   :   -0.432:        0
:  2060:A  37 ASP  O   :A  38 LYS  O   :   -0.423:        0
:  2060:A 119 GLU  O   :A 118 LEU  O   :   -0.419:        0
:  2060:A 118 LEU  O   :A 119 GLU  CG  :   -0.406:        0
:  2060:A  39 TRP  O   :A  38 LYS  O   :   -0.405:        0

:  2060:A  80 ILE  N   :A  80 ILE 2HD1 :   -0.624:        0
:  2060:A  74 LEU  N   :A  74 LEU  CD2 :   -0.584:        0
:  2060:A  74 LEU  N   :A  74 LEU 2HD2 :   -0.497:        0
:  2060:A  80 ILE 3HD1 :A  77 LYS  CB  :   -0.462:        0
:  2060:A  80 ILE  N   :A  80 ILE  CD1 :   -0.423:        0
:  2060:A  77 LYS  CG  :A  73 SER  O   :   -0.410:        0
:  2060:A  74 LEU  O   :A  80 ILE 1HG2 :   -0.409:        0
:  2060:A  66 VAL 1HG1 :A  74 LEU  HG  :   -0.405:        0

:  2060:A  71 VAL 2HG1 :A  68 PRO  O   :   -0.614:        0
:  2060:A  92 ILE 1HD1 :A  71 VAL 3HG2 :   -0.509:        0

:  2060:A  53 ILE 2HD1 :A  51 ILE 2HD1 :   -0.613:        0
:  2060:A  53 ILE  O   :A  55 GLY  N   :   -0.566:        0
:  2060:A  53 ILE 2HD1 :A  51 ILE  CD1 :   -0.543:        0
:  2060:A  55 GLY  O   :A  49 GLU  N   :   -0.510:        0

:  2060:A 100 LEU  O   :A 100 LEU 2HD1 :   -0.544:        0

:  2060:A 115 LEU  N   :A 115 LEU 2HD1 :   -0.544:        0
:  2060:A 115 LEU  N   :A 115 LEU  CD1 :   -0.437:        0

:  2060:A 100 LEU 2HD1 :A 100 LEU  C   :   -0.405:        0

:  2060:A  48 ALA 2HB  :A  57 LYS  O   :   -0.533:        0

:  2060:A 113 PHE  CD1 :A  14 TYR  OH  :   -0.521:        0

:  2060:A  11 GLN  O   :A  15 ASP  N   :   -0.521:        0

:  2060:A 113 PHE  CE1 :A  14 TYR  OH  :   -0.477:        0

:  2060:A  76 LYS  CG  :A  72 GLY  O   :   -0.511:        0

:  2060:A 120 HIS  CG  :A 121 HIS  N   :   -0.504:        0

:  2060:A  85 HIS  O   :A  86 MET  O   :   -0.460:        0

:  2060:A  20 HIS  N   :A  20 HIS  CD2 :   -0.454:        0

:  2060:A  54 ASN  OD1 :A  54 ASN  C   :   -0.432:        0

:  2060:A  96 LEU  C   :A  98 GLY  H   :   -0.423:        0

:  2060:A  43 LEU  C   :A  43 LEU 3HD2 :   -0.418:        0

:  2060:A   2 ASN  N   :A   1 MET  CG  :   -0.408:        0
#sum2 ::22.82 clashscore : 22.82 clashscore B<40 
#summary::2060 atoms:2060 atoms B<40:229410 potential dots:14340.0 A^2:47 bumps:47 bumps B<40:449.3 score

List of bad contacts calculated by MAGE for model $num_n

/farm/software/bin/probe

:  2060:A  53 ILE 2HD1 :A  51 ILE 2HD1 :   -0.795:        0
:  2060:A  53 ILE  O   :A  55 GLY  N   :   -0.561:        0
:  2060:A  53 ILE 2HD1 :A  51 ILE  CD1 :   -0.520:        0
:  2060:A  53 ILE  O   :A  54 ASN  C   :   -0.463:        0

:  2060:A  41 ALA 3HB  :A  31 PHE 1HB  :   -0.701:        0

:  2060:A  91 TRP  CZ3 :A  87 ASN  ND2 :   -0.612:        0
:  2060:A  87 ASN  C   :A  89 GLU  H   :   -0.549:        0
:  2060:A  87 ASN  O   :A  89 GLU  N   :   -0.487:        0
:  2060:A  87 ASN  ND2 :A  91 TRP  CE3 :   -0.473:        0
:  2060:A  87 ASN  C   :A  89 GLU  N   :   -0.404:        0

:  2060:A  43 LEU  C   :A  43 LEU 3HD2 :   -0.592:        0
:  2060:A  28 TYR  CE2 :A  44 MET  SD  :   -0.510:        0
:  2060:A  43 LEU 3HD2 :A  44 MET  N   :   -0.473:        0
:  2060:A   6 PHE  CD2 :A  43 LEU 2HD1 :   -0.443:        0

:  2060:A  74 LEU  H   :A  74 LEU 3HD2 :   -0.583:        0
:  2060:A  74 LEU  H   :A  74 LEU  CD2 :   -0.571:        0
:  2060:A  74 LEU 3HD2 :A  74 LEU  N   :   -0.497:        0

:  2060:A  77 LYS 3HZ  :A  77 LYS 2HB  :   -0.570:        0
:  2060:A  77 LYS  NZ  :A  77 LYS  CB  :   -0.563:        0
:  2060:A  77 LYS 3HZ  :A  77 LYS  CB  :   -0.552:        0
:  2060:A  78 PRO  C   :A  80 ILE  H   :   -0.514:        0
:  2060:A  80 ILE 2HD1 :A  77 LYS 1HB  :   -0.449:        0

:  2060:A  27 ASP  OD1 :A  27 ASP  N   :   -0.541:        0

:  2060:A 123 HIS  O   :A 123 HIS  CG  :   -0.517:        0
:  2060:A 123 HIS  CD2 :A 123 HIS  O   :   -0.458:        0

:  2060:A  45 ASP  OD2 :A   3 ARG  NH2 :   -0.515:        0
:  2060:A   3 ARG  NH2 :A  45 ASP  OD1 :   -0.413:        0
:  2060:A  45 ASP  CG  :A   3 ARG  NH2 :   -0.408:        0

:  2060:A 115 LEU  N   :A 114 GLN  CG  :   -0.512:        0
:  2060:A 114 GLN  NE2 :A 111 ASP  O   :   -0.446:        0

:  2060:A 100 LEU  CD2 :A 100 LEU  N   :   -0.510:        0
:  2060:A 100 LEU 2HD2 :A 100 LEU  N   :   -0.492:        0
:  2060:A  99 PRO  O   :A 100 LEU  O   :   -0.461:        0

:  2060:A  76 LYS  CD  :A  73 SER  O   :   -0.490:        0

:  2060:A  20 HIS  O   :A  20 HIS  CG  :   -0.490:        0

:  2060:A  84 TYR  O   :A  84 TYR  CD1 :   -0.484:        0
:  2060:A  84 TYR  O   :A  85 HIS  C   :   -0.431:        0
:  2060:A  85 HIS  O   :A  85 HIS  CG  :   -0.429:        0

:  2060:A  56 ASP  H   :A  49 GLU 2HB  :   -0.473:        0

:  2060:A 105 ILE  CD1 :A   1 MET  N   :   -0.458:        0
:  2060:A  96 LEU  CD2 :A 105 ILE 3HD1 :   -0.445:        0
:  2060:A  96 LEU 1HD1 :A  62 ILE 3HG2 :   -0.444:        0

:  2060:A  67 GLN 2HE2 :A  70 LEU 2HD1 :   -0.434:        0

:  2060:A   5 GLN 2HE2 :A   2 ASN 2HD2 :   -0.418:        0

:  2060:A  71 VAL 2HG1 :A  68 PRO  O   :   -0.416:        0

:  2060:A  38 LYS 2HG  :A  39 TRP  N   :   -0.414:        0

:  2060:A  83 ALA 1HB  :A  86 MET 1HB  :   -0.413:        0

:  2060:A  29 ALA  O   :A  42 LEU 2HD1 :   -0.406:        0
#sum2 ::23.30 clashscore : 23.30 clashscore B<40 
#summary::2060 atoms:2060 atoms B<40:229631 potential dots:14350.0 A^2:48 bumps:48 bumps B<40:479.6 score

List of bad contacts calculated by MAGE for model $num_n

/farm/software/bin/probe

:  2060:A 108 LEU 1HD2 :A  77 LYS  NZ  :   -0.759:        0
:  2060:A 108 LEU 1HD2 :A  77 LYS 3HZ  :   -0.629:        0
:  2060:A  74 LEU  CD2 :A  92 ILE 1HG2 :   -0.600:        0
:  2060:A  71 VAL 2HG1 :A  68 PRO  O   :   -0.558:        0
:  2060:A  72 GLY  N   :A  71 VAL 3HG1 :   -0.553:        0
:  2060:A  92 ILE 1HD1 :A  71 VAL 3HG2 :   -0.479:        0
:  2060:A  74 LEU 3HD1 :A  66 VAL 1HG1 :   -0.475:        0
:  2060:A  72 GLY  N   :A  71 VAL  CG1 :   -0.471:        0
:  2060:A 108 LEU 2HD2 :A  74 LEU 2HD1 :   -0.460:        0
:  2060:A  92 ILE  CD1 :A  71 VAL 3HG2 :   -0.458:        0

:  2060:A  43 LEU  C   :A  43 LEU 3HD2 :   -0.629:        0
:  2060:A  28 TYR  CE2 :A  44 MET  SD  :   -0.586:        0
:  2060:A  44 MET  CE  :A  84 TYR  OH  :   -0.503:        0
:  2060:A  43 LEU  C   :A  43 LEU  CD2 :   -0.449:        0
:  2060:A  43 LEU 3HD2 :A  44 MET  N   :   -0.421:        0

:  2060:A 106 HIS  CD2 :A   9 TYR  CE2 :   -0.622:        0
:  2060:A   9 TYR  N   :A   8 ASP  OD1 :   -0.520:        0
:  2060:A   9 TYR  N   :A   8 ASP  CG  :   -0.466:        0
:  2060:A   8 ASP  C   :A   8 ASP  OD1 :   -0.449:        0
:  2060:A   9 TYR  CE2 :A 106 HIS  NE2 :   -0.408:        0

:  2060:A  14 TYR  CD1 :A  33 HIS  NE2 :   -0.609:        0
:  2060:A  11 GLN  O   :A  15 ASP  N   :   -0.556:        0
:  2060:A  14 TYR  CD1 :A  33 HIS  CE1 :   -0.553:        0
:  2060:A  15 ASP  C   :A  14 TYR  O   :   -0.460:        0
:  2060:A  14 TYR  C   :A  15 ASP  CG  :   -0.454:        0
:  2060:A  39 TRP  CZ2 :A 116 THR 1HG2 :   -0.433:        0
:  2060:A  15 ASP  OD1 :A  14 TYR  O   :   -0.422:        0
:  2060:A  39 TRP  NE1 :A  33 HIS  CE1 :   -0.412:        0

:  2060:A  65 LYS  N   :A  64 LEU 3HD1 :   -0.589:        0
:  2060:A 112 SER  OG  :A  64 LEU 1HD2 :   -0.565:        0
:  2060:A  64 LEU 1HD1 :A 112 SER  OG  :   -0.480:        0
:  2060:A  64 LEU  CD1 :A  64 LEU  C   :   -0.450:        0
:  2060:A 112 SER  H   :A 112 SER  HG  :   -0.444:        0
:  2060:A  64 LEU  C   :A  64 LEU 3HD1 :   -0.430:        0

:  2060:A  38 LYS  N   :A  36 ASN  O   :   -0.571:        0
:  2060:A  36 ASN  O   :A  36 ASN  OD1 :   -0.406:        0

:  2060:A  45 ASP  OD2 :A   3 ARG  NH2 :   -0.530:        0
:  2060:A  45 ASP  CG  :A   3 ARG  NH2 :   -0.524:        0
:  2060:A   3 ARG  NH2 :A  45 ASP  OD1 :   -0.458:        0
:  2060:A  60 ASP  OD1 :A  45 ASP  OD1 :   -0.418:        0

:  2060:A 115 LEU  N   :A 115 LEU 2HD2 :   -0.525:        0
:  2060:A 115 LEU  CD2 :A 115 LEU  N   :   -0.523:        0

:  2060:A  41 ALA  C   :A  42 LEU 2HD2 :   -0.523:        0
:  2060:A  42 LEU  N   :A  42 LEU  CD2 :   -0.425:        0
:  2060:A  63 ASP 2HB  :A  42 LEU  H   :   -0.410:        0

:  2060:A  20 HIS  ND1 :A  20 HIS  O   :   -0.512:        0
:  2060:A  20 HIS  O   :A  20 HIS  CG  :   -0.449:        0

:  2060:A   2 ASN  ND2 :A   1 MET  O   :   -0.511:        0
:  2060:A   1 MET  SD  :A 105 ILE 2HD1 :   -0.474:        0

:  2060:A  24 LYS  C   :A  25 PHE  CG  :   -0.503:        0
:  2060:A  25 PHE  CD1 :A  24 LYS  O   :   -0.497:        0
:  2060:A  25 PHE  CG  :A  24 LYS  O   :   -0.485:        0

:  2060:A 124 HIS  O   :A 122 HIS  ND1 :   -0.501:        0
:  2060:A 124 HIS  ND1 :A 124 HIS  C   :   -0.450:        0

:  2060:A  96 LEU 1HD1 :A  62 ILE 3HG2 :   -0.455:        0

:  2060:A  37 ASP  O   :A  32 ARG  NH2 :   -0.449:        0

:  2060:A 103 LYS 2HG  :A 104 GLU  N   :   -0.405:        0
#sum2 ::27.67 clashscore : 27.67 clashscore B<40 
#summary::2060 atoms:2060 atoms B<40:229542 potential dots:14350.0 A^2:57 bumps:57 bumps B<40:386 score

List of bad contacts calculated by MAGE for model $num_n

/farm/software/bin/probe

:  2060:A  65 LYS  N   :A  64 LEU 3HD1 :   -0.631:        0
:  2060:A  64 LEU  C   :A  64 LEU  CD1 :   -0.429:        0
:  2060:A  64 LEU 2HD2 :A  64 LEU  HA  :   -0.418:        0

:  2060:A  88 LYS  NZ  :A  75 ARG  NH1 :   -0.605:        0
:  2060:A  83 ALA 3HB  :A  88 LYS  H   :   -0.518:        0
:  2060:A  75 ARG  C   :A  77 LYS  H   :   -0.426:        0
:  2060:A  75 ARG  NH1 :A  88 LYS 3HZ  :   -0.407:        0

:  2060:A  43 LEU  C   :A  43 LEU 3HD2 :   -0.603:        0
:  2060:A  43 LEU 3HD2 :A  44 MET  N   :   -0.421:        0
:  2060:A  43 LEU  CD2 :A  43 LEU  C   :   -0.413:        0

:  2060:A 100 LEU  C   :A  99 PRO  O   :   -0.562:        0

:  2060:A  89 GLU  N   :A  87 ASN  O   :   -0.555:        0
:  2060:A  91 TRP  CD1 :A  87 ASN  CG  :   -0.439:        0

:  2060:A  48 ALA 1HB  :A  53 ILE  HB  :   -0.547:        0
:  2060:A  53 ILE 2HD1 :A  51 ILE  CD1 :   -0.446:        0

:  2060:A  37 ASP  N   :A  33 HIS  O   :   -0.516:        0
:  2060:A  36 ASN  O   :A  37 ASP  CG  :   -0.485:        0
:  2060:A  36 ASN  O   :A  37 ASP  OD2 :   -0.421:        0

:  2060:A  71 VAL 2HG1 :A  68 PRO  O   :   -0.512:        0
:  2060:A  76 LYS  CG  :A  72 GLY  O   :   -0.498:        0
:  2060:A  72 GLY  N   :A  71 VAL 3HG1 :   -0.487:        0
:  2060:A  72 GLY  N   :A  71 VAL  CG1 :   -0.416:        0

:  2060:A  11 GLN  O   :A  15 ASP  N   :   -0.499:        0
:  2060:A  15 ASP  OD1 :A  11 GLN  O   :   -0.423:        0

:  2060:A 120 HIS  O   :A 120 HIS  CG  :   -0.491:        0
:  2060:A 120 HIS  CD2 :A 120 HIS  O   :   -0.479:        0

:  2060:A  70 LEU 1HB  :A  67 GLN  H   :   -0.467:        0

:  2060:A 106 HIS  NE2 :A   9 TYR  CD2 :   -0.448:        0
:  2060:A 106 HIS  CE1 :A   9 TYR  CD2 :   -0.402:        0

:  2060:A  23 GLU  OE1 :A  23 GLU  C   :   -0.445:        0

:  2060:A  55 GLY  C   :A  54 ASN  O   :   -0.443:        0

:  2060:A 122 HIS  O   :A 122 HIS  CG  :   -0.439:        0

:  2060:A  46 ILE 3HG2 :A  45 ASP  O   :   -0.437:        0
:  2060:A  45 ASP  O   :A  46 ILE  CG2 :   -0.421:        0
:  2060:A  45 ASP  O   :A  45 ASP  OD1 :   -0.419:        0
:  2060:A  46 ILE 3HG2 :A  45 ASP  C   :   -0.413:        0

:  2060:A 118 LEU  C   :A 117 ARG  O   :   -0.430:        0
:  2060:A 117 ARG  O   :A 118 LEU  O   :   -0.404:        0

:  2060:A 121 HIS  C   :A 123 HIS  N   :   -0.421:        0
:  2060:A 121 HIS  C   :A 123 HIS  H   :   -0.420:        0

:  2060:A  42 LEU  N   :A  42 LEU 3HD2 :   -0.411:        0

:  2060:A   2 ASN  OD1 :A   2 ASN  C   :   -0.404:        0
#sum2 ::20.39 clashscore : 20.39 clashscore B<40 
#summary::2060 atoms:2060 atoms B<40:229685 potential dots:14360.0 A^2:42 bumps:42 bumps B<40:445.3 score

Output from PDB validation software

Summary from PDB validation

                                                       May. 10, 15:45:40 2013

[ Text modified to reflect that this was run under PSVS - Aneerban Bhattacharya: Dec 2005 ]


The following checks were made on :
-----------------------------------------

CLOSE CONTACTS

==> Distances smaller than 2.2 Angstroms are considered as close contacts
    for heavy atoms, 1.6 Angstroms for hydrogens.

