
#######################################################
#                                                     #
#                        LGA                          #
#                  ---------------                    #
#                                                     #
#               Local-Global Alignment                #
#        A Method for Finding 3-D Similarities        #
#               in Protein Structures                 #
#                                                     #
#                  ------------ 10/2009               #
#                                                     #
#      Adam Zemla (adamz@llnl.gov)                    #
#      Lawrence Livermore National Laboratory, CA     #
#                                                     #
#######################################################

!!!   License for LGA program has expired  !!!
#   For updated version of the LGA program   #
# please contact Adam Zemla:  adamz@llnl.gov #

# Molecule1: number of CA atoms  176 ( 1334),  selected  176 , name one
# Molecule2: number of CA atoms  176 ( 1334),  selected  176 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:A  -ch2:A  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   148      19_A - 166_A       4.88    21.08
  LONGEST_CONTINUOUS_SEGMENT:   148      20_A - 167_A       4.90    21.02
  LONGEST_CONTINUOUS_SEGMENT:   148      21_A - 168_A       4.98    20.98
  LCS_AVERAGE:     74.79

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   119      42_A - 160_A       1.98    21.31
  LCS_AVERAGE:     53.82

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    65      64_A - 128_A       1.00    21.27
  LONGEST_CONTINUOUS_SEGMENT:    65      65_A - 129_A       1.00    21.23
  LCS_AVERAGE:     20.05

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  176
LCS_GDT     RESIDUE       RESIDUE       SEGMENT_SIZE    GLOBAL DISTANCE TEST COLUMNS: number of residues under the threshold assigned to each residue pair
LCS_GDT   NAME NUMBER   NAME NUMBER    1.0  2.0  5.0    0.5  1.0  1.5  2.0  2.5  3.0  3.5  4.0  4.5  5.0  5.5  6.0  6.5  7.0  7.5  8.0  8.5  9.0  9.5 10.0
LCS_GDT     M     1_A     M     1_A      4    4    6      2    4    4    4    4    4    5    5    5    5    5    5    6    6    7    7   12   13   15   43 
LCS_GDT     E     2_A     E     2_A      4    4   16      3    4    4    4    4    4    5    5    5    5    5    8    9   15   25   25   38   43   48   54 
LCS_GDT     Q     3_A     Q     3_A      4    4   23      3    4    4    4    4    4    5    5    6    6    6    8    9   23   25   25   31   43   48   54 
LCS_GDT     S     4_A     S     4_A      4    6   23      3    4    4    4    6    7    8   10   10   13   18   20   31   36   37   37   42   43   48   54 
LCS_GDT     S     5_A     S     5_A      4    9   24      3    4    7    7    9   11   14   16   17   20   23   24   31   36   37   37   42   43   48   54 
LCS_GDT     G     6_A     G     6_A      5    9   24      3    5    7    7    9   11   14   16   19   23   27   28   31   36   37   37   42   43   48   54 
LCS_GDT     D     7_A     D     7_A      5    9   24      3    5    7    7    9   12   14   16   19   23   27   28   31   36   37   37   42   43   48   54 
LCS_GDT     K     8_A     K     8_A      5    9   24      1    5    7    7    9   12   14   16   19   23   27   28   31   36   37   37   42   43   48   54 
LCS_GDT     D     9_A     D     9_A      5    9   24      3    5    7    7    9   12   14   16   19   23   27   28   31   36   37   37   42   43   48   54 
LCS_GDT     G    10_A     G    10_A      5    9   24      3    4    7    7    9   12   14   16   19   23   27   28   31   36   37   37   42   43   48   54 
LCS_GDT     G    11_A     G    11_A      3    9   24      3    3    5    6    8   12   14   16   19   23   27   28   31   36   37   37   42   43   48   54 
LCS_GDT     S    12_A     S    12_A      3    9   24      3    4    7    7    9   12   14   16   19   23   27   28   31   36   37   37   42   43   48   54 
LCS_GDT     D    13_A     D    13_A      4    9   24      3    4    4    6    8   11   14   16   19   23   27   28   31   36   37   37   42   43   48   54 
LCS_GDT     S    14_A     S    14_A      4    5   24      3    4    4    6    8   12   14   17   19   22   27   28   31   36   37   37   42   43   48   54 
LCS_GDT     G    15_A     G    15_A      5    7   24      3    4    6    6    7   10   13   17   18   22   23   25   31   36   37   37   42   43   46   54 
LCS_GDT     G    16_A     G    16_A      5    7   24      3    4    6    6    8   11   14   17   18   20   23   25   28   36   37   37   42   43   46   49 
LCS_GDT     A    17_A     A    17_A      5    7  146      3    4    6    6    8   10   13   17   18   22   23   25   28   36   37   37   42   43   46   49 
LCS_GDT     Q    18_A     Q    18_A      5    7  147      3    4    6    6    7   10   13   17   19   23   27   28   31   36   37   37   42   47   52   54 
LCS_GDT     D    19_A     D    19_A      5    7  148      3    4    6    6    7   10   14   17   18   22   26   28   31   36   37   37   42   47   52   54 
LCS_GDT     G    20_A     G    20_A      3    7  148      0    3    6    6    7   10   13   17   18   20   21   23   31   36   37   37   42   47   61   87 
LCS_GDT     G    21_A     G    21_A      3    7  148      3    3    4    5    7   10   13   17   19   23   29   80  106  120  128  133  139  139  141  142 
