
#######################################################
#                                                     #
#                        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  222 ( 1696),  selected  222 , name one
# Molecule2: number of CA atoms  222 ( 1696),  selected  222 , 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:   144      62_A - 205_A       4.93    23.65
  LCS_AVERAGE:     51.37

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   126      72_A - 197_A       1.85    26.26
  LONGEST_CONTINUOUS_SEGMENT:   126      73_A - 198_A       1.80    26.52
  LCS_AVERAGE:     37.86

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    94      77_A - 170_A       0.97    26.75
  LCS_AVERAGE:     22.46

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  222
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     G     1_A     G     1_A      3   20   37      0    3    3    4    4   11   20   23   26   30   34   49   54   68  100  111  124  139  142  146 
LCS_GDT     P     2_A     P     2_A      3   21   37      3    3    3    4    4    4   21   31   32   34   36   38   45   48   50   70   80  124  128  145 
LCS_GDT     H     3_A     H     3_A     15   21   37      3    3    4   11   15   19   21   23   26   30   34   36   45   60   73  111  118  133  141  146 
LCS_GDT     M     4_A     M     4_A     17   22   37      6   14   16   17   20   21   23   30   32   33   49   79   89   96  101  118  129  139  142  146 
LCS_GDT     E     5_A     E     5_A     17   22   54      7   14   16   17   20   21   28   31   32   34   38   81   93  108  113  128  132  139  142  146 
LCS_GDT     Q     6_A     Q     6_A     17   22   55      6   14   16   17   20   23   28   31   32   34   38   42   49   55  111  118  123  133  141  145 
LCS_GDT     L     7_A     L     7_A     17   22   56      7   14   16   17   20   25   28   31   32   34   38   79   89   96  112  118  127  139  142  146 
LCS_GDT     E     8_A     E     8_A     17   23   56      6   14   16   17   20   26   28   31   32   34   38   79   93  106  116  128  132  139  142  146 
LCS_GDT     G     9_A     G     9_A     17   23   56      7   14   16   17   23   26   28   31   32   36   39   42   65   75  112  128  130  139  141  146 
LCS_GDT     I    10_A     I    10_A     17   23   56      7   14   16   17   23   26   28   31   33   37   40   43   93   98  112  118  129  139  142  146 
LCS_GDT     M    11_A     M    11_A     17   23   56      7   14   16   17   23   26   28   31   35   41   44   79   89   97  112  123  132  139  142  146 
LCS_GDT     L    12_A     L    12_A     17   23   56      7   14   16   17   23   26   29   33   37   41   44   49   51   56   61   75  102  111  141  146 
LCS_GDT     S    13_A     S    13_A     17   23   58      5   14   16   17   23   26   29   32   37   41   43   49   51   54   88  128  130  133  141  146 
LCS_GDT     P    14_A     P    14_A     17   23   62      5   14   16   17   23   26   28   31   37   41   44   49   51   56   62  128  130  133  141  146 
LCS_GDT     A    15_A     A    15_A     17   23   62      7   14   16   17   23   26   28   31   35   41   44   49   51   61  111  112  115  133  141  145 
LCS_GDT     F    16_A     F    16_A     17   23   62      6   14   16   17   23   26   31   35   39   42   48   79   89   98  112  118  129  139  142  146 
LCS_GDT     Q    17_A     Q    17_A     17   23   62      4   14   16   17   23   28   32   37   40   46   52   61   89   96  112  120  132  139  142  146 
LCS_GDT     E    18_A     E    18_A     17   23   62      4   12   16   17   23   26   28   35   39   44   52   79   93   98  112  120  129  139  142  146 
LCS_GDT     Q    19_A     Q    19_A     17   23   62      4   12   16   17   23   28   32   37   43   53   61   64   66   69   71   73  118  124  128  132 
LCS_GDT     M    20_A     M    20_A     17   23   62      4    8   15   20   26   32   37   44   52   58   61   64   66   69   76   90  105  116  129  137 
LCS_GDT     N    21_A     N    21_A     10   23   62      4    7   12   19   26   32   37   42   52   58   61   64   66   69   73   90  100  116  129  137 
LCS_GDT     A    22_A     A    22_A     10   34   62      4    7   13   20   27   32   38   44   52   58   61   64   66   69   76   90  105  116  129  137 
LCS_GDT     L    23_A     L    23_A     10   34   62      4   10   13   23   29   36   38   44   52   58   61   64   66   69   71   73   81   94  102  112 
LCS_GDT     M    24_A     M    24_A     12   34   62      4   10   18   23   29   36   38   44   52   58   61   64   66   69   71   73   75   82   91   98 
LCS_GDT     L    25_A     L    25_A     12   34   62      4    8   13   23   29   36   38   44   52   58   61   64   66   69   71   73   77   86   96  104 
LCS_GDT     D    26_A     D    26_A     12   34   62      4    8   13   23   29   36   38   44   52   58   61   64   66   69   71   73   75   78   87   94 