   Chain Atom    Res  Seq   Chain Atom    Res  Seq   Mol_ID            Distance
   -------------------------------------------------------------------------
       A  H      ASP   60 -     A 2HD2    ASN   97        8            Dist = 1.36
       A  HH     TYR    9 -     A 1HZ     LYS   13        5            Dist = 1.37
       A 2HH2    ARG   75 -     A 2HZ     LYS   88       10            Dist = 1.40
       A  HD1    HIS  123 -     A  H      HIS  125        6            Dist = 1.44
       A  H      ASP   60 -     A 2HD2    ASN   97       11            Dist = 1.47
       A  H      ASP   60 -     A 2HD2    ASN   97       15            Dist = 1.48
       A  H      ASP   60 -     A 2HD2    ASN   97       17            Dist = 1.53
       A  O      ASN   87 -     A  H      GLU   89       18            Dist = 1.54
       A  HE1    TRP   39 -     A  HG1    THR  116       19            Dist = 1.56
       A 2HD2    ASN    2 -     A 2HE2    GLN    5       18            Dist = 1.59


DISTANCES AND ANGLES 

We have checked your intra and intermolecular distances and angles with the
procedures currently in place at PDB:

==> Bond and angle checks are performed by first computing the average rms
    error for all bonds and angles relative to standard values for nucleotide
    units [L. Clowney et al., Geometric Parameters in Nucleic Acids: Nitrogenous
    Bases, J.Am.Chem.Soc. 1996, 118, 509-518; A. Gelbin et al., Geometric
    Parameters in Nucleic Acids: Sugar and Phosphate Constituents, J.Am.Chem.Soc.
    1996, 118, 519-529] and amino acid units [R.A. Engh and R. Huber, Accurate
    Bond and Angle Parameters for X-ray protein structure refinement, Acta
    Crystallogr. 1991, A47, 392-400]. Any bond or angle which deviates from the
    dictionary values by more than six times this computed rms error is 
    identified as an outlier.



    *** Covalent Bond Lengths:


The RMS deviation for covalent bonds relative to the standard 
dictionary is   0.019 Angstroms

All covalent bonds lie within a 6.0*RMSD range about the 
standard dictionary values.

    *** Covalent Angle Values:


The RMS deviation for covalent angles relative to the standard 
dictionary is    1.7 degrees.


All covalent bond angles lie within a 6.0*RMSD range about the 
standard dictionary values.


TORSION ANGLES
 
The torsion angle distributions have been checked.  The postscript file of the
conformation rings showing the torsion angle distributions will be sent in a
separate E-mail message.


CHIRALITY

The chirality has been checked. O1P, O2P, and hydrogen atoms which do not
follow the convention defined in the IUBMB (Liebecq, C. Compendium of
Biochemical Nomenclature and Related Documents, 2nd ed.; Portland Press:
London and Chapel Hill, 1992) and IUPAC nomenclature (J.L. Markley, A. Bax,
Y. Arata, C.W. Hilbers, R. Kaptein, B.D. Sykes, P.E. Wright and K. W�thrich,
Recommendations for the Presentation of NMR Structures of Proteins and
Nucleic Acids, Pure & Appl. Chem., Vol. 70, pp. 117-142, 1998) have been
standardized.  Any other stereochemical violations are listed below.


E/Z NOMENCLATURE

E/Z nomenclature of hydrogens and/or nitrogens on Arg, Asn or Gln residues needs
to be corrected to conform with the standard for E/Z orientation presented in
[J.L. Markley, et al., Recommendations for the Presentation of NMR Structures of
Proteins and Nucleic Acids, Pure & Appl. Chem., 1998, 70, 117-142]. 

Model  Chain  Residue  Residue  Atom Name  Original
               Name    Number              Atom Name
-----  -----  -------  -------  --------   ---------
  1    A       ASN        2      1HD2
  1    A       ASN        2      2HD2
  1    A       GLN        4      1HE2
  1    A       GLN        4      2HE2
  1    A       GLN        5      1HE2
  1    A       GLN        5      2HE2
  1    A       GLN       11      1HE2
  1    A       GLN       11      2HE2
  1    A       ASN       36      1HD2
  1    A       ASN       36      2HD2
  1    A       ASN       54      1HD2
  1    A       ASN       54      2HD2
  1    A       GLN       67      1HE2
  1    A       GLN       67      2HE2
  1    A       ASN       87      1HD2
  1    A       ASN       87      2HD2
  1    A       ASN       97      1HD2
  1    A       ASN       97      2HD2
  1    A       GLN      114      1HE2
  1    A       GLN      114      2HE2
  2    A       ASN        2      1HD2
  2    A       ASN        2      2HD2
  2    A       GLN        4      1HE2
  2    A       GLN        4      2HE2
  2    A       GLN        5      1HE2
  2    A       GLN        5      2HE2
  2    A       GLN       11      1HE2
  2    A       GLN       11      2HE2
  2    A       ASN       36      1HD2
  2    A       ASN       36      2HD2
  2    A       ASN       54      1HD2
  2    A       ASN       54      2HD2
  2    A       GLN       67      1HE2
  2    A       GLN       67      2HE2
  2    A       ASN       87      1HD2
  2    A       ASN       87      2HD2
  2    A       ASN       97      1HD2
  2    A       ASN       97      2HD2
  2    A       GLN      114      1HE2
  2    A       GLN      114      2HE2
  3    A       ASN        2      1HD2
  3    A       ASN        2      2HD2
  3    A       GLN        4      1HE2
  3    A       GLN        4      2HE2
  3    A       GLN        5      1HE2
  3    A       GLN        5      2HE2
  3    A       GLN       11      1HE2
  3    A       GLN       11      2HE2
  3    A       ASN       36      1HD2
  3    A       ASN       36      2HD2
  3    A       ASN       54      1HD2
  3    A       ASN       54      2HD2
  3    A       GLN       67      1HE2
  3    A       GLN       67      2HE2
  3    A       ASN       87      1HD2
  3    A       ASN       87      2HD2
  3    A       ASN       97      1HD2
  3    A       ASN       97      2HD2
  3    A       GLN      114      1HE2
  3    A       GLN      114      2HE2
  4    A       ASN        2      1HD2
  4    A       ASN        2      2HD2
  4    A       GLN        4      1HE2
  4    A       GLN        4      2HE2
  4    A       GLN        5      1HE2
  4    A       GLN        5      2HE2
  4    A       GLN       11      1HE2
  4    A       GLN       11      2HE2
  4    A       ASN       36      1HD2
  4    A       ASN       36      2HD2
  4    A       ASN       54      1HD2
  4    A       ASN       54      2HD2
  4    A       GLN       67      1HE2
  4    A       GLN       67      2HE2
  4    A       ASN       87      1HD2
  4    A       ASN       87      2HD2
  4    A       ASN       97      1HD2
  4    A       ASN       97      2HD2
  4    A       GLN      114      1HE2
  4    A       GLN      114      2HE2
  5    A       ASN        2      1HD2
  5    A       ASN        2      2HD2
  5    A       GLN        4      1HE2
  5    A       GLN        4      2HE2
  5    A       GLN        5      1HE2
  5    A       GLN        5      2HE2
  5    A       GLN       11      1HE2
  5    A       GLN       11      2HE2
  5    A       ASN       36      1HD2
  5    A       ASN       36      2HD2
  5    A       ASN       54      1HD2
  5    A       ASN       54      2HD2
  5    A       GLN       67      1HE2
  5    A       GLN       67      2HE2
  5    A       ASN       87      1HD2
  5    A       ASN       87      2HD2
  5    A       ASN       97      1HD2
  5    A       ASN       97      2HD2
  5    A       GLN      114      1HE2
  5    A       GLN      114      2HE2
  6    A       ASN        2      1HD2
  6    A       ASN        2      2HD2
  6    A       GLN        4      1HE2
  6    A       GLN        4      2HE2
  6    A       GLN        5      1HE2
  6    A       GLN        5      2HE2
  6    A       GLN       11      1HE2
  6    A       GLN       11      2HE2
  6    A       ASN       36      1HD2
  6    A       ASN       36      2HD2
  6    A       ASN       54      1HD2
  6    A       ASN       54      2HD2
  6    A       GLN       67      1HE2
  6    A       GLN       67      2HE2
  6    A       ASN       87      1HD2
  6    A       ASN       87      2HD2
  6    A       ASN       97      1HD2
  6    A       ASN       97      2HD2
  6    A       GLN      114      1HE2
  6    A       GLN      114      2HE2
  7    A       ASN        2      1HD2
  7    A       ASN        2      2HD2
  7    A       GLN        4      1HE2
  7    A       GLN        4      2HE2
  7    A       GLN        5      1HE2
  7    A       GLN        5      2HE2
  7    A       GLN       11      1HE2
  7    A       GLN       11      2HE2
  7    A       ASN       36      1HD2
  7    A       ASN       36      2HD2
  7    A       ASN       54      1HD2
  7    A       ASN       54      2HD2
  7    A       GLN       67      1HE2
  7    A       GLN       67      2HE2
  7    A       ASN       87      1HD2
  7    A       ASN       87      2HD2
  7    A       ASN       97      1HD2
  7    A       ASN       97      2HD2
  7    A       GLN      114      1HE2
  7    A       GLN      114      2HE2
  8    A       ASN        2      1HD2
  8    A       ASN        2      2HD2
  8    A       GLN        4      1HE2
  8    A       GLN        4      2HE2
  8    A       GLN        5      1HE2
  8    A       GLN        5      2HE2
  8    A       GLN       11      1HE2
  8    A       GLN       11      2HE2
  8    A       ASN       36      1HD2
  8    A       ASN       36      2HD2
  8    A       ASN       54      1HD2
  8    A       ASN       54      2HD2
  8    A       GLN       67      1HE2
  8    A       GLN       67      2HE2
  8    A       ASN       87      1HD2
  8    A       ASN       87      2HD2
  8    A       ASN       97      1HD2
  8    A       ASN       97      2HD2
  8    A       GLN      114      1HE2
  8    A       GLN      114      2HE2
  9    A       ASN        2      1HD2
  9    A       ASN        2      2HD2
  9    A       GLN        4      1HE2
  9    A       GLN        4      2HE2
  9    A       GLN        5      1HE2
  9    A       GLN        5      2HE2
  9    A       GLN       11      1HE2
  9    A       GLN       11      2HE2
  9    A       ASN       36      1HD2
  9    A       ASN       36      2HD2
  9    A       ASN       54      1HD2
  9    A       ASN       54      2HD2
  9    A       GLN       67      1HE2
  9    A       GLN       67      2HE2
  9    A       ASN       87      1HD2
  9    A       ASN       87      2HD2
  9    A       ASN       97      1HD2
  9    A       ASN       97      2HD2
  9    A       GLN      114      1HE2
  9    A       GLN      114      2HE2
 10    A       ASN        2      1HD2
 10    A       ASN        2      2HD2
 10    A       GLN        4      1HE2
 10    A       GLN        4      2HE2
 10    A       GLN        5      1HE2
 10    A       GLN        5      2HE2
 10    A       GLN       11      1HE2
 10    A       GLN       11      2HE2
 10    A       ASN       36      1HD2
 10    A       ASN       36      2HD2
 10    A       ASN       54      1HD2
 10    A       ASN       54      2HD2
 10    A       GLN       67      1HE2
 10    A       GLN       67      2HE2
 10    A       ASN       87      1HD2
 10    A       ASN       87      2HD2
 10    A       ASN       97      1HD2
 10    A       ASN       97      2HD2
 10    A       GLN      114      1HE2
 10    A       GLN      114      2HE2
 11    A       ASN        2      1HD2
 11    A       ASN        2      2HD2
 11    A       GLN        4      1HE2
 11    A       GLN        4      2HE2
 11    A       GLN        5      1HE2
 11    A       GLN        5      2HE2
 11    A       GLN       11      1HE2
 11    A       GLN       11      2HE2
 11    A       ASN       36      1HD2
 11    A       ASN       36      2HD2
 11    A       ASN       54      1HD2
 11    A       ASN       54      2HD2
 11    A       GLN       67      1HE2
 11    A       GLN       67      2HE2
 11    A       ASN       87      1HD2
 11    A       ASN       87      2HD2
 11    A       ASN       97      1HD2
 11    A       ASN       97      2HD2
 11    A       GLN      114      1HE2
 11    A       GLN      114      2HE2
 12    A       ASN        2      1HD2
 12    A       ASN        2      2HD2
 12    A       GLN        4      1HE2
 12    A       GLN        4      2HE2
 12    A       GLN        5      1HE2
 12    A       GLN        5      2HE2
 12    A       GLN       11      1HE2
 12    A       GLN       11      2HE2
 12    A       ASN       36      1HD2
 12    A       ASN       36      2HD2
 12    A       ASN       54      1HD2
 12    A       ASN       54      2HD2
 12    A       GLN       67      1HE2
 12    A       GLN       67      2HE2
 12    A       ASN       87      1HD2
 12    A       ASN       87      2HD2
 12    A       ASN       97      1HD2
 12    A       ASN       97      2HD2
 12    A       GLN      114      1HE2
 12    A       GLN      114      2HE2
 13    A       ASN        2      1HD2
 13    A       ASN        2      2HD2
 13    A       GLN        4      1HE2
 13    A       GLN        4      2HE2
 13    A       GLN        5      1HE2
 13    A       GLN        5      2HE2
 13    A       GLN       11      1HE2
 13    A       GLN       11      2HE2
 13    A       ASN       36      1HD2
 13    A       ASN       36      2HD2
 13    A       ASN       54      1HD2
 13    A       ASN       54      2HD2
 13    A       GLN       67      1HE2
 13    A       GLN       67      2HE2
 13    A       ASN       87      1HD2
 13    A       ASN       87      2HD2
 13    A       ASN       97      1HD2
 13    A       ASN       97      2HD2
 13    A       GLN      114      1HE2
 13    A       GLN      114      2HE2
 14    A       ASN        2      1HD2
 14    A       ASN        2      2HD2
 14    A       GLN        4      1HE2
 14    A       GLN        4      2HE2
 14    A       GLN        5      1HE2
 14    A       GLN        5      2HE2
 14    A       GLN       11      1HE2
 14    A       GLN       11      2HE2
 14    A       ASN       36      1HD2
 14    A       ASN       36      2HD2
 14    A       ASN       54      1HD2
 14    A       ASN       54      2HD2
 14    A       GLN       67      1HE2
 14    A       GLN       67      2HE2
 14    A       ASN       87      1HD2
 14    A       ASN       87      2HD2
 14    A       ASN       97      1HD2
 14    A       ASN       97      2HD2
 14    A       GLN      114      1HE2
 14    A       GLN      114      2HE2
 15    A       ASN        2      1HD2
 15    A       ASN        2      2HD2
 15    A       GLN        4      1HE2
 15    A       GLN        4      2HE2
 15    A       GLN        5      1HE2
 15    A       GLN        5      2HE2
 15    A       GLN       11      1HE2
 15    A       GLN       11      2HE2
 15    A       ASN       36      1HD2
 15    A       ASN       36      2HD2
 15    A       ASN       54      1HD2
 15    A       ASN       54      2HD2
 15    A       GLN       67      1HE2
 15    A       GLN       67      2HE2
 15    A       ASN       87      1HD2
 15    A       ASN       87      2HD2
 15    A       ASN       97      1HD2
 15    A       ASN       97      2HD2
 15    A       GLN      114      1HE2
 15    A       GLN      114      2HE2
 16    A       ASN        2      1HD2
 16    A       ASN        2      2HD2
 16    A       GLN        4      1HE2
 16    A       GLN        4      2HE2
 16    A       GLN        5      1HE2
 16    A       GLN        5      2HE2
 16    A       GLN       11      1HE2
 16    A       GLN       11      2HE2
 16    A       ASN       36      1HD2
 16    A       ASN       36      2HD2
 16    A       ASN       54      1HD2
 16    A       ASN       54      2HD2
 16    A       GLN       67      1HE2
 16    A       GLN       67      2HE2
 16    A       ASN       87      1HD2
 16    A       ASN       87      2HD2
 16    A       ASN       97      1HD2
 16    A       ASN       97      2HD2
 16    A       GLN      114      1HE2
 16    A       GLN      114      2HE2
 17    A       ASN        2      1HD2
 17    A       ASN        2      2HD2
 17    A       GLN        4      1HE2
 17    A       GLN        4      2HE2
 17    A       GLN        5      1HE2
 17    A       GLN        5      2HE2
 17    A       GLN       11      1HE2
 17    A       GLN       11      2HE2
 17    A       ASN       36      1HD2
 17    A       ASN       36      2HD2
 17    A       ASN       54      1HD2
 17    A       ASN       54      2HD2
 17    A       GLN       67      1HE2
 17    A       GLN       67      2HE2
 17    A       ASN       87      1HD2
 17    A       ASN       87      2HD2
 17    A       ASN       97      1HD2
 17    A       ASN       97      2HD2
 17    A       GLN      114      1HE2
 17    A       GLN      114      2HE2
 18    A       ASN        2      1HD2
 18    A       ASN        2      2HD2
 18    A       GLN        4      1HE2
 18    A       GLN        4      2HE2
 18    A       GLN        5      1HE2
 18    A       GLN        5      2HE2
 18    A       GLN       11      1HE2
 18    A       GLN       11      2HE2
 18    A       ASN       36      1HD2
 18    A       ASN       36      2HD2
 18    A       ASN       54      1HD2
 18    A       ASN       54      2HD2
 18    A       GLN       67      1HE2
 18    A       GLN       67      2HE2
 18    A       ASN       87      1HD2
 18    A       ASN       87      2HD2
 18    A       ASN       97      1HD2
 18    A       ASN       97      2HD2
 18    A       GLN      114      1HE2
 18    A       GLN      114      2HE2
 19    A       ASN        2      1HD2
 19    A       ASN        2      2HD2
 19    A       GLN        4      1HE2
 19    A       GLN        4      2HE2
 19    A       GLN        5      1HE2
 19    A       GLN        5      2HE2
 19    A       GLN       11      1HE2
 19    A       GLN       11      2HE2
 19    A       ASN       36      1HD2
 19    A       ASN       36      2HD2
 19    A       ASN       54      1HD2
 19    A       ASN       54      2HD2
 19    A       GLN       67      1HE2
 19    A       GLN       67      2HE2
 19    A       ASN       87      1HD2
 19    A       ASN       87      2HD2
 19    A       ASN       97      1HD2
 19    A       ASN       97      2HD2
 19    A       GLN      114      1HE2
 19    A       GLN      114      2HE2
 20    A       ASN        2      1HD2
 20    A       ASN        2      2HD2
 20    A       GLN        4      1HE2
 20    A       GLN        4      2HE2
 20    A       GLN        5      1HE2
 20    A       GLN        5      2HE2
 20    A       GLN       11      1HE2
 20    A       GLN       11      2HE2
 20    A       ASN       36      1HD2
 20    A       ASN       36      2HD2
 20    A       ASN       54      1HD2
 20    A       ASN       54      2HD2
 20    A       GLN       67      1HE2
 20    A       GLN       67      2HE2
 20    A       ASN       87      1HD2
 20    A       ASN       87      2HD2
 20    A       ASN       97      1HD2
 20    A       ASN       97      2HD2
 20    A       GLN      114      1HE2
 20    A       GLN      114      2HE2

OTHER IMPORTANT ISSUES

==> The following residues are missing:
    (Note: The SEQ number starts from 1 for each chain according to SEQRES
     sequence record.)
    