LCS_GDT     S    22_A     S    22_A      3    6  148      3    3    9   17   28   48   81  101  115  125  136  137  138  139  140  140  141  141  141  142 
LCS_GDT     L    23_A     L    23_A     12  109  148      4   11   21   35   99  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     D    24_A     D    24_A     12  109  148      4   22   59   94  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     S    25_A     S    25_A     12  109  148      4   17   37   84  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     L    26_A     L    26_A     12  109  148      6   22   64   96  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     K    27_A     K    27_A     12  109  148      6   22   64   96  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     K    28_A     K    28_A     12  109  148      6   17   53   84  110  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     Y    29_A     Y    29_A     12  109  148      6   17   60   87  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     N    30_A     N    30_A     12  109  148      6   36   61   91  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     G    31_A     G    31_A     12  109  148      4   36   61   92  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     K    32_A     K    32_A     12  109  148      5   31   61   87  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     L    33_A     L    33_A     12  109  148      4   41   81   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     P    34_A     P    34_A     12  109  148      4    5   18   60   95  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     K    35_A     K    35_A     10  109  148      4   10   26   53   79  102  126  132  136  136  137  137  138  138  140  140  141  141  141  142 
LCS_GDT     H    36_A     H    36_A     10  109  148      6   12   32   60   79  118  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     D    37_A     D    37_A     10  109  148      6   13   29   60   90  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     P    38_A     P    38_A     10  109  148      6   13   24   60   89  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     S    39_A     S    39_A     10  109  148      6   13   22   60   98  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     F    40_A     F    40_A     10  109  148      6   12   24   60  103  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     V    41_A     V    41_A     10  109  148      6    7   19   60   89  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     Q    42_A     Q    42_A     10  119  148      5   33   63   94  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     P    43_A     P    43_A     10  119  148      3   15   56   86  105  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     G    44_A     G    44_A      4  119  148      3    4   26   45   88  117  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     N    45_A     N    45_A      5  119  148      3   23   37   79   98  117  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     R    46_A     R    46_A      5  119  148      3   20   72   94  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     H    47_A     H    47_A      5  119  148      3    6   56   92  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     Y    48_A     Y    48_A     12  119  148      3   21   69   92  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     K    49_A     K    49_A     13  119  148      3   16   52   92  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     Y    50_A     Y    50_A     13  119  148      4    9   52   91  103  112  126  131  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     Q    51_A     Q    51_A     55  119  148      7   48   84   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     C    52_A     C    52_A     63  119  148     28   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     T    53_A     T    53_A     63  119  148     28   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     W    54_A     W    54_A     63  119  148     28   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     Y    55_A     Y    55_A     63  119  148     28   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     A    56_A     A    56_A     63  119  148     28   66   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     Y    57_A     Y    57_A     63  119  148     28   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     N    58_A     N    58_A     63  119  148     28   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     R    59_A     R    59_A     63  119  148     17   66   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     R    60_A     R    60_A     63  119  148      8   56   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     G    61_A     G    61_A     63  119  148     21   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     Q    62_A     Q    62_A     63  119  148      8   19   62   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     L    63_A     L    63_A     63  119  148      8   19   30   95  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     G    64_A     G    64_A     65  119  148      8   55   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     I    65_A     I    65_A     65  119  148      8   51   86   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     P    66_A     P    66_A     65  119  148      5   43   71   