LCS_GDT     P    27_A     P    27_A     15   34   62      6   11   16   23   29   36   38   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     R    28_A     R    28_A     15   34   62      7   11   16   23   29   36   38   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     M    29_A     M    29_A     15   34   62      4   11   18   23   29   36   38   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     L    30_A     L    30_A     15   34   62      6   11   18   23   29   36   38   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     D    31_A     D    31_A     15   34   62      7   11   17   23   29   36   38   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     M    32_A     M    32_A     15   34   62      7   11   18   23   29   36   38   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     M    33_A     M    33_A     15   34   62      7   11   18   23   29   36   38   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     I    34_A     I    34_A     15   34   62      7   10   17   23   29   36   38   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     D    35_A     D    35_A     15   34   62      7   10   18   23   29   36   38   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     Q    36_A     Q    36_A     15   34   62      7   11   18   23   29   36   38   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     N    37_A     N    37_A     15   34   62      5   11   17   23   29   36   38   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     P    38_A     P    38_A     15   34   62      5   11   17   23   29   36   38   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     Q    39_A     Q    39_A     15   34   62      5   11   17   21   28   36   38   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     L    40_A     L    40_A     15   34   62      4   11   17   23   29   36   38   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     R    41_A     R    41_A     15   34   62      4   11   18   23   29   36   38   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     N    42_A     N    42_A     14   34   62      3   11   18   23   29   36   38   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     M    43_A     M    43_A     12   34   62      4   11   18   23   29   36   38   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     G    44_A     G    44_A     12   34   62      8   11   18   23   29   36   38   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     P    45_A     P    45_A     12   34   62      8   11   18   23   29   36   38   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     E    46_A     E    46_A     12   34   62      8   11   18   23   29   36   38   44   52   58   61   64   66   69   71   73   75   78   82   90 
LCS_GDT     A    47_A     A    47_A     12   34   62      8   11   18   23   29   36   38   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     R    48_A     R    48_A     12   34   62      8   11   18   23   29   36   38   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     Q    49_A     Q    49_A     13   34   62      8   10   18   23   29   36   38   44   52   58   61   64   66   69   71   73   75   78   83   90 
LCS_GDT     M    50_A     M    50_A     13   34   62      8   11   18   23   29   33   38   44   52   58   61   64   66   69   71   73   75   77   82   90 
LCS_GDT     L    51_A     L    51_A     13   34   62      8   11   13   17   27   32   37   43   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     R    52_A     R    52_A     13   34   62      8   11   13   16   25   31   37   43   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     P    53_A     P    53_A     13   34   62      8   11   13   23   29   36   38   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     M    54_A     M    54_A     13   34   62      8   11   18   23   29   36   38   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     F    55_A     F    55_A     13   34   62      8   11   13   19   28   32   38   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     R    56_A     R    56_A     13   30   62      8   11   13   16   20   31   38   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     E    57_A     E    57_A     13   22   62      7   11   13   19   27   36   38   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     M    58_A     M    58_A     13   22   62      7   11   13   19   28   36   38   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     M    59_A     M    59_A     13   22   62      8   11   13   16   20   24   36   44   52   58   61   64   66   69   72   82   92  108  116  127 
LCS_GDT     S    60_A     S    60_A     13   22   62      8   11   13   15   20   24   34   40   52   58   61   64   66   69   71   73   76   88  100  111 
LCS_GDT     N    61_A     N    61_A     13   22  143      7   11   13   14   22   32   37   44   52   58   61   64   66   69   71   73   79   91  105  116 
LCS_GDT     P    62_A     P    62_A     14   22  144      4    9   13   16   18   32   36   42   48   56   66   75   86  101  111  121  129  139  141  142 
LCS_GDT     E    63_A     E    63_A     14   19  144      4    8   13   16   18   21   22   26   29   38   39   55   66   81   97  114  123  132  141  142 
LCS_GDT     S    64_A     S    64_A     14   19  144      5   10   13   16   18   21   22   26   29   38   39   49   64   71   82   91  107  119  127  135 
LCS_GDT     M    65_A     M    65_A     14   19  144      5   10   13   16   24   36   38   44   52   58   67   78   92  101  117  127  134  139  141  146 
LCS_GDT     R    66_A     R    66_A     14   19  144      5   10   13   16   25   36   41   56   75   89  103  119  128  132  132  135  137  139  142  146 
LCS_GDT     S    67_A     S    67_A     14   19  144      5   10   13   16   18   21   24   35   45   63   80   95  108  119  132  135  137  139  141  142 
LCS_GDT     M    68_A     M    68_A     14   19  144      6   10   13   16   19   24   29   42   51   61   69   87   97  110  124  132  137  139  142  146 
LCS_GDT     M    69_A     M    69_A     14   18  144      5   10   15   23   29   35   55   72   87  101  119  125  129  132  132  135  137  139  142  146 