     RES MOD#C SEQ          

     MET(  1 A-124 )
     ASN(  1 A-123 )
     ARG(  1 A-122 )
     GLN(  1 A-121 )
     GLN(  1 A-120 )
     PHE(  1 A-119 )
     ILE(  1 A-118 )
     ASP(  1 A-117 )
     TYR(  1 A-116 )
     ALA(  1 A-115 )
     GLN(  1 A-114 )
     LYS(  1 A-113 )
     LYS(  1 A-112 )
     TYR(  1 A-111 )
     ASP(  1 A-110 )
     THR(  1 A-109 )
     LYS(  1 A-108 )
     PRO(  1 A-107 )
     ASP(  1 A-106 )
     HIS(  1 A-105 )
     PRO(  1 A-104 )
     TRP(  1 A-103 )
     GLU(  1 A-102 )
     LYS(  1 A-101 )
     PHE(  1 A-100 )
     PRO(  1 A -99 )
     ASP(  1 A -98 )
     TYR(  1 A -97 )
     ALA(  1 A -96 )
     VAL(  1 A -95 )
     PHE(  1 A -94 )
     ARG(  1 A -93 )
     HIS(  1 A -92 )
     SER(  1 A -91 )
     ASP(  1 A -90 )
     ASN(  1 A -89 )
     ASP(  1 A -88 )
     LYS(  1 A -87 )
     TRP(  1 A -86 )
     TYR(  1 A -85 )
     ALA(  1 A -84 )
     LEU(  1 A -83 )
     LEU(  1 A -82 )
     MET(  1 A -81 )
     ASP(  1 A -80 )
     ILE(  1 A -79 )
     PRO(  1 A -78 )
     ALA(  1 A -77 )
     GLU(  1 A -76 )
     LYS(  1 A -75 )
     ILE(  1 A -74 )
     GLY(  1 A -73 )
     ILE(  1 A -72 )
     ASN(  1 A -71 )
     GLY(  1 A -70 )
     ASP(  1 A -69 )
     LYS(  1 A -68 )
     ARG(  1 A -67 )
     VAL(  1 A -66 )
     ASP(  1 A -65 )
     VAL(  1 A -64 )
     ILE(  1 A -63 )
     ASP(  1 A -62 )
     LEU(  1 A -61 )
     LYS(  1 A -60 )
     VAL(  1 A -59 )
     GLN(  1 A -58 )
     PRO(  1 A -57 )
     GLU(  1 A -56 )
     LEU(  1 A -55 )
     VAL(  1 A -54 )
     GLY(  1 A -53 )
     SER(  1 A -52 )
     LEU(  1 A -51 )
     ARG(  1 A -50 )
     LYS(  1 A -49 )
     LYS(  1 A -48 )
     PRO(  1 A -47 )
     GLY(  1 A -46 )
     ILE(  1 A -45 )
     TYR(  1 A -44 )
     PRO(  1 A -43 )
     ALA(  1 A -42 )
     TYR(  1 A -41 )
     HIS(  1 A -40 )
     MET(  1 A -39 )
     ASN(  1 A -38 )
     LYS(  1 A -37 )
     GLU(  1 A -36 )
     HIS(  1 A -35 )
     TRP(  1 A -34 )
     ILE(  1 A -33 )
     THR(  1 A -32 )
     VAL(  1 A -31 )
     LEU(  1 A -30 )
     LEU(  1 A -29 )
     ASN(  1 A -28 )
     GLY(  1 A -27 )
     PRO(  1 A -26 )
     LEU(  1 A -25 )
     GLY(  1 A -24 )
     ALA(  1 A -23 )
     LYS(  1 A -22 )
     GLU(  1 A -21 )
     ILE(  1 A -20 )
     HIS(  1 A -19 )
     SER(  1 A -18 )
     LEU(  1 A -17 )
     ILE(  1 A -16 )
     GLU(  1 A -15 )
     ASP(  1 A -14 )
     SER(  1 A -13 )
     PHE(  1 A -12 )
     GLN(  1 A -11 )
     LEU(  1 A -10 )
     THR(  1 A  -9 )
     ARG(  1 A  -8 )
     LEU(  1 A  -7 )
     GLU(  1 A  -6 )
     HIS(  1 A  -5 )
     HIS(  1 A  -4 )
     HIS(  1 A  -3 )
     HIS(  1 A  -2 )
     HIS(  1 A  -1 )
     HIS(  1 A   0 )
     MET(  2 A-124 )
     ASN(  2 A-123 )
     ARG(  2 A-122 )
     GLN(  2 A-121 )
     GLN(  2 A-120 )
     PHE(  2 A-119 )
     ILE(  2 A-118 )
     ASP(  2 A-117 )
     TYR(  2 A-116 )
     ALA(  2 A-115 )
     GLN(  2 A-114 )
     LYS(  2 A-113 )
     LYS(  2 A-112 )
     TYR(  2 A-111 )
     ASP(  2 A-110 )
     THR(  2 A-109 )
     LYS(  2 A-108 )
     PRO(  2 A-107 )
     ASP(  2 A-106 )
     HIS(  2 A-105 )
     PRO(  2 A-104 )
     TRP(  2 A-103 )
     GLU(  2 A-102 )
     LYS(  2 A-101 )
     PHE(  2 A-100 )
     PRO(  2 A -99 )
     ASP(  2 A -98 )
     TYR(  2 A -97 )
     ALA(  2 A -96 )
     VAL(  2 A -95 )
     PHE(  2 A -94 )
     ARG(  2 A -93 )
     HIS(  2 A -92 )
     SER(  2 A -91 )
     ASP(  2 A -90 )
     ASN(  2 A -89 )
     ASP(  2 A -88 )
     LYS(  2 A -87 )
     TRP(  2 A -86 )
     TYR(  2 A -85 )
     ALA(  2 A -84 )
     LEU(  2 A -83 )
     LEU(  2 A -82 )
     MET(  2 A -81 )
     ASP(  2 A -80 )
     ILE(  2 A -79 )
     PRO(  2 A -78 )
     ALA(  2 A -77 )
     GLU(  2 A -76 )
     LYS(  2 A -75 )
     ILE(  2 A -74 )
     GLY(  2 A -73 )
     ILE(  2 A -72 )
     ASN(  2 A -71 )
     GLY(  2 A -70 )
     ASP(  2 A -69 )
     LYS(  2 A -68 )
     ARG(  2 A -67 )
     VAL(  2 A -66 )
     ASP(  2 A -65 )
     VAL(  2 A -64 )
     ILE(  2 A -63 )
     ASP(  2 A -62 )
     LEU(  2 A -61 )
     LYS(  2 A -60 )
     VAL(  2 A -59 )
     GLN(  2 A -58 )
     PRO(  2 A -57 )
     GLU(  2 A -56 )
     LEU(  2 A -55 )
     VAL(  2 A -54 )
     GLY(  2 A -53 )
     SER(  2 A -52 )
     LEU(  2 A -51 )
     ARG(  2 A -50 )
     LYS(  2 A -49 )
     LYS(  2 A -48 )
     PRO(  2 A -47 )
     GLY(  2 A -46 )
     ILE(  2 A -45 )
     TYR(  2 A -44 )
     PRO(  2 A -43 )
     ALA(  2 A -42 )
     TYR(  2 A -41 )
     HIS(  2 A -40 )
     MET(  2 A -39 )
     ASN(  2 A -38 )
     LYS(  2 A -37 )
     GLU(  2 A -36 )
     HIS(  2 A -35 )
     TRP(  2 A -34 )
     ILE(  2 A -33 )
     THR(  2 A -32 )
     VAL(  2 A -31 )
     LEU(  2 A -30 )
     LEU(  2 A -29 )
     ASN(  2 A -28 )
     GLY(  2 A -27 )
     PRO(  2 A -26 )
     LEU(  2 A -25 )
     GLY(  2 A -24 )
     ALA(  2 A -23 )
     LYS(  2 A -22 )
     GLU(  2 A -21 )
     ILE(  2 A -20 )
     HIS(  2 A -19 )
     SER(  2 A -18 )
     LEU(  2 A -17 )
     ILE(  2 A -16 )
     GLU(  2 A -15 )
     ASP(  2 A -14 )
     SER(  2 A -13 )
     PHE(  2 A -12 )
     GLN(  2 A -11 )
     LEU(  2 A -10 )
     THR(  2 A  -9 )
     ARG(  2 A  -8 )
     LEU(  2 A  -7 )
     GLU(  2 A  -6 )
     HIS(  2 A  -5 )
     HIS(  2 A  -4 )
     HIS(  2 A  -3 )
     HIS(  2 A  -2 )
     HIS(  2 A  -1 )
     HIS(  2 A   0 )
     MET(  3 A-124 )
     ASN(  3 A-123 )
     ARG(  3 A-122 )
     GLN(  3 A-121 )
     GLN(  3 A-120 )
     PHE(  3 A-119 )
     ILE(  3 A-118 )
     ASP(  3 A-117 )
     TYR(  3 A-116 )
     ALA(  3 A-115 )
     GLN(  3 A-114 )
     LYS(  3 A-113 )
     LYS(  3 A-112 )
     TYR(  3 A-111 )
     ASP(  3 A-110 )
     THR(  3 A-109 )
     LYS(  3 A-108 )
     PRO(  3 A-107 )
     ASP(  3 A-106 )
     HIS(  3 A-105 )
     PRO(  3 A-104 )
     TRP(  3 A-103 )
     GLU(  3 A-102 )
     LYS(  3 A-101 )
     PHE(  3 A-100 )
     PRO(  3 A -99 )
     ASP(  3 A -98 )
     TYR(  3 A -97 )
     ALA(  3 A -96 )
     VAL(  3 A -95 )
     PHE(  3 A -94 )
     ARG(  3 A -93 )
     HIS(  3 A -92 )
     SER(  3 A -91 )
     ASP(  3 A -90 )
     ASN(  3 A -89 )
     ASP(  3 A -88 )
     LYS(  3 A -87 )
     TRP(  3 A -86 )
     TYR(  3 A -85 )
     ALA(  3 A -84 )
     LEU(  3 A -83 )
     LEU(  3 A -82 )
     MET(  3 A -81 )
     ASP(  3 A -80 )
     ILE(  3 A -79 )
     PRO(  3 A -78 )
     ALA(  3 A -77 )
     GLU(  3 A -76 )
     LYS(  3 A -75 )
     ILE(  3 A -74 )
     GLY(  3 A -73 )
     ILE(  3 A -72 )
     ASN(  3 A -71 )
     GLY(  3 A -70 )
     ASP(  3 A -69 )
     LYS(  3 A -68 )
     ARG(  3 A -67 )
     VAL(  3 A -66 )
     ASP(  3 A -65 )
     VAL(  3 A -64 )
     ILE(  3 A -63 )
     ASP(  3 A -62 )
     LEU(  3 A -61 )
     LYS(  3 A -60 )
     VAL(  3 A -59 )
     GLN(  3 A -58 )
     PRO(  3 A -57 )
     GLU(  3 A -56 )
     LEU(  3 A -55 )
     VAL(  3 A -54 )
     GLY(  3 A -53 )
     SER(  3 A -52 )
     LEU(  3 A -51 )
     ARG(  3 A -50 )
     LYS(  3 A -49 )
     LYS(  3 A -48 )
     PRO(  3 A -47 )
     GLY(  3 A -46 )
     ILE(  3 A -45 )
     TYR(  3 A -44 )
     PRO(  3 A -43 )
     ALA(  3 A -42 )
     TYR(  3 A -41 )
     HIS(  3 A -40 )
     MET(  3 A -39 )
     ASN(  3 A -38 )
     LYS(  3 A -37 )
     GLU(  3 A -36 )
     HIS(  3 A -35 )
     TRP(  3 A -34 )
     ILE(  3 A -33 )
     THR(  3 A -32 )
     VAL(  3 A -31 )
     LEU(  3 A -30 )
     LEU(  3 A -29 )
     ASN(  3 A -28 )
     GLY(  3 A -27 )
     PRO(  3 A -26 )
     LEU(  3 A -25 )
     GLY(  3 A -24 )
     ALA(  3 A -23 )
     LYS(  3 A -22 )
     GLU(  3 A -21 )
     ILE(  3 A -20 )
     HIS(  3 A -19 )
     SER(  3 A -18 )
     LEU(  3 A -17 )
     ILE(  3 A -16 )
     GLU(  3 A -15 )
     ASP(  3 A -14 )
     SER(  3 A -13 )
     PHE(  3 A -12 )
     GLN(  3 A -11 )
     LEU(  3 A -10 )
     THR(  3 A  -9 )
     ARG(  3 A  -8 )
     LEU(  3 A  -7 )
     GLU(  3 A  -6 )
     HIS(  3 A  -5 )
     HIS(  3 A  -4 )
     HIS(  3 A  -3 )
     HIS(  3 A  -2 )
     HIS(  3 A  -1 )
     HIS(  3 A   0 )
     MET(  4 A-124 )
     ASN(  4 A-123 )
     ARG(  4 A-122 )
     GLN(  4 A-121 )
     GLN(  4 A-120 )
     PHE(  4 A-119 )
     ILE(  4 A-118 )
     ASP(  4 A-117 )
     TYR(  4 A-116 )
     ALA(  4 A-115 )
     GLN(  4 A-114 )
     LYS(  4 A-113 )
     LYS(  4 A-112 )
     TYR(  4 A-111 )
     ASP(  4 A-110 )
     THR(  4 A-109 )
     LYS(  4 A-108 )
     PRO(  4 A-107 )
     ASP(  4 A-106 )
     HIS(  4 A-105 )
     PRO(  4 A-104 )
     TRP(  4 A-103 )
     GLU(  4 A-102 )
     LYS(  4 A-101 )
     PHE(  4 A-100 )
     PRO(  4 A -99 )
     ASP(  4 A -98 )
     TYR(  4 A -97 )
     ALA(  4 A -96 )
     VAL(  4 A -95 )
     PHE(  4 A -94 )
     ARG(  4 A -93 )
     HIS(  4 A -92 )
     SER(  4 A -91 )
     ASP(  4 A -90 )
     ASN(  4 A -89 )
     ASP(  4 A -88 )
     LYS(  4 A -87 )
     TRP(  4 A -86 )
     TYR(  4 A -85 )
     ALA(  4 A -84 )
     LEU(  4 A -83 )
     LEU(  4 A -82 )
     MET(  4 A -81 )
     ASP(  4 A -80 )
     ILE(  4 A -79 )
     PRO(  4 A -78 )
     ALA(  4 A -77 )
     GLU(  4 A -76 )
     LYS(  4 A -75 )
     ILE(  4 A -74 )
     GLY(  4 A -73 )
     ILE(  4 A -72 )
     ASN(  4 A -71 )
     GLY(  4 A -70 )
     ASP(  4 A -69 )
     LYS(  4 A -68 )
     ARG(  4 A -67 )
     VAL(  4 A -66 )
     ASP(  4 A -65 )
     VAL(  4 A -64 )
     ILE(  4 A -63 )
     ASP(  4 A -62 )
     LEU(  4 A -61 )
     LYS(  4 A -60 )
     VAL(  4 A -59 )
     GLN(  4 A -58 )
     PRO(  4 A -57 )
     GLU(  4 A -56 )
     LEU(  4 A -55 )
     VAL(  4 A -54 )
     GLY(  4 A -53 )
     SER(  4 A -52 )
     LEU(  4 A -51 )
     ARG(  4 A -50 )
     LYS(  4 A -49 )
     LYS(  4 A -48 )
     PRO(  4 A -47 )
     GLY(  4 A -46 )
     ILE(  4 A -45 )
     TYR(  4 A -44 )
     PRO(  4 A -43 )
     ALA(  4 A -42 )
     TYR(  4 A -41 )
     HIS(  4 A -40 )
     MET(  4 A -39 )
     ASN(  4 A -38 )
     LYS(  4 A -37 )
     GLU(  4 A -36 )
     HIS(  4 A -35 )
     TRP(  4 A -34 )
     ILE(  4 A -33 )
     THR(  4 A -32 )
     VAL(  4 A -31 )
     LEU(  4 A -30 )
     LEU(  4 A -29 )
     ASN(  4 A -28 )
     GLY(  4 A -27 )
     PRO(  4 A -26 )
     LEU(  4 A -25 )
     GLY(  4 A -24 )
     ALA(  4 A -23 )
     LYS(  4 A -22 )
     GLU(  4 A -21 )
     ILE(  4 A -20 )
     HIS(  4 A -19 )
     SER(  4 A -18 )
     LEU(  4 A -17 )
     ILE(  4 A -16 )
     GLU(  4 A -15 )
     ASP(  4 A -14 )
     SER(  4 A -13 )
     PHE(  4 A -12 )
     GLN(  4 A -11 )
     LEU(  4 A -10 )
     THR(  4 A  -9 )
     ARG(  4 A  -8 )
     LEU(  4 A  -7 )
     GLU(  4 A  -6 )
     HIS(  4 A  -5 )
     HIS(  4 A  -4 )
     HIS(  4 A  -3 )
     HIS(  4 A  -2 )
     HIS(  4 A  -1 )
     HIS(  4 A   0 )
     MET(  5 A-124 )
     ASN(  5 A-123 )
     ARG(  5 A-122 )
     GLN(  5 A-121 )
     GLN(  5 A-120 )
     PHE(  5 A-119 )
     ILE(  5 A-118 )
     ASP(  5 A-117 )
     TYR(  5 A-116 )
     ALA(  5 A-115 )
     GLN(  5 A-114 )
     LYS(  5 A-113 )
     LYS(  5 A-112 )
     TYR(  5 A-111 )
     ASP(  5 A-110 )
     THR(  5 A-109 )
     LYS(  5 A-108 )
     PRO(  5 A-107 )
     ASP(  5 A-106 )
     HIS(  5 A-105 )
     PRO(  5 A-104 )
     TRP(  5 A-103 )
     GLU(  5 A-102 )
     LYS(  5 A-101 )
     PHE(  5 A-100 )
     PRO(  5 A -99 )
     ASP(  5 A -98 )
     TYR(  5 A -97 )
     ALA(  5 A -96 )
     VAL(  5 A -95 )
     PHE(  5 A -94 )
     ARG(  5 A -93 )
     HIS(  5 A -92 )
     SER(  5 A -91 )
     ASP(  5 A -90 )
     ASN(  5 A -89 )
     ASP(  5 A -88 )
     LYS(  5 A -87 )
     TRP(  5 A -86 )
     TYR(  5 A -85 )
     ALA(  5 A -84 )
     LEU(  5 A -83 )
     LEU(  5 A -82 )
     MET(  5 A -81 )
     ASP(  5 A -80 )
     ILE(  5 A -79 )
     PRO(  5 A -78 )
     ALA(  5 A -77 )
     GLU(  5 A -76 )
     LYS(  5 A -75 )
     ILE(  5 A -74 )
     GLY(  5 A -73 )
     ILE(  5 A -72 )
     ASN(  5 A -71 )
     GLY(  5 A -70 )
     ASP(  5 A -69 )
     LYS(  5 A -68 )
     ARG(  5 A -67 )
     VAL(  5 A -66 )
     ASP(  5 A -65 )
     VAL(  5 A -64 )
     ILE(  5 A -63 )
     ASP(  5 A -62 )
     LEU(  5 A -61 )
     LYS(  5 A -60 )
     VAL(  5 A -59 )
     GLN(  5 A -58 )
     PRO(  5 A -57 )
     GLU(  5 A -56 )
     LEU(  5 A -55 )
     VAL(  5 A -54 )
     GLY(  5 A -53 )
     SER(  5 A -52 )
     LEU(  5 A -51 )
     ARG(  5 A -50 )
     LYS(  5 A -49 )
     LYS(  5 A -48 )
     PRO(  5 A -47 )
     GLY(  5 A -46 )
     ILE(  5 A -45 )
     TYR(  5 A -44 )
     PRO(  5 A -43 )
     ALA(  5 A -42 )
     TYR(  5 A -41 )
     HIS(  5 A -40 )
     MET(  5 A -39 )
     ASN(  5 A -38 )
     LYS(  5 A -37 )
     GLU(  5 A -36 )
     HIS(  5 A -35 )
     TRP(  5 A -34 )
     ILE(  5 A -33 )
     THR(  5 A -32 )
     VAL(  5 A -31 )
     LEU(  5 A -30 )
     LEU(  5 A -29 )
     ASN(  5 A -28 )
     GLY(  5 A -27 )
     PRO(  5 A -26 )
     LEU(  5 A -25 )
     GLY(  5 A -24 )
     ALA(  5 A -23 )
     LYS(  5 A -22 )
     GLU(  5 A -21 )
     ILE(  5 A -20 )
     HIS(  5 A -19 )
     SER(  5 A -18 )
     LEU(  5 A -17 )
     ILE(  5 A -16 )
     GLU(  5 A -15 )
     ASP(  5 A -14 )
     SER(  5 A -13 )
     PHE(  5 A -12 )
     GLN(  5 A -11 )
     LEU(  5 A -10 )
     THR(  5 A  -9 )
     ARG(  5 A  -8 )
     LEU(  5 A  -7 )
     GLU(  5 A  -6 )
     HIS(  5 A  -5 )
     HIS(  5 A  -4 )
     HIS(  5 A  -3 )
     HIS(  5 A  -2 )
     HIS(  5 A  -1 )