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     V    67_A     V    67_A     65  119  148      5   43   82   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     P    68_A     P    68_A     65  119  148      5   44   86   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     L    69_A     L    69_A     65  119  148     10   65   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     W    70_A     W    70_A     65  119  148     21   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     G    71_A     G    71_A     65  119  148     10   56   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     D    72_A     D    72_A     65  119  148     21   66   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     A    73_A     A    73_A     65  119  148     21   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     A    74_A     A    74_A     65  119  148     28   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     D    75_A     D    75_A     65  119  148     28   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     W    76_A     W    76_A     65  119  148     28   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     I    77_A     I    77_A     65  119  148     28   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     G    78_A     G    78_A     65  119  148     28   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     G    79_A     G    79_A     65  119  148     28   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     A    80_A     A    80_A     65  119  148     28   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     K    81_A     K    81_A     65  119  148     19   66   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     G    82_A     G    82_A     65  119  148     25   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     A    83_A     A    83_A     65  119  148     28   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     G    84_A     G    84_A     65  119  148     28   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     Y    85_A     Y    85_A     65  119  148     28   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     G    86_A     G    86_A     65  119  148     19   65   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     V    87_A     V    87_A     65  119  148     28   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     G    88_A     G    88_A     65  119  148     28   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     R    89_A     R    89_A     65  119  148     28   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     T    90_A     T    90_A     65  119  148     28   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     P    91_A     P    91_A     65  119  148     26   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     K    92_A     K    92_A     65  119  148     25   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     Q    93_A     Q    93_A     65  119  148     23   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     G    94_A     G    94_A     65  119  148     24   55   88   97  106  120  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     A    95_A     A    95_A     65  119  148     22   62   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     C    96_A     C    96_A     65  119  148     26   61   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     V    97_A     V    97_A     65  119  148     28   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     I    98_A     I    98_A     65  119  148     17   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     W    99_A     W    99_A     65  119  148     22   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     Q   100_A     Q   100_A     65  119  148     26   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     R   101_A     R   101_A     65  119  148     26   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     G   102_A     G   102_A     65  119  148     28   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     V   103_A     V   103_A     65  119  148     28   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     Q   104_A     Q   104_A     65  119  148     25   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     G   105_A     G   105_A     65  119  148     23   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     G   106_A     G   106_A     65  119  148     24   66   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     S   107_A     S   107_A     65  119  148     12   55   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     P   108_A     P   108_A     65  119  148      7   55   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     Q   109_A     Q   109_A     65  119  148     14   61   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     Y   110_A     Y   110_A     65  119  148     25   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     G   111_A     G   111_A     65  119  148     26   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     H   112_A     H   112_A     65  119  148     26   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     V   113_A     V   113_A     65  119  148     26   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     A   114_A     A   114_A     65  119  148     26   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     F   115_A     F   115_A     65  119  148     26   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     V   