LCS_GDT     N    70_A     N    70_A     14   17  144      6   10   13   22   38   63   84  102  119  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     M    71_A     M    71_A     14   17  144      6   10   13   16   20   24   34   51   75   87  102  119  128  132  132  135  137  139  142  146 
LCS_GDT     G    72_A     G    72_A     14  126  144      4   10   13   16   18   30   47   68   84  101  119  125  129  132  132  135  137  139  142  146 
LCS_GDT     R    73_A     R    73_A     14  126  144      6   26   47   81  111  117  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     A    74_A     A    74_A     14  126  144      6   10   13   41   51   92  113  121  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     W    75_A     W    75_A     14  126  144      6   10   13   17   34   66   86  111  122  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     G    76_A     G    76_A     93  126  144      3    7   30   68   86  115  119  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     S    77_A     S    77_A     94  126  144     32   97  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     K    78_A     K    78_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     K    79_A     K    79_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     I    80_A     I    80_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     L    81_A     L    81_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     I    82_A     I    82_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     V    83_A     V    83_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     E    84_A     E    84_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     S    85_A     S    85_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     D    86_A     D    86_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     T    87_A     T    87_A     94  126  144     29  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     A    88_A     A    88_A     94  126  144     29  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     L    89_A     L    89_A     94  126  144     55  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     S    90_A     S    90_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     A    91_A     A    91_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     T    92_A     T    92_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     L    93_A     L    93_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     R    94_A     R    94_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     S    95_A     S    95_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     A    96_A     A    96_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     L    97_A     L    97_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     E    98_A     E    98_A     94  126  144     55  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     G    99_A     G    99_A     94  126  144     32   97  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     R   100_A     R   100_A     94  126  144     55  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     G   101_A     G   101_A     94  126  144     57  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     F   102_A     F   102_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     T   103_A     T   103_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     V   104_A     V   104_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     D   105_A     D   105_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     E   106_A     E   106_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     T   107_A     T   107_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     T   108_A     T   108_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     D   109_A     D   109_A     94  126  144     43  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     G   110_A     G   110_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     K   111_A     K   111_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     G   112_A     G   112_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     S   113_A     S   113_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     V   114_A     V   114_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     E   115_A     E   115_A     94  126  144     40  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     Q   116_A     Q   116_A     94  126  144     43  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     I   117_A     I   117_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     R   118_A     R   118_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     R   119_A     R   119_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     D   120_A     D   120_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     R   121_A     R   121_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     P   122_A     P   122_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     D   123_A     D   123_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     L   124_A     L   124_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     V   125_A     V   125_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     V   126_A     V   126_A     94  126  144     51  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     L   127_A     L   127_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     A   128_A     A   