     HIS(  5 A   0 )
     MET(  6 A-124 )
     ASN(  6 A-123 )
     ARG(  6 A-122 )
     GLN(  6 A-121 )
     GLN(  6 A-120 )
     PHE(  6 A-119 )
     ILE(  6 A-118 )
     ASP(  6 A-117 )
     TYR(  6 A-116 )
     ALA(  6 A-115 )
     GLN(  6 A-114 )
     LYS(  6 A-113 )
     LYS(  6 A-112 )
     TYR(  6 A-111 )
     ASP(  6 A-110 )
     THR(  6 A-109 )
     LYS(  6 A-108 )
     PRO(  6 A-107 )
     ASP(  6 A-106 )
     HIS(  6 A-105 )
     PRO(  6 A-104 )
     TRP(  6 A-103 )
     GLU(  6 A-102 )
     LYS(  6 A-101 )
     PHE(  6 A-100 )
     PRO(  6 A -99 )
     ASP(  6 A -98 )
     TYR(  6 A -97 )
     ALA(  6 A -96 )
     VAL(  6 A -95 )
     PHE(  6 A -94 )
     ARG(  6 A -93 )
     HIS(  6 A -92 )
     SER(  6 A -91 )
     ASP(  6 A -90 )
     ASN(  6 A -89 )
     ASP(  6 A -88 )
     LYS(  6 A -87 )
     TRP(  6 A -86 )
     TYR(  6 A -85 )
     ALA(  6 A -84 )
     LEU(  6 A -83 )
     LEU(  6 A -82 )
     MET(  6 A -81 )
     ASP(  6 A -80 )
     ILE(  6 A -79 )
     PRO(  6 A -78 )
     ALA(  6 A -77 )
     GLU(  6 A -76 )
     LYS(  6 A -75 )
     ILE(  6 A -74 )
     GLY(  6 A -73 )
     ILE(  6 A -72 )
     ASN(  6 A -71 )
     GLY(  6 A -70 )
     ASP(  6 A -69 )
     LYS(  6 A -68 )
     ARG(  6 A -67 )
     VAL(  6 A -66 )
     ASP(  6 A -65 )
     VAL(  6 A -64 )
     ILE(  6 A -63 )
     ASP(  6 A -62 )
     LEU(  6 A -61 )
     LYS(  6 A -60 )
     VAL(  6 A -59 )
     GLN(  6 A -58 )
     PRO(  6 A -57 )
     GLU(  6 A -56 )
     LEU(  6 A -55 )
     VAL(  6 A -54 )
     GLY(  6 A -53 )
     SER(  6 A -52 )
     LEU(  6 A -51 )
     ARG(  6 A -50 )
     LYS(  6 A -49 )
     LYS(  6 A -48 )
     PRO(  6 A -47 )
     GLY(  6 A -46 )
     ILE(  6 A -45 )
     TYR(  6 A -44 )
     PRO(  6 A -43 )
     ALA(  6 A -42 )
     TYR(  6 A -41 )
     HIS(  6 A -40 )
     MET(  6 A -39 )
     ASN(  6 A -38 )
     LYS(  6 A -37 )
     GLU(  6 A -36 )
     HIS(  6 A -35 )
     TRP(  6 A -34 )
     ILE(  6 A -33 )
     THR(  6 A -32 )
     VAL(  6 A -31 )
     LEU(  6 A -30 )
     LEU(  6 A -29 )
     ASN(  6 A -28 )
     GLY(  6 A -27 )
     PRO(  6 A -26 )
     LEU(  6 A -25 )
     GLY(  6 A -24 )
     ALA(  6 A -23 )
     LYS(  6 A -22 )
     GLU(  6 A -21 )
     ILE(  6 A -20 )
     HIS(  6 A -19 )
     SER(  6 A -18 )
     LEU(  6 A -17 )
     ILE(  6 A -16 )
     GLU(  6 A -15 )
     ASP(  6 A -14 )
     SER(  6 A -13 )
     PHE(  6 A -12 )
     GLN(  6 A -11 )
     LEU(  6 A -10 )
     THR(  6 A  -9 )
     ARG(  6 A  -8 )
     LEU(  6 A  -7 )
     GLU(  6 A  -6 )
     HIS(  6 A  -5 )
     HIS(  6 A  -4 )
     HIS(  6 A  -3 )
     HIS(  6 A  -2 )
     HIS(  6 A  -1 )
     HIS(  6 A   0 )
     MET(  7 A-124 )
     ASN(  7 A-123 )
     ARG(  7 A-122 )
     GLN(  7 A-121 )
     GLN(  7 A-120 )
     PHE(  7 A-119 )
     ILE(  7 A-118 )
     ASP(  7 A-117 )
     TYR(  7 A-116 )
     ALA(  7 A-115 )
     GLN(  7 A-114 )
     LYS(  7 A-113 )
     LYS(  7 A-112 )
     TYR(  7 A-111 )
     ASP(  7 A-110 )
     THR(  7 A-109 )
     LYS(  7 A-108 )
     PRO(  7 A-107 )
     ASP(  7 A-106 )
     HIS(  7 A-105 )
     PRO(  7 A-104 )
     TRP(  7 A-103 )
     GLU(  7 A-102 )
     LYS(  7 A-101 )
     PHE(  7 A-100 )
     PRO(  7 A -99 )
     ASP(  7 A -98 )
     TYR(  7 A -97 )
     ALA(  7 A -96 )
     VAL(  7 A -95 )
     PHE(  7 A -94 )
     ARG(  7 A -93 )
     HIS(  7 A -92 )
     SER(  7 A -91 )
     ASP(  7 A -90 )
     ASN(  7 A -89 )
     ASP(  7 A -88 )
     LYS(  7 A -87 )
     TRP(  7 A -86 )
     TYR(  7 A -85 )
     ALA(  7 A -84 )
     LEU(  7 A -83 )
     LEU(  7 A -82 )
     MET(  7 A -81 )
     ASP(  7 A -80 )
     ILE(  7 A -79 )
     PRO(  7 A -78 )
     ALA(  7 A -77 )
     GLU(  7 A -76 )
     LYS(  7 A -75 )
     ILE(  7 A -74 )
     GLY(  7 A -73 )
     ILE(  7 A -72 )
     ASN(  7 A -71 )
     GLY(  7 A -70 )
     ASP(  7 A -69 )
     LYS(  7 A -68 )
     ARG(  7 A -67 )
     VAL(  7 A -66 )
     ASP(  7 A -65 )
     VAL(  7 A -64 )
     ILE(  7 A -63 )
     ASP(  7 A -62 )
     LEU(  7 A -61 )
     LYS(  7 A -60 )
     VAL(  7 A -59 )
     GLN(  7 A -58 )
     PRO(  7 A -57 )
     GLU(  7 A -56 )
     LEU(  7 A -55 )
     VAL(  7 A -54 )
     GLY(  7 A -53 )
     SER(  7 A -52 )
     LEU(  7 A -51 )
     ARG(  7 A -50 )
     LYS(  7 A -49 )
     LYS(  7 A -48 )
     PRO(  7 A -47 )
     GLY(  7 A -46 )
     ILE(  7 A -45 )
     TYR(  7 A -44 )
     PRO(  7 A -43 )
     ALA(  7 A -42 )
     TYR(  7 A -41 )
     HIS(  7 A -40 )
     MET(  7 A -39 )
     ASN(  7 A -38 )
     LYS(  7 A -37 )
     GLU(  7 A -36 )
     HIS(  7 A -35 )
     TRP(  7 A -34 )
     ILE(  7 A -33 )
     THR(  7 A -32 )
     VAL(  7 A -31 )
     LEU(  7 A -30 )
     LEU(  7 A -29 )
     ASN(  7 A -28 )
     GLY(  7 A -27 )
     PRO(  7 A -26 )
     LEU(  7 A -25 )
     GLY(  7 A -24 )
     ALA(  7 A -23 )
     LYS(  7 A -22 )
     GLU(  7 A -21 )
     ILE(  7 A -20 )
     HIS(  7 A -19 )
     SER(  7 A -18 )
     LEU(  7 A -17 )
     ILE(  7 A -16 )
     GLU(  7 A -15 )
     ASP(  7 A -14 )
     SER(  7 A -13 )
     PHE(  7 A -12 )
     GLN(  7 A -11 )
     LEU(  7 A -10 )
     THR(  7 A  -9 )
     ARG(  7 A  -8 )
     LEU(  7 A  -7 )
     GLU(  7 A  -6 )
     HIS(  7 A  -5 )
     HIS(  7 A  -4 )
     HIS(  7 A  -3 )
     HIS(  7 A  -2 )
     HIS(  7 A  -1 )
     HIS(  7 A   0 )
     MET(  8 A-124 )
     ASN(  8 A-123 )
     ARG(  8 A-122 )
     GLN(  8 A-121 )
     GLN(  8 A-120 )
     PHE(  8 A-119 )
     ILE(  8 A-118 )
     ASP(  8 A-117 )
     TYR(  8 A-116 )
     ALA(  8 A-115 )
     GLN(  8 A-114 )
     LYS(  8 A-113 )
     LYS(  8 A-112 )
     TYR(  8 A-111 )
     ASP(  8 A-110 )
     THR(  8 A-109 )
     LYS(  8 A-108 )
     PRO(  8 A-107 )
     ASP(  8 A-106 )
     HIS(  8 A-105 )
     PRO(  8 A-104 )
     TRP(  8 A-103 )
     GLU(  8 A-102 )
     LYS(  8 A-101 )
     PHE(  8 A-100 )
     PRO(  8 A -99 )
     ASP(  8 A -98 )
     TYR(  8 A -97 )
     ALA(  8 A -96 )
     VAL(  8 A -95 )
     PHE(  8 A -94 )
     ARG(  8 A -93 )
     HIS(  8 A -92 )
     SER(  8 A -91 )
     ASP(  8 A -90 )
     ASN(  8 A -89 )
     ASP(  8 A -88 )
     LYS(  8 A -87 )
     TRP(  8 A -86 )
     TYR(  8 A -85 )
     ALA(  8 A -84 )
     LEU(  8 A -83 )
     LEU(  8 A -82 )
     MET(  8 A -81 )
     ASP(  8 A -80 )
     ILE(  8 A -79 )
     PRO(  8 A -78 )
     ALA(  8 A -77 )
     GLU(  8 A -76 )
     LYS(  8 A -75 )
     ILE(  8 A -74 )
     GLY(  8 A -73 )
     ILE(  8 A -72 )
     ASN(  8 A -71 )
     GLY(  8 A -70 )
     ASP(  8 A -69 )
     LYS(  8 A -68 )
     ARG(  8 A -67 )
     VAL(  8 A -66 )
     ASP(  8 A -65 )
     VAL(  8 A -64 )
     ILE(  8 A -63 )
     ASP(  8 A -62 )
     LEU(  8 A -61 )
     LYS(  8 A -60 )
     VAL(  8 A -59 )
     GLN(  8 A -58 )
     PRO(  8 A -57 )
     GLU(  8 A -56 )
     LEU(  8 A -55 )
     VAL(  8 A -54 )
     GLY(  8 A -53 )
     SER(  8 A -52 )
     LEU(  8 A -51 )
     ARG(  8 A -50 )
     LYS(  8 A -49 )
     LYS(  8 A -48 )
     PRO(  8 A -47 )
     GLY(  8 A -46 )
     ILE(  8 A -45 )
     TYR(  8 A -44 )
     PRO(  8 A -43 )
     ALA(  8 A -42 )
     TYR(  8 A -41 )
     HIS(  8 A -40 )
     MET(  8 A -39 )
     ASN(  8 A -38 )
     LYS(  8 A -37 )
     GLU(  8 A -36 )
     HIS(  8 A -35 )
     TRP(  8 A -34 )
     ILE(  8 A -33 )
     THR(  8 A -32 )
     VAL(  8 A -31 )
     LEU(  8 A -30 )
     LEU(  8 A -29 )
     ASN(  8 A -28 )
     GLY(  8 A -27 )
     PRO(  8 A -26 )
     LEU(  8 A -25 )
     GLY(  8 A -24 )
     ALA(  8 A -23 )
     LYS(  8 A -22 )
     GLU(  8 A -21 )
     ILE(  8 A -20 )
     HIS(  8 A -19 )
     SER(  8 A -18 )
     LEU(  8 A -17 )
     ILE(  8 A -16 )
     GLU(  8 A -15 )
     ASP(  8 A -14 )
     SER(  8 A -13 )
     PHE(  8 A -12 )
     GLN(  8 A -11 )
     LEU(  8 A -10 )
     THR(  8 A  -9 )
     ARG(  8 A  -8 )
     LEU(  8 A  -7 )
     GLU(  8 A  -6 )
     HIS(  8 A  -5 )
     HIS(  8 A  -4 )
     HIS(  8 A  -3 )
     HIS(  8 A  -2 )
     HIS(  8 A  -1 )
     HIS(  8 A   0 )
     MET(  9 A-124 )
     ASN(  9 A-123 )
     ARG(  9 A-122 )
     GLN(  9 A-121 )
     GLN(  9 A-120 )
     PHE(  9 A-119 )
     ILE(  9 A-118 )
     ASP(  9 A-117 )
     TYR(  9 A-116 )
     ALA(  9 A-115 )
     GLN(  9 A-114 )
     LYS(  9 A-113 )
     LYS(  9 A-112 )
     TYR(  9 A-111 )
     ASP(  9 A-110 )
     THR(  9 A-109 )
     LYS(  9 A-108 )
     PRO(  9 A-107 )
     ASP(  9 A-106 )
     HIS(  9 A-105 )
     PRO(  9 A-104 )
     TRP(  9 A-103 )
     GLU(  9 A-102 )
     LYS(  9 A-101 )
     PHE(  9 A-100 )
     PRO(  9 A -99 )
     ASP(  9 A -98 )
     TYR(  9 A -97 )
     ALA(  9 A -96 )
     VAL(  9 A -95 )
     PHE(  9 A -94 )
     ARG(  9 A -93 )
     HIS(  9 A -92 )
     SER(  9 A -91 )
     ASP(  9 A -90 )
     ASN(  9 A -89 )
     ASP(  9 A -88 )
     LYS(  9 A -87 )
     TRP(  9 A -86 )
     TYR(  9 A -85 )
     ALA(  9 A -84 )
     LEU(  9 A -83 )
     LEU(  9 A -82 )
     MET(  9 A -81 )
     ASP(  9 A -80 )
     ILE(  9 A -79 )
     PRO(  9 A -78 )
     ALA(  9 A -77 )
     GLU(  9 A -76 )
     LYS(  9 A -75 )
     ILE(  9 A -74 )
     GLY(  9 A -73 )
     ILE(  9 A -72 )
     ASN(  9 A -71 )
     GLY(  9 A -70 )
     ASP(  9 A -69 )
     LYS(  9 A -68 )
     ARG(  9 A -67 )
     VAL(  9 A -66 )
     ASP(  9 A -65 )
     VAL(  9 A -64 )
     ILE(  9 A -63 )
     ASP(  9 A -62 )
     LEU(  9 A -61 )
     LYS(  9 A -60 )
     VAL(  9 A -59 )
     GLN(  9 A -58 )
     PRO(  9 A -57 )
     GLU(  9 A -56 )
     LEU(  9 A -55 )
     VAL(  9 A -54 )
     GLY(  9 A -53 )
     SER(  9 A -52 )
     LEU(  9 A -51 )
     ARG(  9 A -50 )
     LYS(  9 A -49 )
     LYS(  9 A -48 )
     PRO(  9 A -47 )
     GLY(  9 A -46 )
     ILE(  9 A -45 )
     TYR(  9 A -44 )
     PRO(  9 A -43 )
     ALA(  9 A -42 )
     TYR(  9 A -41 )
     HIS(  9 A -40 )
     MET(  9 A -39 )
     ASN(  9 A -38 )
     LYS(  9 A -37 )
     GLU(  9 A -36 )
     HIS(  9 A -35 )
     TRP(  9 A -34 )
     ILE(  9 A -33 )
     THR(  9 A -32 )
     VAL(  9 A -31 )
     LEU(  9 A -30 )
     LEU(  9 A -29 )
     ASN(  9 A -28 )
     GLY(  9 A -27 )
     PRO(  9 A -26 )
     LEU(  9 A -25 )
     GLY(  9 A -24 )
     ALA(  9 A -23 )
     LYS(  9 A -22 )
     GLU(  9 A -21 )
     ILE(  9 A -20 )
     HIS(  9 A -19 )
     SER(  9 A -18 )
     LEU(  9 A -17 )
     ILE(  9 A -16 )
     GLU(  9 A -15 )
     ASP(  9 A -14 )
     SER(  9 A -13 )
     PHE(  9 A -12 )
     GLN(  9 A -11 )
     LEU(  9 A -10 )
     THR(  9 A  -9 )
     ARG(  9 A  -8 )
     LEU(  9 A  -7 )
     GLU(  9 A  -6 )
     HIS(  9 A  -5 )
     HIS(  9 A  -4 )
     HIS(  9 A  -3 )
     HIS(  9 A  -2 )
     HIS(  9 A  -1 )
     HIS(  9 A   0 )
     MET( 10 A-124 )
     ASN( 10 A-123 )
     ARG( 10 A-122 )
     GLN( 10 A-121 )
     GLN( 10 A-120 )
     PHE( 10 A-119 )
     ILE( 10 A-118 )
     ASP( 10 A-117 )
     TYR( 10 A-116 )
     ALA( 10 A-115 )
     GLN( 10 A-114 )
     LYS( 10 A-113 )
     LYS( 10 A-112 )
     TYR( 10 A-111 )
     ASP( 10 A-110 )
     THR( 10 A-109 )
     LYS( 10 A-108 )
     PRO( 10 A-107 )
     ASP( 10 A-106 )
     HIS( 10 A-105 )
     PRO( 10 A-104 )
     TRP( 10 A-103 )
     GLU( 10 A-102 )
     LYS( 10 A-101 )
     PHE( 10 A-100 )
     PRO( 10 A -99 )
     ASP( 10 A -98 )
     TYR( 10 A -97 )
     ALA( 10 A -96 )
     VAL( 10 A -95 )
     PHE( 10 A -94 )
     ARG( 10 A -93 )
     HIS( 10 A -92 )
     SER( 10 A -91 )
     ASP( 10 A -90 )
     ASN( 10 A -89 )
     ASP( 10 A -88 )
     LYS( 10 A -87 )
     TRP( 10 A -86 )
     TYR( 10 A -85 )
     ALA( 10 A -84 )
     LEU( 10 A -83 )
     LEU( 10 A -82 )
     MET( 10 A -81 )
     ASP( 10 A -80 )
     ILE( 10 A -79 )
     PRO( 10 A -78 )
     ALA( 10 A -77 )
     GLU( 10 A -76 )
     LYS( 10 A -75 )
     ILE( 10 A -74 )
     GLY( 10 A -73 )
     ILE( 10 A -72 )
     ASN( 10 A -71 )
     GLY( 10 A -70 )
     ASP( 10 A -69 )
     LYS( 10 A -68 )
     ARG( 10 A -67 )
     VAL( 10 A -66 )
     ASP( 10 A -65 )
     VAL( 10 A -64 )
     ILE( 10 A -63 )
     ASP( 10 A -62 )
     LEU( 10 A -61 )
     LYS( 10 A -60 )
     VAL( 10 A -59 )
     GLN( 10 A -58 )
     PRO( 10 A -57 )
     GLU( 10 A -56 )
     LEU( 10 A -55 )
     VAL( 10 A -54 )
     GLY( 10 A -53 )
     SER( 10 A -52 )
     LEU( 10 A -51 )
     ARG( 10 A -50 )
     LYS( 10 A -49 )
     LYS( 10 A -48 )
     PRO( 10 A -47 )
     GLY( 10 A -46 )
     ILE( 10 A -45 )
     TYR( 10 A -44 )
     PRO( 10 A -43 )
     ALA( 10 A -42 )
     TYR( 10 A -41 )
     HIS( 10 A -40 )
     MET( 10 A -39 )
     ASN( 10 A -38 )
     LYS( 10 A -37 )
     GLU( 10 A -36 )
     HIS( 10 A -35 )
     TRP( 10 A -34 )
     ILE( 10 A -33 )
     THR( 10 A -32 )
     VAL( 10 A -31 )
     LEU( 10 A -30 )
     LEU( 10 A -29 )
     ASN( 10 A -28 )
     GLY( 10 A -27 )
     PRO( 10 A -26 )
     LEU( 10 A -25 )
     GLY( 10 A -24 )
     ALA( 10 A -23 )
     LYS( 10 A -22 )
     GLU( 10 A -21 )
     ILE( 10 A -20 )
     HIS( 10 A -19 )
     SER( 10 A -18 )
     LEU( 10 A -17 )
     ILE( 10 A -16 )
     GLU( 10 A -15 )
     ASP( 10 A -14 )
     SER( 10 A -13 )
     PHE( 10 A -12 )
     GLN( 10 A -11 )
     LEU( 10 A -10 )
     THR( 10 A  -9 )
     ARG( 10 A  -8 )
     LEU( 10 A  -7 )
     GLU( 10 A  -6 )
     HIS( 10 A  -5 )
     HIS( 10 A  -4 )
     HIS( 10 A  -3 )
     HIS( 10 A  -2 )
     HIS( 10 A  -1 )