116_A     V   116_A     65  119  148     26   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     E   117_A     E   117_A     65  119  148     26   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     K   118_A     K   118_A     65  119  148     26   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     V   119_A     V   119_A     65  119  148     26   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     L   120_A     L   120_A     65  119  148     24   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     D   121_A     D   121_A     65  119  148     26   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     G   122_A     G   122_A     65  119  148     15   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     G   123_A     G   123_A     65  119  148     26   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     K   124_A     K   124_A     65  119  148     26   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     K   125_A     K   125_A     65  119  148     24   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     I   126_A     I   126_A     65  119  148     26   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     F   127_A     F   127_A     65  119  148     25   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     I   128_A     I   128_A     65  119  148     26   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     S   129_A     S   129_A     65  119  148     26   58   88   97  110  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     E   130_A     E   130_A     64  119  148      5   36   70   95  110  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     H   131_A     H   131_A     60  119  148      5   10   28   46   80   98  125  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     N   132_A     N   132_A      8  119  148      6   13   22   41   67  105  125  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     Y   133_A     Y   133_A      8  119  148      4    8   19   34   81  111  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     A   134_A     A   134_A      8  119  148      4    8   32   91  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     T   135_A     T   135_A      8  119  148      9   55   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     P   136_A     P   136_A      8  119  148      4   12   41   64   93  112  125  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     N   137_A     N   137_A      9  119  148      5    7   10   14   23   40   60   72   93  116  124  137  138  139  140  140  141  141  141  142 
LCS_GDT     G   138_A     G   138_A     19  119  148      5   10   24   44   62   76   98  119  125  135  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     Y   139_A     Y   139_A     21  119  148      8   31   60   82   95  107  120  132  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     G   140_A     G   140_A     21  119  148      8   43   64   91  103  113  124  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     T   141_A     T   141_A     21  119  148     20   55   88   97  107  119  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     R   142_A     R   142_A     21  119  148     26   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     T   143_A     T   143_A     21  119  148     25   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     I   144_A     I   144_A     21  119  148     25   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     D   145_A     D   145_A     21  119  148     22   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     M   146_A     M   146_A     21  119  148     25   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     S   147_A     S   147_A     21  119  148     25   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     S   148_A     S   148_A     21  119  148     24   64   88   97  111  120  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     A   149_A     A   149_A     21  119  148     25   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     I   150_A     I   150_A     21  119  148     28   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     G   151_A     G   151_A     21  119  148     28   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     K   152_A     K   152_A     21  119  148     22   65   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     N   153_A     N   153_A     21  119  148     21   66   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     A   154_A     A   154_A     21  119  148     20   66   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     Q   155_A     Q   155_A     21  119  148     26   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     F   156_A     F   156_A     21  119  148     28   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     I   157_A     I   157_A     21  119  148     28   67   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     Y   158_A     Y   158_A     21  119  148     19   65   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     D   159_A     D   159_A     21  119  148      3   58   88   97  111  121  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     K   160_A     K   160_A     21  119  148      3   31   85   97  106  117  127  133  136  136  137  137  138  139  140  140  141  141  141  142 
LCS_GDT     K   161_A     K   161_A      4  114  148      3   17   36   58   63   75   95  102  111  123  130  136  137  139  140  140  141  141  141  142 