128_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     V   129_A     V   129_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     D   130_A     D   130_A     94  126  144     14   98  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     L   131_A     L   131_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     S   132_A     S   132_A     94  126  144      4   83  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     A   133_A     A   133_A     94  126  144      4    6   84  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     G   134_A     G   134_A     94  126  144     22   83  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     Q   135_A     Q   135_A     94  126  144     17  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     N   136_A     N   136_A     94  126  144     22  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     G   137_A     G   137_A     94  126  144     22  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     Y   138_A     Y   138_A     94  126  144     53  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     L   139_A     L   139_A     94  126  144     22  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     I   140_A     I   140_A     94  126  144     15  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     C   141_A     C   141_A     94  126  144     53  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     G   142_A     G   142_A     94  126  144     53  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     K   143_A     K   143_A     94  126  144     53  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     L   144_A     L   144_A     94  126  144     53  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     K   145_A     K   145_A     94  126  144     53  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     K   146_A     K   146_A     94  126  144     53  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     D   147_A     D   147_A     94  126  144     31  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     D   148_A     D   148_A     94  126  144     53  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     D   149_A     D   149_A     94  126  144     53  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     L   150_A     L   150_A     94  126  144     53  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     K   151_A     K   151_A     94  126  144     53  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     N   152_A     N   152_A     94  126  144     53  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     V   153_A     V   153_A     94  126  144     58  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     P   154_A     P   154_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     I   155_A     I   155_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     V   156_A     V   156_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     I   157_A     I   157_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     I   158_A     I   158_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     G   159_A     G   159_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     N   160_A     N   160_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     P   161_A     P   161_A     94  126  144      5  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     D   162_A     D   162_A     94  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     G   163_A     G   163_A     94  126  144      5   75  110  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     F   164_A     F   164_A     94  126  144      6   95  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     A   165_A     A   165_A     94  126  144      9   64  107  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     Q   166_A     Q   166_A     94  126  144      6   40   86  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     H   167_A     H   167_A     94  126  144      5   79  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     R   168_A     R   168_A     94  126  144      9   82  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     K   169_A     K   169_A     94  126  144      6   29   84  112  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     L   170_A     L   170_A     94  126  144      3   34   85  112  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     K   171_A     K   171_A      9  126  144      4   12   49   93  116  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     A   172_A     A   172_A     24  126  144      3    5   31   79  103  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     H   173_A     H   173_A     24  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     A   174_A     A   174_A     24  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     D   175_A     D   175_A     24  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     E   176_A     E   176_A     24  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     Y   177_A     Y   177_A     24  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     V   178_A     V   178_A     24  126  144     58  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     A   179_A     A   179_A     24  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     K   180_A     K   180_A     24  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     P   181_A     P   181_A     24  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     V   182_A     V   182_A     24  126  144     58  