     HIS( 10 A   0 )
     MET( 11 A-124 )
     ASN( 11 A-123 )
     ARG( 11 A-122 )
     GLN( 11 A-121 )
     GLN( 11 A-120 )
     PHE( 11 A-119 )
     ILE( 11 A-118 )
     ASP( 11 A-117 )
     TYR( 11 A-116 )
     ALA( 11 A-115 )
     GLN( 11 A-114 )
     LYS( 11 A-113 )
     LYS( 11 A-112 )
     TYR( 11 A-111 )
     ASP( 11 A-110 )
     THR( 11 A-109 )
     LYS( 11 A-108 )
     PRO( 11 A-107 )
     ASP( 11 A-106 )
     HIS( 11 A-105 )
     PRO( 11 A-104 )
     TRP( 11 A-103 )
     GLU( 11 A-102 )
     LYS( 11 A-101 )
     PHE( 11 A-100 )
     PRO( 11 A -99 )
     ASP( 11 A -98 )
     TYR( 11 A -97 )
     ALA( 11 A -96 )
     VAL( 11 A -95 )
     PHE( 11 A -94 )
     ARG( 11 A -93 )
     HIS( 11 A -92 )
     SER( 11 A -91 )
     ASP( 11 A -90 )
     ASN( 11 A -89 )
     ASP( 11 A -88 )
     LYS( 11 A -87 )
     TRP( 11 A -86 )
     TYR( 11 A -85 )
     ALA( 11 A -84 )
     LEU( 11 A -83 )
     LEU( 11 A -82 )
     MET( 11 A -81 )
     ASP( 11 A -80 )
     ILE( 11 A -79 )
     PRO( 11 A -78 )
     ALA( 11 A -77 )
     GLU( 11 A -76 )
     LYS( 11 A -75 )
     ILE( 11 A -74 )
     GLY( 11 A -73 )
     ILE( 11 A -72 )
     ASN( 11 A -71 )
     GLY( 11 A -70 )
     ASP( 11 A -69 )
     LYS( 11 A -68 )
     ARG( 11 A -67 )
     VAL( 11 A -66 )
     ASP( 11 A -65 )
     VAL( 11 A -64 )
     ILE( 11 A -63 )
     ASP( 11 A -62 )
     LEU( 11 A -61 )
     LYS( 11 A -60 )
     VAL( 11 A -59 )
     GLN( 11 A -58 )
     PRO( 11 A -57 )
     GLU( 11 A -56 )
     LEU( 11 A -55 )
     VAL( 11 A -54 )
     GLY( 11 A -53 )
     SER( 11 A -52 )
     LEU( 11 A -51 )
     ARG( 11 A -50 )
     LYS( 11 A -49 )
     LYS( 11 A -48 )
     PRO( 11 A -47 )
     GLY( 11 A -46 )
     ILE( 11 A -45 )
     TYR( 11 A -44 )
     PRO( 11 A -43 )
     ALA( 11 A -42 )
     TYR( 11 A -41 )
     HIS( 11 A -40 )
     MET( 11 A -39 )
     ASN( 11 A -38 )
     LYS( 11 A -37 )
     GLU( 11 A -36 )
     HIS( 11 A -35 )
     TRP( 11 A -34 )
     ILE( 11 A -33 )
     THR( 11 A -32 )
     VAL( 11 A -31 )
     LEU( 11 A -30 )
     LEU( 11 A -29 )
     ASN( 11 A -28 )
     GLY( 11 A -27 )
     PRO( 11 A -26 )
     LEU( 11 A -25 )
     GLY( 11 A -24 )
     ALA( 11 A -23 )
     LYS( 11 A -22 )
     GLU( 11 A -21 )
     ILE( 11 A -20 )
     HIS( 11 A -19 )
     SER( 11 A -18 )
     LEU( 11 A -17 )
     ILE( 11 A -16 )
     GLU( 11 A -15 )
     ASP( 11 A -14 )
     SER( 11 A -13 )
     PHE( 11 A -12 )
     GLN( 11 A -11 )
     LEU( 11 A -10 )
     THR( 11 A  -9 )
     ARG( 11 A  -8 )
     LEU( 11 A  -7 )
     GLU( 11 A  -6 )
     HIS( 11 A  -5 )
     HIS( 11 A  -4 )
     HIS( 11 A  -3 )
     HIS( 11 A  -2 )
     HIS( 11 A  -1 )
     HIS( 11 A   0 )
     MET( 12 A-124 )
     ASN( 12 A-123 )
     ARG( 12 A-122 )
     GLN( 12 A-121 )
     GLN( 12 A-120 )
     PHE( 12 A-119 )
     ILE( 12 A-118 )
     ASP( 12 A-117 )
     TYR( 12 A-116 )
     ALA( 12 A-115 )
     GLN( 12 A-114 )
     LYS( 12 A-113 )
     LYS( 12 A-112 )
     TYR( 12 A-111 )
     ASP( 12 A-110 )
     THR( 12 A-109 )
     LYS( 12 A-108 )
     PRO( 12 A-107 )
     ASP( 12 A-106 )
     HIS( 12 A-105 )
     PRO( 12 A-104 )
     TRP( 12 A-103 )
     GLU( 12 A-102 )
     LYS( 12 A-101 )
     PHE( 12 A-100 )
     PRO( 12 A -99 )
     ASP( 12 A -98 )
     TYR( 12 A -97 )
     ALA( 12 A -96 )
     VAL( 12 A -95 )
     PHE( 12 A -94 )
     ARG( 12 A -93 )
     HIS( 12 A -92 )
     SER( 12 A -91 )
     ASP( 12 A -90 )
     ASN( 12 A -89 )
     ASP( 12 A -88 )
     LYS( 12 A -87 )
     TRP( 12 A -86 )
     TYR( 12 A -85 )
     ALA( 12 A -84 )
     LEU( 12 A -83 )
     LEU( 12 A -82 )
     MET( 12 A -81 )
     ASP( 12 A -80 )
     ILE( 12 A -79 )
     PRO( 12 A -78 )
     ALA( 12 A -77 )
     GLU( 12 A -76 )
     LYS( 12 A -75 )
     ILE( 12 A -74 )
     GLY( 12 A -73 )
     ILE( 12 A -72 )
     ASN( 12 A -71 )
     GLY( 12 A -70 )
     ASP( 12 A -69 )
     LYS( 12 A -68 )
     ARG( 12 A -67 )
     VAL( 12 A -66 )
     ASP( 12 A -65 )
     VAL( 12 A -64 )
     ILE( 12 A -63 )
     ASP( 12 A -62 )
     LEU( 12 A -61 )
     LYS( 12 A -60 )
     VAL( 12 A -59 )
     GLN( 12 A -58 )
     PRO( 12 A -57 )
     GLU( 12 A -56 )
     LEU( 12 A -55 )
     VAL( 12 A -54 )
     GLY( 12 A -53 )
     SER( 12 A -52 )
     LEU( 12 A -51 )
     ARG( 12 A -50 )
     LYS( 12 A -49 )
     LYS( 12 A -48 )
     PRO( 12 A -47 )
     GLY( 12 A -46 )
     ILE( 12 A -45 )
     TYR( 12 A -44 )
     PRO( 12 A -43 )
     ALA( 12 A -42 )
     TYR( 12 A -41 )
     HIS( 12 A -40 )
     MET( 12 A -39 )
     ASN( 12 A -38 )
     LYS( 12 A -37 )
     GLU( 12 A -36 )
     HIS( 12 A -35 )
     TRP( 12 A -34 )
     ILE( 12 A -33 )
     THR( 12 A -32 )
     VAL( 12 A -31 )
     LEU( 12 A -30 )
     LEU( 12 A -29 )
     ASN( 12 A -28 )
     GLY( 12 A -27 )
     PRO( 12 A -26 )
     LEU( 12 A -25 )
     GLY( 12 A -24 )
     ALA( 12 A -23 )
     LYS( 12 A -22 )
     GLU( 12 A -21 )
     ILE( 12 A -20 )
     HIS( 12 A -19 )
     SER( 12 A -18 )
     LEU( 12 A -17 )
     ILE( 12 A -16 )
     GLU( 12 A -15 )
     ASP( 12 A -14 )
     SER( 12 A -13 )
     PHE( 12 A -12 )
     GLN( 12 A -11 )
     LEU( 12 A -10 )
     THR( 12 A  -9 )
     ARG( 12 A  -8 )
     LEU( 12 A  -7 )
     GLU( 12 A  -6 )
     HIS( 12 A  -5 )
     HIS( 12 A  -4 )
     HIS( 12 A  -3 )
     HIS( 12 A  -2 )
     HIS( 12 A  -1 )
     HIS( 12 A   0 )
     MET( 13 A-124 )
     ASN( 13 A-123 )
     ARG( 13 A-122 )
     GLN( 13 A-121 )
     GLN( 13 A-120 )
     PHE( 13 A-119 )
     ILE( 13 A-118 )
     ASP( 13 A-117 )
     TYR( 13 A-116 )
     ALA( 13 A-115 )
     GLN( 13 A-114 )
     LYS( 13 A-113 )
     LYS( 13 A-112 )
     TYR( 13 A-111 )
     ASP( 13 A-110 )
     THR( 13 A-109 )
     LYS( 13 A-108 )
     PRO( 13 A-107 )
     ASP( 13 A-106 )
     HIS( 13 A-105 )
     PRO( 13 A-104 )
     TRP( 13 A-103 )
     GLU( 13 A-102 )
     LYS( 13 A-101 )
     PHE( 13 A-100 )
     PRO( 13 A -99 )
     ASP( 13 A -98 )
     TYR( 13 A -97 )
     ALA( 13 A -96 )
     VAL( 13 A -95 )
     PHE( 13 A -94 )
     ARG( 13 A -93 )
     HIS( 13 A -92 )
     SER( 13 A -91 )
     ASP( 13 A -90 )
     ASN( 13 A -89 )
     ASP( 13 A -88 )
     LYS( 13 A -87 )
     TRP( 13 A -86 )
     TYR( 13 A -85 )
     ALA( 13 A -84 )
     LEU( 13 A -83 )
     LEU( 13 A -82 )
     MET( 13 A -81 )
     ASP( 13 A -80 )
     ILE( 13 A -79 )
     PRO( 13 A -78 )
     ALA( 13 A -77 )
     GLU( 13 A -76 )
     LYS( 13 A -75 )
     ILE( 13 A -74 )
     GLY( 13 A -73 )
     ILE( 13 A -72 )
     ASN( 13 A -71 )
     GLY( 13 A -70 )
     ASP( 13 A -69 )
     LYS( 13 A -68 )
     ARG( 13 A -67 )
     VAL( 13 A -66 )
     ASP( 13 A -65 )
     VAL( 13 A -64 )
     ILE( 13 A -63 )
     ASP( 13 A -62 )
     LEU( 13 A -61 )
     LYS( 13 A -60 )
     VAL( 13 A -59 )
     GLN( 13 A -58 )
     PRO( 13 A -57 )
     GLU( 13 A -56 )
     LEU( 13 A -55 )
     VAL( 13 A -54 )
     GLY( 13 A -53 )
     SER( 13 A -52 )
     LEU( 13 A -51 )
     ARG( 13 A -50 )
     LYS( 13 A -49 )
     LYS( 13 A -48 )
     PRO( 13 A -47 )
     GLY( 13 A -46 )
     ILE( 13 A -45 )
     TYR( 13 A -44 )
     PRO( 13 A -43 )
     ALA( 13 A -42 )
     TYR( 13 A -41 )
     HIS( 13 A -40 )
     MET( 13 A -39 )
     ASN( 13 A -38 )
     LYS( 13 A -37 )
     GLU( 13 A -36 )
     HIS( 13 A -35 )
     TRP( 13 A -34 )
     ILE( 13 A -33 )
     THR( 13 A -32 )
     VAL( 13 A -31 )
     LEU( 13 A -30 )
     LEU( 13 A -29 )
     ASN( 13 A -28 )
     GLY( 13 A -27 )
     PRO( 13 A -26 )
     LEU( 13 A -25 )
     GLY( 13 A -24 )
     ALA( 13 A -23 )
     LYS( 13 A -22 )
     GLU( 13 A -21 )
     ILE( 13 A -20 )
     HIS( 13 A -19 )
     SER( 13 A -18 )
     LEU( 13 A -17 )
     ILE( 13 A -16 )
     GLU( 13 A -15 )
     ASP( 13 A -14 )
     SER( 13 A -13 )
     PHE( 13 A -12 )
     GLN( 13 A -11 )
     LEU( 13 A -10 )
     THR( 13 A  -9 )
     ARG( 13 A  -8 )
     LEU( 13 A  -7 )
     GLU( 13 A  -6 )
     HIS( 13 A  -5 )
     HIS( 13 A  -4 )
     HIS( 13 A  -3 )
     HIS( 13 A  -2 )
     HIS( 13 A  -1 )
     HIS( 13 A   0 )
     MET( 14 A-124 )
     ASN( 14 A-123 )
     ARG( 14 A-122 )
     GLN( 14 A-121 )
     GLN( 14 A-120 )
     PHE( 14 A-119 )
     ILE( 14 A-118 )
     ASP( 14 A-117 )
     TYR( 14 A-116 )
     ALA( 14 A-115 )
     GLN( 14 A-114 )
     LYS( 14 A-113 )
     LYS( 14 A-112 )
     TYR( 14 A-111 )
     ASP( 14 A-110 )
     THR( 14 A-109 )
     LYS( 14 A-108 )
     PRO( 14 A-107 )
     ASP( 14 A-106 )
     HIS( 14 A-105 )
     PRO( 14 A-104 )
     TRP( 14 A-103 )
     GLU( 14 A-102 )
     LYS( 14 A-101 )
     PHE( 14 A-100 )
     PRO( 14 A -99 )
     ASP( 14 A -98 )
     TYR( 14 A -97 )
     ALA( 14 A -96 )
     VAL( 14 A -95 )
     PHE( 14 A -94 )
     ARG( 14 A -93 )
     HIS( 14 A -92 )
     SER( 14 A -91 )
     ASP( 14 A -90 )
     ASN( 14 A -89 )
     ASP( 14 A -88 )
     LYS( 14 A -87 )
     TRP( 14 A -86 )
     TYR( 14 A -85 )
     ALA( 14 A -84 )
     LEU( 14 A -83 )
     LEU( 14 A -82 )
     MET( 14 A -81 )
     ASP( 14 A -80 )
     ILE( 14 A -79 )
     PRO( 14 A -78 )
     ALA( 14 A -77 )
     GLU( 14 A -76 )
     LYS( 14 A -75 )
     ILE( 14 A -74 )
     GLY( 14 A -73 )
     ILE( 14 A -72 )
     ASN( 14 A -71 )
     GLY( 14 A -70 )
     ASP( 14 A -69 )
     LYS( 14 A -68 )
     ARG( 14 A -67 )
     VAL( 14 A -66 )
     ASP( 14 A -65 )
     VAL( 14 A -64 )
     ILE( 14 A -63 )
     ASP( 14 A -62 )
     LEU( 14 A -61 )
     LYS( 14 A -60 )
     VAL( 14 A -59 )
     GLN( 14 A -58 )
     PRO( 14 A -57 )
     GLU( 14 A -56 )
     LEU( 14 A -55 )
     VAL( 14 A -54 )
     GLY( 14 A -53 )
     SER( 14 A -52 )
     LEU( 14 A -51 )
     ARG( 14 A -50 )
     LYS( 14 A -49 )
     LYS( 14 A -48 )
     PRO( 14 A -47 )
     GLY( 14 A -46 )
     ILE( 14 A -45 )
     TYR( 14 A -44 )
     PRO( 14 A -43 )
     ALA( 14 A -42 )
     TYR( 14 A -41 )
     HIS( 14 A -40 )
     MET( 14 A -39 )
     ASN( 14 A -38 )
     LYS( 14 A -37 )
     GLU( 14 A -36 )
     HIS( 14 A -35 )
     TRP( 14 A -34 )
     ILE( 14 A -33 )
     THR( 14 A -32 )
     VAL( 14 A -31 )
     LEU( 14 A -30 )
     LEU( 14 A -29 )
     ASN( 14 A -28 )
     GLY( 14 A -27 )
     PRO( 14 A -26 )
     LEU( 14 A -25 )
     GLY( 14 A -24 )
     ALA( 14 A -23 )
     LYS( 14 A -22 )
     GLU( 14 A -21 )
     ILE( 14 A -20 )
     HIS( 14 A -19 )
     SER( 14 A -18 )
     LEU( 14 A -17 )
     ILE( 14 A -16 )
     GLU( 14 A -15 )
     ASP( 14 A -14 )
     SER( 14 A -13 )
     PHE( 14 A -12 )
     GLN( 14 A -11 )
     LEU( 14 A -10 )
     THR( 14 A  -9 )
     ARG( 14 A  -8 )
     LEU( 14 A  -7 )
     GLU( 14 A  -6 )
     HIS( 14 A  -5 )
     HIS( 14 A  -4 )
     HIS( 14 A  -3 )
     HIS( 14 A  -2 )
     HIS( 14 A  -1 )
     HIS( 14 A   0 )
     MET( 15 A-124 )
     ASN( 15 A-123 )
     ARG( 15 A-122 )
     GLN( 15 A-121 )
     GLN( 15 A-120 )
     PHE( 15 A-119 )
     ILE( 15 A-118 )
     ASP( 15 A-117 )
     TYR( 15 A-116 )
     ALA( 15 A-115 )
     GLN( 15 A-114 )
     LYS( 15 A-113 )
     LYS( 15 A-112 )
     TYR( 15 A-111 )
     ASP( 15 A-110 )
     THR( 15 A-109 )
     LYS( 15 A-108 )
     PRO( 15 A-107 )
     ASP( 15 A-106 )
     HIS( 15 A-105 )
     PRO( 15 A-104 )
     TRP( 15 A-103 )
     GLU( 15 A-102 )
     LYS( 15 A-101 )
     PHE( 15 A-100 )
     PRO( 15 A -99 )
     ASP( 15 A -98 )
     TYR( 15 A -97 )
     ALA( 15 A -96 )
     VAL( 15 A -95 )
     PHE( 15 A -94 )
     ARG( 15 A -93 )
     HIS( 15 A -92 )
     SER( 15 A -91 )
     ASP( 15 A -90 )
     ASN( 15 A -89 )
     ASP( 15 A -88 )
     LYS( 15 A -87 )
     TRP( 15 A -86 )
     TYR( 15 A -85 )
     ALA( 15 A -84 )
     LEU( 15 A -83 )
     LEU( 15 A -82 )
     MET( 15 A -81 )
     ASP( 15 A -80 )
     ILE( 15 A -79 )
     PRO( 15 A -78 )
     ALA( 15 A -77 )
     GLU( 15 A -76 )
     LYS( 15 A -75 )
     ILE( 15 A -74 )
     GLY( 15 A -73 )
     ILE( 15 A -72 )
     ASN( 15 A -71 )
     GLY( 15 A -70 )
     ASP( 15 A -69 )
     LYS( 15 A -68 )
     ARG( 15 A -67 )
     VAL( 15 A -66 )
     ASP( 15 A -65 )
     VAL( 15 A -64 )
     ILE( 15 A -63 )
     ASP( 15 A -62 )
     LEU( 15 A -61 )
     LYS( 15 A -60 )
     VAL( 15 A -59 )
     GLN( 15 A -58 )
     PRO( 15 A -57 )
     GLU( 15 A -56 )
     LEU( 15 A -55 )
     VAL( 15 A -54 )
     GLY( 15 A -53 )
     SER( 15 A -52 )
     LEU( 15 A -51 )
     ARG( 15 A -50 )
     LYS( 15 A -49 )
     LYS( 15 A -48 )
     PRO( 15 A -47 )
     GLY( 15 A -46 )
     ILE( 15 A -45 )
     TYR( 15 A -44 )
     PRO( 15 A -43 )
     ALA( 15 A -42 )
     TYR( 15 A -41 )
     HIS( 15 A -40 )
     MET( 15 A -39 )
     ASN( 15 A -38 )
     LYS( 15 A -37 )
     GLU( 15 A -36 )
     HIS( 15 A -35 )
     TRP( 15 A -34 )
     ILE( 15 A -33 )
     THR( 15 A -32 )
     VAL( 15 A -31 )
     LEU( 15 A -30 )
     LEU( 15 A -29 )
     ASN( 15 A -28 )
     GLY( 15 A -27 )
     PRO( 15 A -26 )
     LEU( 15 A -25 )
     GLY( 15 A -24 )
     ALA( 15 A -23 )
     LYS( 15 A -22 )
     GLU( 15 A -21 )
     ILE( 15 A -20 )
     HIS( 15 A -19 )
     SER( 15 A -18 )
     LEU( 15 A -17 )
     ILE( 15 A -16 )
     GLU( 15 A -15 )
     ASP( 15 A -14 )
     SER( 15 A -13 )
     PHE( 15 A -12 )
     GLN( 15 A -11 )
     LEU( 15 A -10 )
     THR( 15 A  -9 )
     ARG( 15 A  -8 )
     LEU( 15 A  -7 )
     GLU( 15 A  -6 )
     HIS( 15 A  -5 )
     HIS( 15 A  -4 )
     HIS( 15 A  -3 )
     HIS( 15 A  -2 )
     HIS( 15 A  -1 )
     HIS( 15 A   0 )