LCS_GDT     K   162_A     K   162_A      3   78  148      3    6   16   37   54   62   76   85   95  102  114  122  129  132  138  140  141  141  141  142 
LCS_GDT     N   163_A     N   163_A      3    6  148      3    4    5    6   16   32   52   62   67   76   88   97  103  112  123  130  132  136  141  142 
LCS_GDT     S   164_A     S   164_A      3    6  148      3    4    4    6    8   11   13   14   15   17   27   28   31   80   82   99  102  108  114  125 
LCS_GDT     S   165_A     S   165_A      3    6  148      3    4    4    5    7    8   13   14   19   23   36   71   74   80   90   99  102  108  119  128 
LCS_GDT     S   166_A     S   166_A      3    5  148      3    4    4    5    6    8   12   14   19   34   55   64   74   80   82   99  102  108  121  126 
LCS_GDT     V   167_A     V   167_A      3    5  148      3    3    4    5    7    8   12   14   22   28   36   42   53   60   68   72   84   92  102  116 
LCS_GDT     D   168_A     D   168_A      6    7  148      4    5    6    7    7    8   12   14   20   27   33   40   48   57   68   72   80   91  101  115 
LCS_GDT     K   169_A     K   169_A      6    7  132      4    5    6    7    7   12   17   22   27   35   39   50   60   66   72   79   90  100  110  125 
LCS_GDT     L   170_A     L   170_A      6    7   85      4    5    6    7    7    9   10   13   15   18   21   25   28   28   30   36   39   44   58   72 
LCS_GDT     A   171_A     A   171_A      6    7   17      4    5    6    7    7   10   10   12   15   17   20   25   28   28   31   35   37   38   43   46 
LCS_GDT     A   172_A     A   172_A      6    7   17      4    5    6    7    7    8   10   11   13   19   23   25   31   36   37   37   42   50   54   65 
LCS_GDT     A   173_A     A   173_A      6    7   17      4    5    6    7    7    8   10   13   16   18   21   25   29   32   41   46   57   61   68   76 
LCS_GDT     L   174_A     L   174_A      5    7   17      3    4    5    7    7   10   10   13   15   17   20   25   28   28   31   35   37   38   40   44 
LCS_GDT     E   175_A     E   175_A      4    5   17      3    4    4    5    7   10   10   13   16   18   21   25   28   32   34   37   40   45   53   56 
LCS_GDT     H   176_A     H   176_A      4    5   17      0    4    4    4    5    7    9   11   11   12   16   19   20   22   31   36   50   61   68   72 
LCS_AVERAGE  LCS_A:  49.55  (  20.05   53.82   74.79 )

GLOBAL_DISTANCE_TEST (summary information about detected largest sets of residues (represented by selected AToms) that can fit under specified thresholds)
GDT DIST_CUTOFF  0.50   1.00   1.50   2.00   2.50   3.00   3.50   4.00   4.50   5.00   5.50   6.00   6.50   7.00   7.50   8.00   8.50   9.00   9.50  10.00
GDT NUMBER_AT     28     67     88     97    111    121    127    133    136    136    137    137    138    139    140    140    141    141    141    142 
GDT PERCENT_AT  15.91  38.07  50.00  55.11  63.07  68.75  72.16  75.57  77.27  77.27  77.84  77.84  78.41  78.98  79.55  79.55  80.11  80.11  80.11  80.68
GDT RMS_LOCAL    0.33   0.66   0.85   1.00   1.44   1.73   1.81   1.99   2.08   2.08   2.15   2.15   2.26   2.44   2.47   2.47   2.63   2.63   2.63   2.90
GDT RMS_ALL_AT  21.49  21.12  21.11  21.22  21.55  21.74  21.69  21.66  21.68  21.68  21.64  21.64  21.63  21.52  21.55  21.55  21.52  21.52  21.52  21.45

# Checking swapping
#   possible swapping detected:  E     2_A      E     2_A
#   possible swapping detected:  D     7_A      D     7_A
#   possible swapping detected:  D    13_A      D    13_A
#   possible swapping detected:  D    19_A      D    19_A
#   possible swapping detected:  Y    48_A      Y    48_A
#   possible swapping detected:  Y    55_A      Y    55_A
#   possible swapping detected:  Y    57_A      Y    57_A
#   possible swapping detected:  D    72_A      D    72_A
#   possible swapping detected:  Y    85_A      Y    85_A
#   possible swapping detected:  Y   110_A      Y   110_A
#   possible swapping detected:  F   115_A      F   115_A
#   possible swapping detected:  E   117_A      E   117_A
#   possible swapping detected:  F   127_A      F   127_A
#   possible swapping detected:  Y   133_A      Y   133_A
#   possible swapping detected:  D   145_A      D   145_A
#   possible swapping detected:  F   156_A      F   156_A
#   possible swapping detected:  E   175_A      E   175_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    M     1_A      M     1_A    88.951     0    0.102   0.960    93.363    0.000    0.000
LGA    E     2_A      E     2_A    85.532     0    0.184   1.062    88.718    0.000    0.000
LGA    Q     3_A      Q     3_A    83.530     0    0.490   0.987    84.177    0.000    0.000
LGA    S     4_A      S     4_A    80.136     0    0.557   0.633    81.346    0.000    0.000
LGA    S     5_A      S     5_A    77.651     0    0.527   0.839    79.646    0.000    0.000
LGA    G     6_A      G     6_A    72.316     0    0.499   0.499    74.110    0.000    0.000
LGA    D     7_A      D     7_A    69.740     0    0.109   1.105    71.443    0.000    0.000
LGA    K     8_A      K     8_A    63.917     0    0.261   0.803    67.651    0.000    0.000
LGA    D     9_A      D     9_A    59.138     0    0.205   1.201    60.655    0.000    0.000
LGA    G    10_A      G    10_A    55.199     0    0.336   0.336    57.194    0.000    0.000
LGA    G    11_A      G    11_A    52.164     0    0.560   0.560    53.425    0.000    0.000