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     D   183_A     D   183_A     24  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     A   184_A     A   184_A     24  126  144     59  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     D   185_A     D   185_A     24  126  144     36  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     Q   186_A     Q   186_A     24  126  144     25  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     L   187_A     L   187_A     24  126  144     45  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     V   188_A     V   188_A     24  126  144     25  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     E   189_A     E   189_A     24  126  144     44  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     R   190_A     R   190_A     24  126  144     58  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     A   191_A     A   191_A     24  126  144      9  100  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     G   192_A     G   192_A     24  126  144      8   82  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     A   193_A     A   193_A     24  126  144     27  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     L   194_A     L   194_A     24  126  144     27  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     I   195_A     I   195_A     24  126  144     43  101  111  114  119  120  121  122  123  126  126  127  129  132  132  135  137  139  142  146 
LCS_GDT     G   196_A     G   196_A     24  126  144      3   23   56  112  119  120  121  122  123  126  126  127  129  132  132  135  137  139  141  146 
LCS_GDT     F   197_A     F   197_A      4  126  144      3    4   46   96  119  120  121  122  123  126  126  127  129  132  132  135  137  139  141  146 
LCS_GDT     P   198_A     P   198_A      5  126  144      4    5    9   20   22   24   38   46   65  113  119  125  127  128  129  130  135  138  141  142 
LCS_GDT     E   199_A     E   199_A      5  125  144      4    5    7   12   18   22   24   26   30   44   53   63   79   85  114  129  136  138  141  142 
LCS_GDT     G   200_A     G   200_A      5   25  144      4    5    7   11   18   28   34   72   98  119  124  127  129  132  132  135  137  139  141  144 
LCS_GDT     N   201_A     N   201_A     21   25  144      4   17   20   22   24   28   34   75   96  111  122  126  129  132  132  135  137  139  142  146 
LCS_GDT     S   202_A     S   202_A     21   25  144     11   18   20   22   24   24   27   32   36   49   68   85   99  112  123  135  137  139  141  143 
LCS_GDT     M   203_A     M   203_A     21   25  144     11   18   20   22   24   24   27   36   56   67   84   92  105  114  124  135  137  139  142  146 
LCS_GDT     M   204_A     M   204_A     21   25  144     11   18   20   22   24   24   27   39   52   67   82   91  101  116  125  132  137  139  142  146 
LCS_GDT     I   205_A     I   205_A     21   25  144     11   18   20   22   24   24   27   32   36   38   52   63   75   87   97  110  121  130  137  144 
LCS_GDT     A   206_A     A   206_A     21   25  143     11   18   20   22   24   24   28   32   36   38   43   48   53   63   73   82   89  104  114  122 
LCS_GDT     L   207_A     L   207_A     21   25  143     11   18   20   22   24   24   28   32   36   38   43   48   51   63   71   81   94  101  116  127 
LCS_GDT     G   208_A     G   208_A     21   25  140     10   18   20   22   24   24   28   32   36   38   43   48   51   56   66   71   80   94  101  112 
LCS_GDT     V   209_A     V   209_A     21   25   32     11   18   20   22   24   24   28   32   36   38   46   57   66   69   71   73   75   78   84   90 
LCS_GDT     A   210_A     A   210_A     21   25   32     11   18   20   22   24   25   31   33   36   44   55   61   66   69   71   73   75   78   84   90 
LCS_GDT     C   211_A     C   211_A     21   25   32     10   18   20   22   24   25   31   39   42   47   57   64   66   69   71   73   75   78   84   90 
LCS_GDT     A   212_A     A   212_A     21   25   32     11   18   20   22   24   25   31   39   42   53   60   64   66   69   71   73   75   78   84   90 
LCS_GDT     I   213_A     I   213_A     21   25   32     11   18   20   22   24   25   32   39   50   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     A   214_A     A   214_A     21   25   32     11   18   20   22   27   30   37   44   51   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     L   215_A     L   215_A     21   25   32      9   18   20   22   27   30   37   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     A   216_A     A   216_A     21   25   32      9   18   20   22   27   30   37   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     I   217_A     I   217_A     21   25   32      9   18   20   22   27   30   37   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     A   218_A     A   218_A     21   25   32      9   18   20   22   27   36   38   44   52   58   61   64   66   69   71   73   75   78   84   90 
LCS_GDT     A   219_A     A   219_A     21   25   32      9   18   20   22   27   36   38   44   52   58   61   64   66   69   71   73   75   77   81   86 
LCS_GDT     V   220_A     V   220_A     21   25   32      9   14   18   22   27   33   38   44   52   58   61   64   66   69   71   73   75   77   81   85 
LCS_GDT     Y   221_A     Y   221_A     21   25   32      5   18   20   22   24   24   36   42   45   51   55   60   63   66   68   72   75   76   78   82 