     MET( 16 A-124 )
     ASN( 16 A-123 )
     ARG( 16 A-122 )
     GLN( 16 A-121 )
     GLN( 16 A-120 )
     PHE( 16 A-119 )
     ILE( 16 A-118 )
     ASP( 16 A-117 )
     TYR( 16 A-116 )
     ALA( 16 A-115 )
     GLN( 16 A-114 )
     LYS( 16 A-113 )
     LYS( 16 A-112 )
     TYR( 16 A-111 )
     ASP( 16 A-110 )
     THR( 16 A-109 )
     LYS( 16 A-108 )
     PRO( 16 A-107 )
     ASP( 16 A-106 )
     HIS( 16 A-105 )
     PRO( 16 A-104 )
     TRP( 16 A-103 )
     GLU( 16 A-102 )
     LYS( 16 A-101 )
     PHE( 16 A-100 )
     PRO( 16 A -99 )
     ASP( 16 A -98 )
     TYR( 16 A -97 )
     ALA( 16 A -96 )
     VAL( 16 A -95 )
     PHE( 16 A -94 )
     ARG( 16 A -93 )
     HIS( 16 A -92 )
     SER( 16 A -91 )
     ASP( 16 A -90 )
     ASN( 16 A -89 )
     ASP( 16 A -88 )
     LYS( 16 A -87 )
     TRP( 16 A -86 )
     TYR( 16 A -85 )
     ALA( 16 A -84 )
     LEU( 16 A -83 )
     LEU( 16 A -82 )
     MET( 16 A -81 )
     ASP( 16 A -80 )
     ILE( 16 A -79 )
     PRO( 16 A -78 )
     ALA( 16 A -77 )
     GLU( 16 A -76 )
     LYS( 16 A -75 )
     ILE( 16 A -74 )
     GLY( 16 A -73 )
     ILE( 16 A -72 )
     ASN( 16 A -71 )
     GLY( 16 A -70 )
     ASP( 16 A -69 )
     LYS( 16 A -68 )
     ARG( 16 A -67 )
     VAL( 16 A -66 )
     ASP( 16 A -65 )
     VAL( 16 A -64 )
     ILE( 16 A -63 )
     ASP( 16 A -62 )
     LEU( 16 A -61 )
     LYS( 16 A -60 )
     VAL( 16 A -59 )
     GLN( 16 A -58 )
     PRO( 16 A -57 )
     GLU( 16 A -56 )
     LEU( 16 A -55 )
     VAL( 16 A -54 )
     GLY( 16 A -53 )
     SER( 16 A -52 )
     LEU( 16 A -51 )
     ARG( 16 A -50 )
     LYS( 16 A -49 )
     LYS( 16 A -48 )
     PRO( 16 A -47 )
     GLY( 16 A -46 )
     ILE( 16 A -45 )
     TYR( 16 A -44 )
     PRO( 16 A -43 )
     ALA( 16 A -42 )
     TYR( 16 A -41 )
     HIS( 16 A -40 )
     MET( 16 A -39 )
     ASN( 16 A -38 )
     LYS( 16 A -37 )
     GLU( 16 A -36 )
     HIS( 16 A -35 )
     TRP( 16 A -34 )
     ILE( 16 A -33 )
     THR( 16 A -32 )
     VAL( 16 A -31 )
     LEU( 16 A -30 )
     LEU( 16 A -29 )
     ASN( 16 A -28 )
     GLY( 16 A -27 )
     PRO( 16 A -26 )
     LEU( 16 A -25 )
     GLY( 16 A -24 )
     ALA( 16 A -23 )
     LYS( 16 A -22 )
     GLU( 16 A -21 )
     ILE( 16 A -20 )
     HIS( 16 A -19 )
     SER( 16 A -18 )
     LEU( 16 A -17 )
     ILE( 16 A -16 )
     GLU( 16 A -15 )
     ASP( 16 A -14 )
     SER( 16 A -13 )
     PHE( 16 A -12 )
     GLN( 16 A -11 )
     LEU( 16 A -10 )
     THR( 16 A  -9 )
     ARG( 16 A  -8 )
     LEU( 16 A  -7 )
     GLU( 16 A  -6 )
     HIS( 16 A  -5 )
     HIS( 16 A  -4 )
     HIS( 16 A  -3 )
     HIS( 16 A  -2 )
     HIS( 16 A  -1 )
     HIS( 16 A   0 )
     MET( 17 A-124 )
     ASN( 17 A-123 )
     ARG( 17 A-122 )
     GLN( 17 A-121 )
     GLN( 17 A-120 )
     PHE( 17 A-119 )
     ILE( 17 A-118 )
     ASP( 17 A-117 )
     TYR( 17 A-116 )
     ALA( 17 A-115 )
     GLN( 17 A-114 )
     LYS( 17 A-113 )
     LYS( 17 A-112 )
     TYR( 17 A-111 )
     ASP( 17 A-110 )
     THR( 17 A-109 )
     LYS( 17 A-108 )
     PRO( 17 A-107 )
     ASP( 17 A-106 )
     HIS( 17 A-105 )
     PRO( 17 A-104 )
     TRP( 17 A-103 )
     GLU( 17 A-102 )
     LYS( 17 A-101 )
     PHE( 17 A-100 )
     PRO( 17 A -99 )
     ASP( 17 A -98 )
     TYR( 17 A -97 )
     ALA( 17 A -96 )
     VAL( 17 A -95 )
     PHE( 17 A -94 )
     ARG( 17 A -93 )
     HIS( 17 A -92 )
     SER( 17 A -91 )
     ASP( 17 A -90 )
     ASN( 17 A -89 )
     ASP( 17 A -88 )
     LYS( 17 A -87 )
     TRP( 17 A -86 )
     TYR( 17 A -85 )
     ALA( 17 A -84 )
     LEU( 17 A -83 )
     LEU( 17 A -82 )
     MET( 17 A -81 )
     ASP( 17 A -80 )
     ILE( 17 A -79 )
     PRO( 17 A -78 )
     ALA( 17 A -77 )
     GLU( 17 A -76 )
     LYS( 17 A -75 )
     ILE( 17 A -74 )
     GLY( 17 A -73 )
     ILE( 17 A -72 )
     ASN( 17 A -71 )
     GLY( 17 A -70 )
     ASP( 17 A -69 )
     LYS( 17 A -68 )
     ARG( 17 A -67 )
     VAL( 17 A -66 )
     ASP( 17 A -65 )
     VAL( 17 A -64 )
     ILE( 17 A -63 )
     ASP( 17 A -62 )
     LEU( 17 A -61 )
     LYS( 17 A -60 )
     VAL( 17 A -59 )
     GLN( 17 A -58 )
     PRO( 17 A -57 )
     GLU( 17 A -56 )
     LEU( 17 A -55 )
     VAL( 17 A -54 )
     GLY( 17 A -53 )
     SER( 17 A -52 )
     LEU( 17 A -51 )
     ARG( 17 A -50 )
     LYS( 17 A -49 )
     LYS( 17 A -48 )
     PRO( 17 A -47 )
     GLY( 17 A -46 )
     ILE( 17 A -45 )
     TYR( 17 A -44 )
     PRO( 17 A -43 )
     ALA( 17 A -42 )
     TYR( 17 A -41 )
     HIS( 17 A -40 )
     MET( 17 A -39 )
     ASN( 17 A -38 )
     LYS( 17 A -37 )
     GLU( 17 A -36 )
     HIS( 17 A -35 )
     TRP( 17 A -34 )
     ILE( 17 A -33 )
     THR( 17 A -32 )
     VAL( 17 A -31 )
     LEU( 17 A -30 )
     LEU( 17 A -29 )
     ASN( 17 A -28 )
     GLY( 17 A -27 )
     PRO( 17 A -26 )
     LEU( 17 A -25 )
     GLY( 17 A -24 )
     ALA( 17 A -23 )
     LYS( 17 A -22 )
     GLU( 17 A -21 )
     ILE( 17 A -20 )
     HIS( 17 A -19 )
     SER( 17 A -18 )
     LEU( 17 A -17 )
     ILE( 17 A -16 )
     GLU( 17 A -15 )
     ASP( 17 A -14 )
     SER( 17 A -13 )
     PHE( 17 A -12 )
     GLN( 17 A -11 )
     LEU( 17 A -10 )
     THR( 17 A  -9 )
     ARG( 17 A  -8 )
     LEU( 17 A  -7 )
     GLU( 17 A  -6 )
     HIS( 17 A  -5 )
     HIS( 17 A  -4 )
     HIS( 17 A  -3 )
     HIS( 17 A  -2 )
     HIS( 17 A  -1 )
     HIS( 17 A   0 )
     MET( 18 A-124 )
     ASN( 18 A-123 )
     ARG( 18 A-122 )
     GLN( 18 A-121 )
     GLN( 18 A-120 )
     PHE( 18 A-119 )
     ILE( 18 A-118 )
     ASP( 18 A-117 )
     TYR( 18 A-116 )
     ALA( 18 A-115 )
     GLN( 18 A-114 )
     LYS( 18 A-113 )
     LYS( 18 A-112 )
     TYR( 18 A-111 )
     ASP( 18 A-110 )
     THR( 18 A-109 )
     LYS( 18 A-108 )
     PRO( 18 A-107 )
     ASP( 18 A-106 )
     HIS( 18 A-105 )
     PRO( 18 A-104 )
     TRP( 18 A-103 )
     GLU( 18 A-102 )
     LYS( 18 A-101 )
     PHE( 18 A-100 )
     PRO( 18 A -99 )
     ASP( 18 A -98 )
     TYR( 18 A -97 )
     ALA( 18 A -96 )
     VAL( 18 A -95 )
     PHE( 18 A -94 )
     ARG( 18 A -93 )
     HIS( 18 A -92 )
     SER( 18 A -91 )
     ASP( 18 A -90 )
     ASN( 18 A -89 )
     ASP( 18 A -88 )
     LYS( 18 A -87 )
     TRP( 18 A -86 )
     TYR( 18 A -85 )
     ALA( 18 A -84 )
     LEU( 18 A -83 )
     LEU( 18 A -82 )
     MET( 18 A -81 )
     ASP( 18 A -80 )
     ILE( 18 A -79 )
     PRO( 18 A -78 )
     ALA( 18 A -77 )
     GLU( 18 A -76 )
     LYS( 18 A -75 )
     ILE( 18 A -74 )
     GLY( 18 A -73 )
     ILE( 18 A -72 )
     ASN( 18 A -71 )
     GLY( 18 A -70 )
     ASP( 18 A -69 )
     LYS( 18 A -68 )
     ARG( 18 A -67 )
     VAL( 18 A -66 )
     ASP( 18 A -65 )
     VAL( 18 A -64 )
     ILE( 18 A -63 )
     ASP( 18 A -62 )
     LEU( 18 A -61 )
     LYS( 18 A -60 )
     VAL( 18 A -59 )
     GLN( 18 A -58 )
     PRO( 18 A -57 )
     GLU( 18 A -56 )
     LEU( 18 A -55 )
     VAL( 18 A -54 )
     GLY( 18 A -53 )
     SER( 18 A -52 )
     LEU( 18 A -51 )
     ARG( 18 A -50 )
     LYS( 18 A -49 )
     LYS( 18 A -48 )
     PRO( 18 A -47 )
     GLY( 18 A -46 )
     ILE( 18 A -45 )
     TYR( 18 A -44 )
     PRO( 18 A -43 )
     ALA( 18 A -42 )
     TYR( 18 A -41 )
     HIS( 18 A -40 )
     MET( 18 A -39 )
     ASN( 18 A -38 )
     LYS( 18 A -37 )
     GLU( 18 A -36 )
     HIS( 18 A -35 )
     TRP( 18 A -34 )
     ILE( 18 A -33 )
     THR( 18 A -32 )
     VAL( 18 A -31 )
     LEU( 18 A -30 )
     LEU( 18 A -29 )
     ASN( 18 A -28 )
     GLY( 18 A -27 )
     PRO( 18 A -26 )
     LEU( 18 A -25 )
     GLY( 18 A -24 )
     ALA( 18 A -23 )
     LYS( 18 A -22 )
     GLU( 18 A -21 )
     ILE( 18 A -20 )
     HIS( 18 A -19 )
     SER( 18 A -18 )
     LEU( 18 A -17 )
     ILE( 18 A -16 )
     GLU( 18 A -15 )
     ASP( 18 A -14 )
     SER( 18 A -13 )
     PHE( 18 A -12 )
     GLN( 18 A -11 )
     LEU( 18 A -10 )
     THR( 18 A  -9 )
     ARG( 18 A  -8 )
     LEU( 18 A  -7 )
     GLU( 18 A  -6 )
     HIS( 18 A  -5 )
     HIS( 18 A  -4 )
     HIS( 18 A  -3 )
     HIS( 18 A  -2 )
     HIS( 18 A  -1 )
     HIS( 18 A   0 )
     MET( 19 A-124 )
     ASN( 19 A-123 )
     ARG( 19 A-122 )
     GLN( 19 A-121 )
     GLN( 19 A-120 )
     PHE( 19 A-119 )
     ILE( 19 A-118 )
     ASP( 19 A-117 )
     TYR( 19 A-116 )
     ALA( 19 A-115 )
     GLN( 19 A-114 )
     LYS( 19 A-113 )
     LYS( 19 A-112 )
     TYR( 19 A-111 )
     ASP( 19 A-110 )
     THR( 19 A-109 )
     LYS( 19 A-108 )
     PRO( 19 A-107 )
     ASP( 19 A-106 )
     HIS( 19 A-105 )
     PRO( 19 A-104 )
     TRP( 19 A-103 )
     GLU( 19 A-102 )
     LYS( 19 A-101 )
     PHE( 19 A-100 )
     PRO( 19 A -99 )
     ASP( 19 A -98 )
     TYR( 19 A -97 )
     ALA( 19 A -96 )
     VAL( 19 A -95 )
     PHE( 19 A -94 )
     ARG( 19 A -93 )
     HIS( 19 A -92 )
     SER( 19 A -91 )
     ASP( 19 A -90 )
     ASN( 19 A -89 )
     ASP( 19 A -88 )
     LYS( 19 A -87 )
     TRP( 19 A -86 )
     TYR( 19 A -85 )
     ALA( 19 A -84 )
     LEU( 19 A -83 )
     LEU( 19 A -82 )
     MET( 19 A -81 )
     ASP( 19 A -80 )
     ILE( 19 A -79 )
     PRO( 19 A -78 )
     ALA( 19 A -77 )
     GLU( 19 A -76 )
     LYS( 19 A -75 )
     ILE( 19 A -74 )
     GLY( 19 A -73 )
     ILE( 19 A -72 )
     ASN( 19 A -71 )
     GLY( 19 A -70 )
     ASP( 19 A -69 )
     LYS( 19 A -68 )
     ARG( 19 A -67 )
     VAL( 19 A -66 )
     ASP( 19 A -65 )
     VAL( 19 A -64 )
     ILE( 19 A -63 )
     ASP( 19 A -62 )
     LEU( 19 A -61 )
     LYS( 19 A -60 )
     VAL( 19 A -59 )
     GLN( 19 A -58 )
     PRO( 19 A -57 )
     GLU( 19 A -56 )
     LEU( 19 A -55 )
     VAL( 19 A -54 )
     GLY( 19 A -53 )
     SER( 19 A -52 )
     LEU( 19 A -51 )
     ARG( 19 A -50 )
     LYS( 19 A -49 )
     LYS( 19 A -48 )
     PRO( 19 A -47 )
     GLY( 19 A -46 )
     ILE( 19 A -45 )
     TYR( 19 A -44 )
     PRO( 19 A -43 )
     ALA( 19 A -42 )
     TYR( 19 A -41 )
     HIS( 19 A -40 )
     MET( 19 A -39 )
     ASN( 19 A -38 )
     LYS( 19 A -37 )
     GLU( 19 A -36 )
     HIS( 19 A -35 )
     TRP( 19 A -34 )
     ILE( 19 A -33 )
     THR( 19 A -32 )
     VAL( 19 A -31 )
     LEU( 19 A -30 )
     LEU( 19 A -29 )
     ASN( 19 A -28 )
     GLY( 19 A -27 )
     PRO( 19 A -26 )
     LEU( 19 A -25 )
     GLY( 19 A -24 )
     ALA( 19 A -23 )
     LYS( 19 A -22 )
     GLU( 19 A -21 )
     ILE( 19 A -20 )
     HIS( 19 A -19 )
     SER( 19 A -18 )
     LEU( 19 A -17 )
     ILE( 19 A -16 )
     GLU( 19 A -15 )
     ASP( 19 A -14 )
     SER( 19 A -13 )
     PHE( 19 A -12 )
     GLN( 19 A -11 )
     LEU( 19 A -10 )
     THR( 19 A  -9 )
     ARG( 19 A  -8 )
     LEU( 19 A  -7 )
     GLU( 19 A  -6 )
     HIS( 19 A  -5 )
     HIS( 19 A  -4 )
     HIS( 19 A  -3 )
     HIS( 19 A  -2 )
     HIS( 19 A  -1 )
     HIS( 19 A   0 )
     MET( 20 A-124 )
     ASN( 20 A-123 )
     ARG( 20 A-122 )
     GLN( 20 A-121 )
     GLN( 20 A-120 )
     PHE( 20 A-119 )
     ILE( 20 A-118 )
     ASP( 20 A-117 )
     TYR( 20 A-116 )
     ALA( 20 A-115 )
     GLN( 20 A-114 )
     LYS( 20 A-113 )
     LYS( 20 A-112 )
     TYR( 20 A-111 )
     ASP( 20 A-110 )
     THR( 20 A-109 )
     LYS( 20 A-108 )
     PRO( 20 A-107 )
     ASP( 20 A-106 )
     HIS( 20 A-105 )
     PRO( 20 A-104 )
     TRP( 20 A-103 )
     GLU( 20 A-102 )
     LYS( 20 A-101 )
     PHE( 20 A-100 )
     PRO( 20 A -99 )
     ASP( 20 A -98 )
     TYR( 20 A -97 )
     ALA( 20 A -96 )
     VAL( 20 A -95 )
     PHE( 20 A -94 )
     ARG( 20 A -93 )
     HIS( 20 A -92 )
     SER( 20 A -91 )
     ASP( 20 A -90 )
     ASN( 20 A -89 )
     ASP( 20 A -88 )
     LYS( 20 A -87 )
     TRP( 20 A -86 )
     TYR( 20 A -85 )
     ALA( 20 A -84 )
     LEU( 20 A -83 )
     LEU( 20 A -82 )
     MET( 20 A -81 )
     ASP( 20 A -80 )
     ILE( 20 A -79 )
     PRO( 20 A -78 )
     ALA( 20 A -77 )
     GLU( 20 A -76 )
     LYS( 20 A -75 )
     ILE( 20 A -74 )
     GLY( 20 A -73 )
     ILE( 20 A -72 )
     ASN( 20 A -71 )
     GLY( 20 A -70 )
     ASP( 20 A -69 )
     LYS( 20 A -68 )
     ARG( 20 A -67 )
     VAL( 20 A -66 )
     ASP( 20 A -65 )
     VAL( 20 A -64 )
     ILE( 20 A -63 )
     ASP( 20 A -62 )
     LEU( 20 A -61 )
     LYS( 20 A -60 )
     VAL( 20 A -59 )
     GLN( 20 A -58 )
     PRO( 20 A -57 )
     GLU( 20 A -56 )
     LEU( 20 A -55 )
     VAL( 20 A -54 )
     GLY( 20 A -53 )
     SER( 20 A -52 )
     LEU( 20 A -51 )
     ARG( 20 A -50 )
     LYS( 20 A -49 )
     LYS( 20 A -48 )
     PRO( 20 A -47 )
     GLY( 20 A -46 )
     ILE( 20 A -45 )
     TYR( 20 A -44 )
     PRO( 20 A -43 )
     ALA( 20 A -42 )
     TYR( 20 A -41 )
     HIS( 20 A -40 )
     MET( 20 A -39 )
     ASN( 20 A -38 )
     LYS( 20 A -37 )
     GLU( 20 A -36 )
     HIS( 20 A -35 )
     TRP( 20 A -34 )
     ILE( 20 A -33 )
     THR( 20 A -32 )
     VAL( 20 A -31 )
     LEU( 20 A -30 )
     LEU( 20 A -29 )
     ASN( 20 A -28 )
     GLY( 20 A -27 )
     PRO( 20 A -26 )
     LEU( 20 A -25 )
     GLY( 20 A -24 )
     ALA( 20 A -23 )
     LYS( 20 A -22 )
     GLU( 20 A -21 )
     ILE( 20 A -20 )
     HIS( 20 A -19 )
     SER( 20 A -18 )
     LEU( 20 A -17 )
     ILE( 20 A -16 )
     GLU( 20 A -15 )
     ASP( 20 A -14 )
     SER( 20 A -13 )
     PHE( 20 A -12 )
     GLN( 20 A -11 )
     LEU( 20 A -10 )
     THR( 20 A  -9 )
     ARG( 20 A  -8 )
     LEU( 20 A  -7 )
     GLU( 20 A  -6 )
     HIS( 20 A  -5 )
     HIS( 20 A  -4 )
     HIS( 20 A  -3 )
     HIS( 20 A  -2 )
     HIS( 20 A  -1 )
     HIS( 20 A   0 )