LGA    S    12_A      S    12_A    48.447     0    0.504   0.462    50.159    0.000    0.000
LGA    D    13_A      D    13_A    42.739     0    0.466   0.924    45.127    0.000    0.000
LGA    S    14_A      S    14_A    43.433     0    0.249   0.682    45.499    0.000    0.000
LGA    G    15_A      G    15_A    39.520     0    0.021   0.021    40.851    0.000    0.000
LGA    G    16_A      G    16_A    37.131     0    0.021   0.021    38.436    0.000    0.000
LGA    A    17_A      A    17_A    32.375     0    0.160   0.193    34.179    0.000    0.000
LGA    Q    18_A      Q    18_A    26.496     0    0.296   1.213    29.449    0.000    0.000
LGA    D    19_A      D    19_A    22.811     0    0.660   0.832    24.123    0.000    0.000
LGA    G    20_A      G    20_A    19.095     0    0.341   0.341    20.112    0.000    0.000
LGA    G    21_A      G    21_A    13.888     0    0.443   0.443    16.130    0.000    0.000
LGA    S    22_A      S    22_A     8.500     0    0.047   0.731    10.195   14.405    9.762
LGA    L    23_A      L    23_A     3.055     0    0.269   0.297     5.380   39.405   58.750
LGA    D    24_A      D    24_A     1.948     0    0.077   0.860     3.354   68.810   63.095
LGA    S    25_A      S    25_A     2.616     0    0.122   0.698     3.891   62.857   57.460
LGA    L    26_A      L    26_A     1.741     0    0.030   0.102     1.997   72.857   72.857
LGA    K    27_A      K    27_A     1.765     0    0.021   1.025     4.275   68.810   62.011
LGA    K    28_A      K    28_A     2.830     0    0.037   0.556     4.502   57.262   49.788
LGA    Y    29_A      Y    29_A     2.541     0    0.044   0.171     4.095   60.952   53.889
LGA    N    30_A      N    30_A     2.241     0    0.092   0.937     2.275   64.762   73.274
LGA    G    31_A      G    31_A     2.138     0    0.060   0.060     2.169   64.762   64.762
LGA    K    32_A      K    32_A     2.328     0    0.263   1.073     3.467   61.071   56.508
LGA    L    33_A      L    33_A     1.063     0    0.030   0.164     2.436   75.119   78.452
LGA    P    34_A      P    34_A     3.696     0    0.061   0.129     4.430   53.810   48.503
LGA    K    35_A      K    35_A     5.018     0    0.017   0.953    14.437   32.976   16.296
LGA    H    36_A      H    36_A     4.009     0    0.067   1.223     6.046   35.714   35.286
LGA    D    37_A      D    37_A     3.987     0    0.015   0.901     5.676   45.000   39.107
LGA    P    38_A      P    38_A     3.833     0    0.091   0.323     4.381   43.333   41.565
LGA    S    39_A      S    39_A     3.710     0    0.041   0.245     3.796   43.333   44.444
LGA    F    40_A      F    40_A     3.405     0    0.069   0.156     3.523   48.333   49.394
LGA    V    41_A      V    41_A     3.416     0    0.055   1.087     5.929   55.476   43.810
LGA    Q    42_A      Q    42_A     2.340     0    0.048   1.290     5.036   62.857   52.698
LGA    P    43_A      P    43_A     3.013     0    0.615   0.595     4.483   50.357   47.415
LGA    G    44_A      G    44_A     3.344     0    0.135   0.135     3.619   51.905   51.905
LGA    N    45_A      N    45_A     3.307     0    0.558   1.271     8.523   53.571   34.881
LGA    R    46_A      R    46_A     2.292     0    0.197   0.559     2.412   64.762   72.294
LGA    H    47_A      H    47_A     2.907     0    0.150   0.621     5.967   57.143   42.667
LGA    Y    48_A      Y    48_A     2.969     0    0.134   0.210     5.813   57.143   40.238
LGA    K    49_A      K    49_A     2.873     0    0.654   1.036     5.983   62.976   43.598
LGA    Y    50_A      Y    50_A     4.315     0    0.072   1.254    10.573   40.238   19.444
LGA    Q    51_A      Q    51_A     2.323     0    0.037   1.139     7.410   66.905   48.148
LGA    C    52_A      C    52_A     0.994     0    0.088   0.123     1.364   88.214   88.968
LGA    T    53_A      T    53_A     0.401     0    0.035   0.065     0.582   97.619   98.639
LGA    W    54_A      W    54_A     0.396     0    0.020   1.510     6.681   95.238   69.694
LGA    Y    55_A      Y    55_A     0.959     0    0.077   1.534    10.571   88.214   48.175
LGA    A    56_A      A    56_A     0.886     0    0.025   0.035     0.926   90.476   90.476
LGA    Y    57_A      Y    57_A     0.815     0    0.061   1.364     6.854   90.476   64.008
LGA    N    58_A      N    58_A     1.162     0    0.036   1.105     3.825   83.690   77.857
LGA    R    59_A      R    59_A     1.000     0    0.094   1.246     6.725   83.810   56.104
LGA    R    60_A      R    60_A     1.246     0    0.053   0.958     4.247   81.429   68.831
LGA    G    61_A      G    61_A     1.243     0    0.117   0.117     1.669   77.143   77.143
LGA    Q    62_A      Q    62_A     2.347     0    0.087   0.994     5.199   64.881   53.280
LGA    L    63_A      L    63_A     2.244     0    0.055   0.127     3.969   68.810   60.417
LGA    G    64_A      G    64_A     1.411     0    0.048   0.048     1.655   83.810   83.810
LGA    I    65_A      I    65_A     1.044     0    0.281   0.280     1.999   81.548   77.202
LGA    P    66_A      P    66_A     1.541     0    0.116   0.259     1.726   75.000   77.823
LGA    V    67_A      V    67_A     1.368     0    0.016   0.076     1.464   81.429   81.429
LGA    P    68_A      P    68_A     1.159     0    0.035   0.286     1.296   85.952   85.306
LGA    L    69_A      L    69_A     0.861     0    0.026   0.223     1.037   90.476   89.345
LGA    W    70_A      W    70_A     0.835     0    0.611   0.479     3.144   78.095   86.939
LGA    G    71_A      G    71_A     1.247     0    0.285   0.285     2.342   77.262   77.262
LGA    D    72_A      D    72_A     1.007     0    0.090   0.813     2.573   85.952   79.583
LGA    A    73_A      A    73_A     0.684     0    0.055   0.052     0.913   90.476   90.476
LGA    A    74_A      A    74_A     0.577     0    0.014   0.027     0.870   90.476   90.476
LGA    D    75_A      D    75_A     0.708     0    0.029   0.503     2.504   90.476   85.179
LGA    W    76_A      W    76_A     0.492     0    0.008   0.096     0.607   92.857   97.959
LGA    I    77_A      I    77_A     0.635     0    0.016   0.125     0.902   90.476   91.667
LGA    G    78_A      G    78_A     0.978     0    0.067   0.067     0.978   90.476   90.476
LGA    G    79_A      G    79_A     0.891     0    0.051   0.051     1.022   88.214   88.214
LGA    A    80_A      A    80_A     0.742     0    0.038   0.045     0.958   90.476   90.476
LGA    K    81_A      K    81_A     1.121     0    0.026   0.806     3.571   83.690   75.397
LGA    G    82_A      G    82_A     1.809     0    0.043   0.043     2.114   70.833   70.833
LGA    A    83_A      A    83_A     1.635     0    0.064   0.060     1.663   72.857   72.857
LGA    G    84_A      G    84_A     1.672     0    0.044   0.044     1.672   72.857   72.857
LGA    Y    85_A      Y    85_A     1.119     0    0.090   0.687     1.963   83.690   80.833
LGA    G    86_A      G    86_A     0.553     0    0.123   0.123     0.795   95.238   95.238
LGA    V    87_A      V    87_A     0.699     0    0.030   1.082     2.541   90.476   80.952
LGA    G    88_A      G    88_A     1.371     0    0.078   0.078     1.371   81.429   81.429
LGA    R    89_A      R    89_A     0.795     0    0.081   1.341     6.597   90.476   64.935
LGA    T    90_A      T    90_A     0.696     0    0.032   0.053     1.132   88.214   89.184
LGA    P    91_A      P    91_A     1.158     0    0.114   0.344     1.730   81.548   81.565
LGA    K    92_A      K    92_A     1.310     0    0.031   0.653     4.882   81.429   71.270
LGA    Q    93_A      Q    93_A     1.746     0    0.033   0.258     2.506   70.952   67.566
LGA    G    94_A      G    94_A     2.874     0    0.204   0.204     3.786   55.595   55.595
LGA    A    95_A      A    95_A     2.077     0    0.020   0.041     2.092   68.810   68.000
LGA    C    96_A      C    96_A     2.013     0    0.039   0.803     2.699   73.095   71.825
LGA    V    97_A      V    97_A     0.422     0    0.025   1.125     2.153   97.619   87.211
LGA    I    98_A      I    98_A     0.790     0    0.034   0.661     2.626   88.214   84.048
LGA    W    99_A      W    99_A     0.864     0    0.076   0.169     1.183   88.214   91.905
LGA    Q   100_A      Q   100_A     0.847     0    0.042   0.485     1.782   90.476   88.519
LGA    R   101_A      R   101_A     0.646     0    0.066   1.304     3.975   86.071   76.190
LGA    G   102_A      G   102_A     1.659     0    0.149   0.149     2.848   71.071   71.071
LGA    V   103_A      V   103_A     1.319     0    0.033   0.059     1.698   81.429   81.497
LGA    Q   104_A      Q   104_A     1.599     0    0.025   0.668     4.392   77.143   62.434
LGA    G   105_A      G   105_A     1.202     0    0.025   0.025     1.345   83.690   83.690
LGA    G   106_A      G   106_A     0.795     0    0.065   0.065     0.892   90.476   90.476
LGA    S   107_A      S   107_A     1.090     0    0.069   0.739     4.137   88.214   77.143
LGA    P   108_A      P   108_A     1.087     0    0.050   0.275     1.309   85.952   85.306
LGA    Q   109_A      Q   109_A     0.799     0    0.031   0.944     2.335   90.476   82.751
LGA    Y   110_A      Y   110_A     0.557     0    0.093   0.204     2.473   90.476   83.889
LGA    G   111_A      G   111_A     0.466     0    0.076   0.076     0.616   97.619   97.619
LGA    H   112_A      H   112_A     0.321     0    0.030   0.487     2.490  100.000   89.190
LGA    V   113_A      V   113_A     0.808     0    0.031   1.202     2.474   85.952   79.252
LGA    A   114_A      A   114_A     1.412     0    0.036   0.058     1.638   77.143   78.000
LGA    F   115_A      F   115_A     1.956     0    0.035   0.222     2.552   72.857   67.749
LGA    V   116_A      V   116_A     1.919     0    0.104   0.105     2.101   68.810   70.544
LGA    E   117_A      E   117_A     2.340     0    0.040   0.161     2.878   64.762   62.222
LGA    K   118_A      K   118_A     2.220     0    0.066   0.632     3.180   66.786   64.180
LGA    V   119_A      V   119_A     1.919     0    0.051   0.084     2.471   66.786   69.388
LGA    L   120_A      L   120_A     2.186     0    0.071   0.120     2.633   64.762   61.905
LGA    D   121_A      D   121_A     1.763     0    0.176   1.264     4.961   70.833   60.952
LGA    G   122_A      G   122_A     1.593     0    0.307   0.307     2.092   72.976   72.976
LGA    G   123_A      G   123_A     1.340     0    0.190   0.190     1.637   79.286   79.286
LGA    K   124_A      K   124_A     0.856     0    0.113   0.631     1.344   85.952   88.519
LGA    K   125_A      K   125_A     1.546     0    0.070   0.925     3.893   75.000   70.529
LGA    I   126_A      I   126_A     1.436     0    0.046   0.063     1.513   79.286   81.488
LGA    F   127_A      F   127_A     1.842     0    0.022   0.160     3.493   72.857   61.602
LGA    I   128_A      I   128_A     1.773     0    0.036   0.045     2.092   68.810   74.048