   PDB Chain_ID: A

           1                                                        15
   SEQRES: MET ASN ARG GLN GLN PHE ILE ASP TYR ALA GLN LYS LYS TYR ASP 
   COORDS: ... ... ... ... ... ... ... ... ... ... ... ... ... ... ... 
                                                                       

           16                                                       30
   SEQRES: THR LYS PRO ASP HIS PRO TRP GLU LYS PHE PRO ASP TYR ALA VAL 
   COORDS: ... ... ... ... ... ... ... ... ... ... ... ... ... ... ... 
                                                                       

           31                                                       45
   SEQRES: PHE ARG HIS SER ASP ASN ASP LYS TRP TYR ALA LEU LEU MET ASP 
   COORDS: ... ... ... ... ... ... ... ... ... ... ... ... ... ... ... 
                                                                       

           46                                                       60
   SEQRES: ILE PRO ALA GLU LYS ILE GLY ILE ASN GLY ASP LYS ARG VAL ASP 
   COORDS: ... ... ... ... ... ... ... ... ... ... ... ... ... ... ... 
                                                                       

           61                                                       75
   SEQRES: VAL ILE ASP LEU LYS VAL GLN PRO GLU LEU VAL GLY SER LEU ARG 
   COORDS: ... ... ... ... ... ... ... ... ... ... ... ... ... ... ... 
                                                                       

           76                                                       90
   SEQRES: LYS LYS PRO GLY ILE TYR PRO ALA TYR HIS MET ASN LYS GLU HIS 
   COORDS: ... ... ... ... ... ... ... ... ... ... ... ... ... ... ... 
                                                                       

           91                                                      105
   SEQRES: TRP ILE THR VAL LEU LEU ASN GLY PRO LEU GLY ALA LYS GLU ILE 
   COORDS: ... ... ... ... ... ... ... ... ... ... ... ... ... ... ... 
                                                                       

           106                                                     120
   SEQRES: HIS SER LEU ILE GLU ASP SER PHE GLN LEU THR ARG LEU GLU HIS 
   COORDS: ... ... ... ... ... ... ... ... ... ... ... ... ... ... ... 
                                                                       

           121                                                     135
   SEQRES: HIS HIS HIS HIS HIS MET ASN ARG GLN GLN PHE ILE ASP TYR ALA 
   COORDS: ... ... ... ... ... MET ASN ARG GLN GLN PHE ILE ASP TYR ALA 
                               1                                    10

           136                                                     150
   SEQRES: GLN LYS LYS TYR ASP THR LYS PRO ASP HIS PRO TRP GLU LYS PHE 
   COORDS: GLN LYS LYS TYR ASP THR LYS PRO ASP HIS PRO TRP GLU LYS PHE 
           11                                                       25

           151                                                     165
   SEQRES: PRO ASP TYR ALA VAL PHE ARG HIS SER ASP ASN ASP LYS TRP TYR 
   COORDS: PRO ASP TYR ALA VAL PHE ARG HIS SER ASP ASN ASP LYS TRP TYR 
           26                                                       40

           166                                                     180
   SEQRES: ALA LEU LEU MET ASP ILE PRO ALA GLU LYS ILE GLY ILE ASN GLY 
   COORDS: ALA LEU LEU MET ASP ILE PRO ALA GLU LYS ILE GLY ILE ASN GLY 
           41                                                       55

           181                                                     195
   SEQRES: ASP LYS ARG VAL ASP VAL ILE ASP LEU LYS VAL GLN PRO GLU LEU 
   COORDS: ASP LYS ARG VAL ASP VAL ILE ASP LEU LYS VAL GLN PRO GLU LEU 
           56                                                       70

           196                                                     210
   SEQRES: VAL GLY SER LEU ARG LYS LYS PRO GLY ILE TYR PRO ALA TYR HIS 
   COORDS: VAL GLY SER LEU ARG LYS LYS PRO GLY ILE TYR PRO ALA TYR HIS 
           71                                                       85

           211                                                     225
   SEQRES: MET ASN LYS GLU HIS TRP ILE THR VAL LEU LEU ASN GLY PRO LEU 
   COORDS: MET ASN LYS GLU HIS TRP ILE THR VAL LEU LEU ASN GLY PRO LEU 
           86                                                      100

           226                                                     240
   SEQRES: GLY ALA LYS GLU ILE HIS SER LEU ILE GLU ASP SER PHE GLN LEU 
   COORDS: GLY ALA LYS GLU ILE HIS SER LEU ILE GLU ASP SER PHE GLN LEU 
           101                                                     115

           241                                 250
   SEQRES: THR ARG LEU GLU HIS HIS HIS HIS HIS HIS 
   COORDS: THR ARG LEU GLU HIS HIS HIS HIS HIS HIS 
           116                                 125


==> The following residues have missing atoms:                        