LGA    S   129_A      S   129_A     2.438     0    0.090   0.686     4.778   64.762   57.937
LGA    E   130_A      E   130_A     2.628     0    0.060   0.663     5.066   55.476   49.101
LGA    H   131_A      H   131_A     4.210     0    0.407   0.482     6.964   31.667   39.143
LGA    N   132_A      N   132_A     4.638     0    0.269   1.287    10.065   30.357   18.274
LGA    Y   133_A      Y   133_A     4.278     0    0.085   0.140     9.760   41.786   22.262
LGA    A   134_A      A   134_A     2.605     0    0.058   0.054     3.589   67.143   62.381
LGA    T   135_A      T   135_A     1.552     0    0.058   0.096     4.006   73.690   64.830
LGA    P   136_A      P   136_A     4.393     0    0.137   0.418     6.472   30.357   37.007
LGA    N   137_A      N   137_A     9.110     0    0.336   1.029    14.420    4.762    2.381
LGA    G   138_A      G   138_A     6.585     0    0.102   0.102     7.386   17.738   17.738
LGA    Y   139_A      Y   139_A     4.404     0    0.071   1.010     6.879   34.405   31.270
LGA    G   140_A      G   140_A     3.610     0    0.026   0.026     3.833   46.667   46.667
LGA    T   141_A      T   141_A     2.669     0    0.035   0.119     3.023   57.262   57.211
LGA    R   142_A      R   142_A     2.134     0    0.042   0.547     3.561   66.786   60.173
LGA    T   143_A      T   143_A     1.903     0    0.021   0.085     2.369   70.833   69.388
LGA    I   144_A      I   144_A     1.303     0    0.025   0.551     1.483   81.429   84.821
LGA    D   145_A      D   145_A     1.460     0    0.019   0.907     2.859   79.286   74.167
LGA    M   146_A      M   146_A     0.921     0    0.023   0.603     1.855   83.690   84.881
LGA    S   147_A      S   147_A     1.547     0    0.050   0.558     3.707   72.976   69.444
LGA    S   148_A      S   148_A     2.076     0    0.035   0.750     3.758   72.976   66.667
LGA    A   149_A      A   149_A     1.634     0    0.015   0.043     1.817   77.143   76.286
LGA    I   150_A      I   150_A     0.806     0    0.013   0.593     2.667   90.595   85.238
LGA    G   151_A      G   151_A     0.697     0    0.065   0.065     0.857   90.476   90.476
LGA    K   152_A      K   152_A     1.433     0    0.039   1.276     7.696   79.286   59.947
LGA    N   153_A      N   153_A     1.236     0    0.035   0.063     1.662   81.429   80.357
LGA    A   154_A      A   154_A     0.866     0    0.056   0.078     1.534   83.810   85.143
LGA    Q   155_A      Q   155_A     0.959     0    0.036   0.924     2.452   90.476   83.757
LGA    F   156_A      F   156_A     0.890     0    0.021   0.148     1.313   90.476   88.009
LGA    I   157_A      I   157_A     0.605     0    0.018   0.103     0.836   90.476   91.667
LGA    Y   158_A      Y   158_A     0.406     0    0.333   0.451     2.010   91.190   88.452
LGA    D   159_A      D   159_A     1.454     0    0.037   1.046     6.938   66.190   48.750
LGA    K   160_A      K   160_A     3.166     0    0.636   1.050     4.420   49.286   55.397
LGA    K   161_A      K   161_A     8.582     0    0.056   0.960    16.725    5.476    2.434
LGA    K   162_A      K   162_A    11.190     0    0.559   0.926    15.597    0.119    6.085
LGA    N   163_A      N   163_A    15.597     0    0.042   1.300    17.046    0.000    0.000
LGA    S   164_A      S   164_A    21.568     0    0.574   0.952    24.290    0.000    0.000
LGA    S   165_A      S   165_A    22.619     0    0.365   0.618    24.122    0.000    0.000
LGA    S   166_A      S   166_A    23.178     0    0.716   0.888    25.317    0.000    0.000
LGA    V   167_A      V   167_A    25.465     0    0.606   0.973    26.375    0.000    0.000
LGA    D   168_A      D   168_A    24.647     0    0.656   1.014    27.520    0.000    0.000
LGA    K   169_A      K   169_A    23.770     0    0.064   0.841    26.628    0.000    0.000
LGA    L   170_A      L   170_A    26.088     0    0.019   0.272    30.656    0.000    0.000
LGA    A   171_A      A   171_A    31.522     0    0.021   0.024    35.569    0.000    0.000
LGA    A   172_A      A   172_A    34.212     0    0.056   0.052    36.450    0.000    0.000
LGA    A   173_A      A   173_A    33.153     0    0.588   0.539    33.957    0.000    0.000
LGA    L   174_A      L   174_A    36.609     0    0.313   1.050    40.289    0.000    0.000
LGA    E   175_A      E   175_A    38.377     0    0.604   1.036    41.798    0.000    0.000
LGA    H   176_A      H   176_A    36.191     0    0.648   0.918    37.160    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      176     704    704  100.00    1334   1334  100.00               176
SUMMARY(RMSD_GDC):    15.769         15.719                 16.028           56.943   53.541

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  176  176    4.0    133    1.99    62.074    63.172     6.367

LGA_LOCAL      RMSD:   1.989  Number of atoms:  133  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  21.659  Number of assigned atoms:  176 
Std_ASGN_ATOMS RMSD:  15.769  Standard rmsd on all 176 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.295636 * X  +  -0.323655 * Y  +  -0.898803 * Z  +   1.567646
  Y_new =  -0.565610 * X  +  -0.698918 * Y  +   0.437719 * Z  +  -2.578252
  Z_new =  -0.769860 * X  +   0.637778 * Y  +   0.023563 * Z  +   0.960928 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -2.052427  0.878622  1.533868   [DEG: -117.5954   50.3413   87.8841 ]
ZXZ: -2.023992  1.547231 -0.878957   [DEG: -115.9662   88.6498  -50.3605 ]
 
# END of job