     RES MOD#C SEQ          ATOMS

     ASP(  1 A   8)         HD2 
     ASP(  1 A  15)         HD2 
     ASP(  1 A  19)         HD2 
     HIS(  1 A  20)         HE2 
     GLU(  1 A  23)         HE2 
     ASP(  1 A  27)         HD2 
     HIS(  1 A  33)         HE2 
     ASP(  1 A  35)         HD2 
     ASP(  1 A  37)         HD2 
     ASP(  1 A  45)         HD2 
     GLU(  1 A  49)         HE2 
     ASP(  1 A  56)         HD2 
     ASP(  1 A  60)         HD2 
     ASP(  1 A  63)         HD2 
     GLU(  1 A  69)         HE2 
     HIS(  1 A  85)         HE2 
     GLU(  1 A  89)         HE2 
     HIS(  1 A  90)         HE2 
     GLU(  1 A 104)         HE2 
     HIS(  1 A 106)         HE2 
     GLU(  1 A 110)         HE2 
     ASP(  1 A 111)         HD2 
     GLU(  1 A 119)         HE2 
     HIS(  1 A 120)         HE2 
     HIS(  1 A 121)         HE2 
     HIS(  1 A 122)         HE2 
     HIS(  1 A 123)         HE2 
     HIS(  1 A 124)         HE2 
     HIS(  1 A 125)         HE2 
     ASP(  2 A   8)         HD2 
     ASP(  2 A  15)         HD2 
     ASP(  2 A  19)         HD2 
     HIS(  2 A  20)         HE2 
     GLU(  2 A  23)         HE2 
     ASP(  2 A  27)         HD2 
     HIS(  2 A  33)         HE2 
     ASP(  2 A  35)         HD2 
     ASP(  2 A  37)         HD2 
     ASP(  2 A  45)         HD2 
     GLU(  2 A  49)         HE2 
     ASP(  2 A  56)         HD2 
     ASP(  2 A  60)         HD2 
     ASP(  2 A  63)         HD2 
     GLU(  2 A  69)         HE2 
     HIS(  2 A  85)         HE2 
     GLU(  2 A  89)         HE2 
     HIS(  2 A  90)         HE2 
     GLU(  2 A 104)         HE2 
     HIS(  2 A 106)         HE2 
     GLU(  2 A 110)         HE2 
     ASP(  2 A 111)         HD2 
     GLU(  2 A 119)         HE2 
     HIS(  2 A 120)         HE2 
     HIS(  2 A 121)         HE2 
     HIS(  2 A 122)         HE2 
     HIS(  2 A 123)         HE2 
     HIS(  2 A 124)         HE2 
     HIS(  2 A 125)         HE2 
     ASP(  3 A   8)         HD2 
     ASP(  3 A  15)         HD2 
     ASP(  3 A  19)         HD2 
     HIS(  3 A  20)         HE2 
     GLU(  3 A  23)         HE2 
     ASP(  3 A  27)         HD2 
     HIS(  3 A  33)         HE2 
     ASP(  3 A  35)         HD2 
     ASP(  3 A  37)         HD2 
     ASP(  3 A  45)         HD2 
     GLU(  3 A  49)         HE2 
     ASP(  3 A  56)         HD2 
     ASP(  3 A  60)         HD2 
     ASP(  3 A  63)         HD2 
     GLU(  3 A  69)         HE2 
     HIS(  3 A  85)         HE2 
     GLU(  3 A  89)         HE2 
     HIS(  3 A  90)         HE2 
     GLU(  3 A 104)         HE2 
     HIS(  3 A 106)         HE2 
     GLU(  3 A 110)         HE2 
     ASP(  3 A 111)         HD2 
     GLU(  3 A 119)         HE2 
     HIS(  3 A 120)         HE2 
     HIS(  3 A 121)         HE2 
     HIS(  3 A 122)         HE2 
     HIS(  3 A 123)         HE2 
     HIS(  3 A 124)         HE2 
     HIS(  3 A 125)         HE2 
     ASP(  4 A   8)         HD2 
     ASP(  4 A  15)         HD2 
     ASP(  4 A  19)         HD2 
     HIS(  4 A  20)         HE2 
     GLU(  4 A  23)         HE2 
     ASP(  4 A  27)         HD2 
     HIS(  4 A  33)         HE2 
     ASP(  4 A  35)         HD2 
     ASP(  4 A  37)         HD2 
     ASP(  4 A  45)         HD2 
     GLU(  4 A  49)         HE2 
     ASP(  4 A  56)         HD2 
     ASP(  4 A  60)         HD2 
     ASP(  4 A  63)         HD2 
     GLU(  4 A  69)         HE2 
     HIS(  4 A  85)         HE2 
     GLU(  4 A  89)         HE2 
     HIS(  4 A  90)         HE2 
     GLU(  4 A 104)         HE2 
     HIS(  4 A 106)         HE2 
     GLU(  4 A 110)         HE2 
     ASP(  4 A 111)         HD2 
     GLU(  4 A 119)         HE2 
     HIS(  4 A 120)         HE2 
     HIS(  4 A 121)         HE2 
     HIS(  4 A 122)         HE2 
     HIS(  4 A 123)         HE2 
     HIS(  4 A 124)         HE2 
     HIS(  4 A 125)         HE2 
     ASP(  5 A   8)         HD2 
     ASP(  5 A  15)         HD2 
     ASP(  5 A  19)         HD2 
     HIS(  5 A  20)         HE2 
     GLU(  5 A  23)         HE2 
     ASP(  5 A  27)         HD2 
     HIS(  5 A  33)         HE2 
     ASP(  5 A  35)         HD2 
     ASP(  5 A  37)         HD2 
     ASP(  5 A  45)         HD2 
     GLU(  5 A  49)         HE2 
     ASP(  5 A  56)         HD2 
     ASP(  5 A  60)         HD2 
     ASP(  5 A  63)         HD2 
     GLU(  5 A  69)         HE2 
     HIS(  5 A  85)         HE2 
     GLU(  5 A  89)         HE2 
     HIS(  5 A  90)         HE2 
     GLU(  5 A 104)         HE2 
     HIS(  5 A 106)         HE2 
     GLU(  5 A 110)         HE2 
     ASP(  5 A 111)         HD2 
     GLU(  5 A 119)         HE2 
     HIS(  5 A 120)         HE2 
     HIS(  5 A 121)         HE2 
     HIS(  5 A 122)         HE2 
     HIS(  5 A 123)         HE2 
     HIS(  5 A 124)         HE2 
     HIS(  5 A 125)         HE2 
     ASP(  6 A   8)         HD2 
     ASP(  6 A  15)         HD2 
     ASP(  6 A  19)         HD2 
     HIS(  6 A  20)         HE2 
     GLU(  6 A  23)         HE2 
     ASP(  6 A  27)         HD2 
     HIS(  6 A  33)         HE2 
     ASP(  6 A  35)         HD2 
     ASP(  6 A  37)         HD2 
     ASP(  6 A  45)         HD2 
     GLU(  6 A  49)         HE2 
     ASP(  6 A  56)         HD2 
     ASP(  6 A  60)         HD2 
     ASP(  6 A  63)         HD2 
     GLU(  6 A  69)         HE2 
     HIS(  6 A  85)         HE2 
     GLU(  6 A  89)         HE2 
     HIS(  6 A  90)         HE2 
     GLU(  6 A 104)         HE2 
     HIS(  6 A 106)         HE2 
     GLU(  6 A 110)         HE2 
     ASP(  6 A 111)         HD2 
     GLU(  6 A 119)         HE2 
     HIS(  6 A 120)         HE2 
     HIS(  6 A 121)         HE2 
     HIS(  6 A 122)         HE2 
     HIS(  6 A 123)         HE2 
     HIS(  6 A 124)         HE2 
     HIS(  6 A 125)         HE2 
     ASP(  7 A   8)         HD2 
     ASP(  7 A  15)         HD2 
     ASP(  7 A  19)         HD2 
     HIS(  7 A  20)         HE2 
     GLU(  7 A  23)         HE2 
     ASP(  7 A  27)         HD2 
     HIS(  7 A  33)         HE2 
     ASP(  7 A  35)         HD2 
     ASP(  7 A  37)         HD2 
     ASP(  7 A  45)         HD2 
     GLU(  7 A  49)         HE2 
     ASP(  7 A  56)         HD2 
     ASP(  7 A  60)         HD2 
     ASP(  7 A  63)         HD2 
     GLU(  7 A  69)         HE2 
     HIS(  7 A  85)         HE2 
     GLU(  7 A  89)         HE2 
     HIS(  7 A  90)         HE2 
     GLU(  7 A 104)         HE2 
     HIS(  7 A 106)         HE2 
     GLU(  7 A 110)         HE2 
     ASP(  7 A 111)         HD2 
     GLU(  7 A 119)         HE2 
     HIS(  7 A 120)         HE2 
     HIS(  7 A 121)         HE2 
     HIS(  7 A 122)         HE2 
     HIS(  7 A 123)         HE2 
     HIS(  7 A 124)         HE2 
     HIS(  7 A 125)         HE2 
     ASP(  8 A   8)         HD2 
     ASP(  8 A  15)         HD2 
     ASP(  8 A  19)         HD2 
     HIS(  8 A  20)         HE2 
     GLU(  8 A  23)         HE2 
     ASP(  8 A  27)         HD2 
     HIS(  8 A  33)         HE2 
     ASP(  8 A  35)         HD2 
     ASP(  8 A  37)         HD2 
     ASP(  8 A  45)         HD2 
     GLU(  8 A  49)         HE2 
     ASP(  8 A  56)         HD2 
     ASP(  8 A  60)         HD2 
     ASP(  8 A  63)         HD2 
     GLU(  8 A  69)         HE2 
     HIS(  8 A  85)         HE2 
     GLU(  8 A  89)         HE2 
     HIS(  8 A  90)         HE2 
     GLU(  8 A 104)         HE2 
     HIS(  8 A 106)         HE2 
     GLU(  8 A 110)         HE2 
     ASP(  8 A 111)         HD2 
     GLU(  8 A 119)         HE2 
     HIS(  8 A 120)         HE2 
     HIS(  8 A 121)         HE2 
     HIS(  8 A 122)         HE2 
     HIS(  8 A 123)         HE2 
     HIS(  8 A 124)         HE2 
     HIS(  8 A 125)         HE2 
     ASP(  9 A   8)         HD2 
     ASP(  9 A  15)         HD2 
     ASP(  9 A  19)         HD2 
     HIS(  9 A  20)         HE2 
     GLU(  9 A  23)         HE2 
     ASP(  9 A  27)         HD2 
     HIS(  9 A  33)         HE2 
     ASP(  9 A  35)         HD2 
     ASP(  9 A  37)         HD2 
     ASP(  9 A  45)         HD2 
     GLU(  9 A  49)         HE2 
     ASP(  9 A  56)         HD2 
     ASP(  9 A  60)         HD2 
     ASP(  9 A  63)         HD2 
     GLU(  9 A  69)         HE2 
     HIS(  9 A  85)         HE2 
     GLU(  9 A  89)         HE2 
     HIS(  9 A  90)         HE2 
     GLU(  9 A 104)         HE2 
     HIS(  9 A 106)         HE2 
     GLU(  9 A 110)         HE2 
     ASP(  9 A 111)         HD2 
     GLU(  9 A 119)         HE2 
     HIS(  9 A 120)         HE2 
     HIS(  9 A 121)         HE2 
     HIS(  9 A 122)         HE2 
     HIS(  9 A 123)         HE2 
     HIS(  9 A 124)         HE2 
     HIS(  9 A 125)         HE2 
     ASP( 10 A   8)         HD2 
     ASP( 10 A  15)         HD2 
     ASP( 10 A  19)         HD2 
     HIS( 10 A  20)         HE2 
     GLU( 10 A  23)         HE2 
     ASP( 10 A  27)         HD2 
     HIS( 10 A  33)         HE2 
     ASP( 10 A  35)         HD2 
     ASP( 10 A  37)         HD2 
     ASP( 10 A  45)         HD2 
     GLU( 10 A  49)         HE2 
     ASP( 10 A  56)         HD2 
     ASP( 10 A  60)         HD2 
     ASP( 10 A  63)         HD2 
     GLU( 10 A  69)         HE2 
     HIS( 10 A  85)         HE2 
     GLU( 10 A  89)         HE2 
     HIS( 10 A  90)         HE2 
     GLU( 10 A 104)         HE2 
     HIS( 10 A 106)         HE2 
     GLU( 10 A 110)         HE2 
     ASP( 10 A 111)         HD2 
     GLU( 10 A 119)         HE2 
     HIS( 10 A 120)         HE2 
     HIS( 10 A 121)         HE2 
     HIS( 10 A 122)         HE2 
     HIS( 10 A 123)         HE2 
     HIS( 10 A 124)         HE2 
     HIS( 10 A 125)         HE2 
     ASP( 11 A   8)         HD2 
     ASP( 11 A  15)         HD2 
     ASP( 11 A  19)         HD2 
     HIS( 11 A  20)         HE2 
     GLU( 11 A  23)         HE2 
     ASP( 11 A  27)         HD2 
     HIS( 11 A  33)         HE2 
     ASP( 11 A  35)         HD2 
     ASP( 11 A  37)         HD2 
     ASP( 11 A  45)         HD2 
     GLU( 11 A  49)         HE2 
     ASP( 11 A  56)         HD2 
     ASP( 11 A  60)         HD2 
     ASP( 11 A  63)         HD2 
     GLU( 11 A  69)         HE2 
     HIS( 11 A  85)         HE2 
     GLU( 11 A  89)         HE2 
     HIS( 11 A  90)         HE2 
     GLU( 11 A 104)         HE2 
     HIS( 11 A 106)         HE2 
     GLU( 11 A 110)         HE2 
     ASP( 11 A 111)         HD2 
     GLU( 11 A 119)         HE2 
     HIS( 11 A 120)         HE2 
     HIS( 11 A 121)         HE2 
     HIS( 11 A 122)         HE2 
     HIS( 11 A 123)         HE2 
     HIS( 11 A 124)         HE2 
     HIS( 11 A 125)         HE2 
     ASP( 12 A   8)         HD2 
     ASP( 12 A  15)         HD2 
     ASP( 12 A  19)         HD2 
     HIS( 12 A  20)         HE2 
     GLU( 12 A  23)         HE2 
     ASP( 12 A  27)         HD2 
     HIS( 12 A  33)         HE2 
     ASP( 12 A  35)         HD2 
     ASP( 12 A  37)         HD2 
     ASP( 12 A  45)         HD2 
     GLU( 12 A  49)         HE2 
     ASP( 12 A  56)         HD2 
     ASP( 12 A  60)         HD2 
     ASP( 12 A  63)         HD2 
     GLU( 12 A  69)         HE2 
     HIS( 12 A  85)         HE2 
     GLU( 12 A  89)         HE2 
     HIS( 12 A  90)         HE2 
     GLU( 12 A 104)         HE2 
     HIS( 12 A 106)         HE2 
     GLU( 12 A 110)         HE2 
     ASP( 12 A 111)         HD2 
     GLU( 12 A 119)         HE2 
     HIS( 12 A 120)         HE2 
     HIS( 12 A 121)         HE2 
     HIS( 12 A 122)         HE2 
     HIS( 12 A 123)         HE2 
     HIS( 12 A 124)         HE2 
     HIS( 12 A 125)         HE2 
     ASP( 13 A   8)         HD2 
     ASP( 13 A  15)         HD2 
     ASP( 13 A  19)         HD2 
     HIS( 13 A  20)         HE2 
     GLU( 13 A  23)         HE2 
     ASP( 13 A  27)         HD2 
     HIS( 13 A  33)         HE2 
     ASP( 13 A  35)         HD2 
     ASP( 13 A  37)         HD2 
     ASP( 13 A  45)         HD2 
     GLU( 13 A  49)         HE2 
     ASP( 13 A  56)         HD2 
     ASP( 13 A  60)         HD2 
     ASP( 13 A  63)         HD2 
     GLU( 13 A  69)         HE2 
     HIS( 13 A  85)         HE2 
     GLU( 13 A  89)         HE2 
     HIS( 13 A  90)         HE2 
     GLU( 13 A 104)         HE2 
     HIS( 13 A 106)         HE2 
     GLU( 13 A 110)         HE2 
     ASP( 13 A 111)         HD2 
     GLU( 13 A 119)         HE2 
     HIS( 13 A 120)         HE2 
     HIS( 13 A 121)         HE2 
     HIS( 13 A 122)         HE2 
     HIS( 13 A 123)         HE2 
     HIS( 13 A 124)         HE2 
     HIS( 13 A 125)         HE2 
     ASP( 14 A   8)         HD2 
     ASP( 14 A  15)         HD2 
     ASP( 14 A  19)         HD2 
     HIS( 14 A  20)         HE2 
     GLU( 14 A  23)         HE2 
     ASP( 14 A  27)         HD2 
     HIS( 14 A  33)         HE2 
     ASP( 14 A  35)         HD2 
     ASP( 14 A  37)         HD2 
     ASP( 14 A  45)         HD2 
     GLU( 14 A  49)         HE2 
     ASP( 14 A  56)         HD2 
     ASP( 14 A  60)         HD2 
     ASP( 14 A  63)         HD2 
     GLU( 14 A  69)         HE2 
     HIS( 14 A  85)         HE2 
     GLU( 14 A  89)         HE2 
     HIS( 14 A  90)         HE2 
     GLU( 14 A 104)         HE2 
     HIS( 14 A 106)         HE2 
     GLU( 14 A 110)         HE2 
     ASP( 14 A 111)         HD2 
     GLU( 14 A 119)         HE2 
     HIS( 14 A 120)         HE2 
     HIS( 14 A 121)         HE2 
     HIS( 14 A 122)         HE2 
     HIS( 14 A 123)         HE2 
     HIS( 14 A 124)         HE2 
     HIS( 14 A 125)         HE2 
     ASP( 15 A   8)         HD2 
     ASP( 15 A  15)         HD2 
     ASP( 15 A  19)         HD2 
     HIS( 15 A  20)         HE2 
     GLU( 15 A  23)         HE2 
     ASP( 15 A  27)         HD2 
     HIS( 15 A  33)         HE2 
     ASP( 15 A  35)         HD2 
     ASP( 15 A  37)         HD2 
     ASP( 15 A  45)         HD2 
     GLU( 15 A  49)         HE2 
     ASP( 15 A  56)         HD2 
     ASP( 15 A  60)         HD2 
     ASP( 15 A  63)         HD2 
     GLU( 15 A  69)         HE2 
     HIS( 15 A  85)         HE2 
     GLU( 15 A  89)         HE2 
     HIS( 15 A  90)         HE2 
     GLU( 15 A 104)         HE2 
     HIS( 15 A 106)         HE2 
     GLU( 15 A 110)         HE2 
     ASP( 15 A 111)         HD2 
     GLU( 15 A 119)         HE2 
     HIS( 15 A 120)         HE2 
     HIS( 15 A 121)         HE2 
     HIS( 15 A 122)         HE2 
     HIS( 15 A 123)         HE2 
     HIS( 15 A 124)         HE2 
     HIS( 15 A 125)         HE2 
     ASP( 16 A   8)         HD2 
     ASP( 16 A  15)         HD2 
     ASP( 16 A  19)         HD2 
     HIS( 16 A  20)         HE2 
     GLU( 16 A  23)         HE2 
     ASP( 16 A  27)         HD2 
     HIS( 16 A  33)         HE2 
     ASP( 16 A  35)         HD2 
     ASP( 16 A  37)         HD2 
     ASP( 16 A  45)         HD2 
     GLU( 16 A  49)         HE2 
     ASP( 16 A  56)         HD2 
     ASP( 16 A  60)         HD2 
     ASP( 16 A  63)         HD2 
     GLU( 16 A  69)         HE2 
     HIS( 16 A  85)         HE2 
     GLU( 16 A  89)         HE2 
     HIS( 16 A  90)         HE2 
     GLU( 16 A 104)         HE2 
     HIS( 16 A 106)         HE2 
     GLU( 16 A 110)         HE2 
     ASP( 16 A 111)         HD2 
     GLU( 16 A 119)         HE2 
     HIS( 16 A 120)         HE2 
     HIS( 16 A 121)         HE2 
     HIS( 16 A 122)         HE2 
     HIS( 16 A 123)         HE2 
     HIS( 16 A 124)         HE2 
     HIS( 16 A 125)         HE2 
     ASP( 17 A   8)         HD2 
     ASP( 17 A  15)         HD2 
     ASP( 17 A  19)         HD2 
     HIS( 17 A  20)         HE2 
     GLU( 17 A  23)         HE2 
     ASP( 17 A  27)         HD2 
     HIS( 17 A  33)         HE2 
     ASP( 17 A  35)         HD2 
     ASP( 17 A  37)         HD2 
     ASP( 17 A  45)         HD2 
     GLU( 17 A  49)         HE2 
     ASP( 17 A  56)         HD2 
     ASP( 17 A  60)         HD2 
     ASP( 17 A  63)         HD2 
     GLU( 17 A  69)         HE2 
     HIS( 17 A  85)         HE2 
     GLU( 17 A  89)         HE2 
     HIS( 17 A  90)         HE2 
     GLU( 17 A 104)         HE2 
     HIS( 17 A 106)         HE2 
     GLU( 17 A 110)         HE2 
     ASP( 17 A 111)         HD2 
     GLU( 17 A 119)         HE2 
     HIS( 17 A 120)         HE2 
     HIS( 17 A 121)         HE2 
     HIS( 17 A 122)         HE2 
     HIS( 17 A 123)         HE2 
     HIS( 17 A 124)         HE2 
     HIS( 17 A 125)         HE2 
     ASP( 18 A   8)         HD2 
     ASP( 18 A  15)         HD2 
     ASP( 18 A  19)         HD2 
     HIS( 18 A  20)         HE2 
     GLU( 18 A  23)         HE2 
     ASP( 18 A  27)         HD2 
     HIS( 18 A  33)         HE2 
     ASP( 18 A  35)         HD2 
     ASP( 18 A  37)         HD2 
     ASP( 18 A  45)         HD2 
     GLU( 18 A  49)         HE2 
     ASP( 18 A  56)         HD2 
     ASP( 18 A  60)         HD2 
     ASP( 18 A  63)         HD2 
     GLU( 18 A  69)         HE2 
     HIS( 18 A  85)         HE2 
     GLU( 18 A  89)         HE2 
     HIS( 18 A  90)         HE2 
     GLU( 18 A 104)         HE2 
     HIS( 18 A 106)         HE2 
     GLU( 18 A 110)         HE2 
     ASP( 18 A 111)         HD2 
     GLU( 18 A 119)         HE2 
     HIS( 18 A 120)         HE2 
     HIS( 18 A 121)         HE2 
     HIS( 18 A 122)         HE2 
     HIS( 18 A 123)         HE2 
     HIS( 18 A 124)         HE2 
     HIS( 18 A 125)         HE2 
     ASP( 19 A   8)         HD2 
     ASP( 19 A  15)         HD2 
     ASP( 19 A  19)         HD2 
     HIS( 19 A  20)         HE2 
     GLU( 19 A  23)         HE2 
     ASP( 19 A  27)         HD2 
     HIS( 19 A  33)         HE2 
     ASP( 19 A  35)         HD2 
     ASP( 19 A  37)         HD2 
     ASP( 19 A  45)         HD2 
     GLU( 19 A  49)         HE2 
     ASP( 19 A  56)         HD2 
     ASP( 19 A  60)         HD2 
     ASP( 19 A  63)         HD2 
     GLU( 19 A  69)         HE2 
     HIS( 19 A  85)         HE2 
     GLU( 19 A  89)         HE2 
     HIS( 19 A  90)         HE2 
     GLU( 19 A 104)         HE2 
     HIS( 19 A 106)         HE2 
     GLU( 19 A 110)         HE2 
     ASP( 19 A 111)         HD2 
     GLU( 19 A 119)         HE2 
     HIS( 19 A 120)         HE2 
     HIS( 19 A 121)         HE2 
     HIS( 19 A 122)         HE2 
     HIS( 19 A 123)         HE2 
     HIS( 19 A 124)         HE2 
     HIS( 19 A 125)         HE2 
     ASP( 20 A   8)         HD2 
     ASP( 20 A  15)         HD2 
     ASP( 20 A  19)         HD2 
     HIS( 20 A  20)         HE2 
     GLU( 20 A  23)         HE2 
     ASP( 20 A  27)         HD2 
     HIS( 20 A  33)         HE2 
     ASP( 20 A  35)         HD2 
     ASP( 20 A  37)         HD2 
     ASP( 20 A  45)         HD2 
     GLU( 20 A  49)         HE2 
     ASP( 20 A  56)         HD2 
     ASP( 20 A  60)         HD2 
     ASP( 20 A  63)         HD2 
     GLU( 20 A  69)         HE2 
     HIS( 20 A  85)         HE2 
     GLU( 20 A  89)         HE2 
     HIS( 20 A  90)         HE2 
     GLU( 20 A 104)         HE2 
     HIS( 20 A 106)         HE2 
     GLU( 20 A 110)         HE2 
     ASP( 20 A 111)         HD2 
     GLU( 20 A 119)         HE2 
     HIS( 20 A 120)         HE2 
     HIS( 20 A 121)         HE2 
     HIS( 20 A 122)         HE2 
     HIS( 20 A 123)         HE2 
     HIS( 20 A 124)         HE2 
     HIS( 20 A 125)         HE2 
==> The following residues have extra atoms:                         
    
     RES MOD#C SEQ          ATOMS
    
     HIS(  1 A 125)          O2 
     HIS(  2 A 125)          O2 
     HIS(  3 A 125)          O2 
     HIS(  4 A 125)          O2 
     HIS(  5 A 125)          O2 
     HIS(  6 A 125)          O2 
     HIS(  7 A 125)          O2 
     HIS(  8 A 125)          O2 
     HIS(  9 A 125)          O2 
     HIS( 10 A 125)          O2 
     HIS( 11 A 125)          O2 
     HIS( 12 A 125)          O2 
     HIS( 13 A 125)          O2 
     HIS( 14 A 125)          O2 
     HIS( 15 A 125)          O2 
     HIS( 16 A 125)          O2 
     HIS( 17 A 125)          O2 
     HIS( 18 A 125)          O2 
     HIS( 19 A 125)          O2 
     HIS( 20 A 125)          O2 



    CHECK TERMINAL ATOMS
    --------------------

Terminal atom(s) showed in middle of sequence will be deleted:

1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A
1H MET 1 A
2H MET 1 A
3H MET 1 A