LCS_GDT     F   222_A     F   222_A     21   25   32      3    4    5   17   24   24   34   42   46   49   55   58   62   66   68   71   73   76   78   79 
LCS_AVERAGE  LCS_A:  37.23  (  22.46   37.86   51.37 )

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     59    101    111    114    119    120    121    122    123    126    126    127    129    132    132    135    137    139    142    146 
GDT PERCENT_AT  26.58  45.50  50.00  51.35  53.60  54.05  54.50  54.95  55.41  56.76  56.76  57.21  58.11  59.46  59.46  60.81  61.71  62.61  63.96  65.77
GDT RMS_LOCAL    0.33   0.54   0.68   0.77   1.00   1.06   1.11   1.19   1.27   1.79   1.79   1.99   2.37   2.93   2.93   3.54   3.88   4.29   5.04   5.05
GDT RMS_ALL_AT  26.85  26.69  26.68  26.67  26.82  26.85  26.87  26.74  26.65  26.31  26.31  26.23  25.89  25.30  25.30  24.84  24.44  23.96  22.41  22.59

# Checking swapping
#   possible swapping detected:  E     5_A      E     5_A
#   possible swapping detected:  F    16_A      F    16_A
#   possible swapping detected:  D    26_A      D    26_A
#   possible swapping detected:  E    46_A      E    46_A
#   possible swapping detected:  E    63_A      E    63_A
#   possible swapping detected:  E    84_A      E    84_A
#   possible swapping detected:  D   105_A      D   105_A
#   possible swapping detected:  E   115_A      E   115_A
#   possible swapping detected:  D   148_A      D   148_A
#   possible swapping detected:  D   149_A      D   149_A
#   possible swapping detected:  D   162_A      D   162_A
#   possible swapping detected:  E   176_A      E   176_A
#   possible swapping detected:  D   183_A      D   183_A
#   possible swapping detected:  D   185_A      D   185_A
#   possible swapping detected:  E   189_A      E   189_A
#   possible swapping detected:  E   199_A      E   199_A
#   possible swapping detected:  F   222_A      F   222_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    G     1_A      G     1_A    15.935     0    0.261   0.261    16.508    0.000    0.000
LGA    P     2_A      P     2_A    17.399     0    0.627   0.582    20.112    0.000    0.000
LGA    H     3_A      H     3_A    17.877     0    0.573   1.529    18.360    0.000    0.000
LGA    M     4_A      M     4_A    18.571     0    0.244   1.030    24.045    0.000    0.000
LGA    E     5_A      E     5_A    15.033     0    0.014   1.370    16.599    0.000    0.000
LGA    Q     6_A      Q     6_A    17.100     0    0.011   0.766    24.056    0.000    0.000
LGA    L     7_A      L     7_A    19.522     0    0.023   0.092    24.085    0.000    0.000
LGA    E     8_A      E     8_A    16.763     0    0.043   1.024    17.370    0.000    0.000
LGA    G     9_A      G     9_A    14.409     0    0.024   0.024    15.331    0.000    0.000
LGA    I    10_A      I    10_A    18.204     0    0.022   0.086    22.452    0.000    0.000
LGA    M    11_A      M    11_A    19.933     0    0.024   0.682    25.944    0.000    0.000
LGA    L    12_A      L    12_A    16.361     0    0.189   1.214    17.729    0.000    0.000
LGA    S    13_A      S    13_A    14.462     0    0.087   0.569    17.004    0.000    0.000
LGA    P    14_A      P    14_A    14.991     0    0.052   0.055    17.836    0.000    0.000
LGA    A    15_A      A    15_A    19.102     0    0.070   0.077    22.587    0.000    0.000
LGA    F    16_A      F    16_A    21.852     0    0.083   1.418    27.737    0.000    0.000
LGA    Q    17_A      Q    17_A    21.837     0    0.079   0.349    24.458    0.000    0.000
LGA    E    18_A      E    18_A    23.465     0    0.202   1.087    27.452    0.000    0.000
LGA    Q    19_A      Q    19_A    28.454     0    0.050   0.777    32.031    0.000    0.000
LGA    M    20_A      M    20_A    30.135     0    0.613   0.858    33.711    0.000    0.000
LGA    N    21_A      N    21_A    30.967     0    0.502   0.724    33.365    0.000    0.000
LGA    A    22_A      A    22_A    33.797     0    0.284   0.298    38.166    0.000    0.000
LGA    L    23_A      L    23_A    38.386     0    0.100   0.307    42.663    0.000    0.000
LGA    M    24_A      M    24_A    42.108     0    0.047   1.127    44.834    0.000    0.000
LGA    L    25_A      L    25_A    42.635     0    0.185   1.400    46.389    0.000    0.000
LGA    D    26_A      D    26_A    48.004     0    0.073   0.235    52.285    0.000    0.000
LGA    P    27_A      P    27_A    53.138     0    0.110   0.405    55.327    0.000    0.000
LGA    R    28_A      R    28_A    56.176     0    0.064   1.216    58.659    0.000    0.000
LGA    M    29_A      M    29_A    50.359     0    0.112   0.824    52.024    0.000    0.000
LGA    L    30_A      L    30_A    49.976     0    0.100   0.865    52.618    0.000    0.000
LGA    D    31_A      D    31_A    57.416     0    0.012   0.129    61.572    0.000    0.000
LGA    M    32_A      M    32_A    57.181     0    0.029   0.755    57.181    0.000    0.000
LGA    M    33_A      M    33_A    51.671     0    0.027   0.334    53.199    0.000    0.000
LGA    I    34_A      I    34_A    55.459     0    0.024   0.633    58.671    0.000    0.000
LGA    D    35_A      D    35_A    61.737     0    0.109   0.174    65.981    0.000    0.000
LGA    Q    36_A      Q    36_A    58.679     0    0.064   0.930    59.120    0.000    0.000
LGA    N    37_A      N    37_A    56.493     0    0.085   0.978    58.903    0.000    0.000
LGA    P    38_A      P    38_A    62.404     0    0.050   0.056    63.365    0.000    0.000
LGA    Q    39_A      Q    39_A    58.386     0    0.031   1.031    59.173    0.000    0.000
LGA    L    40_A      L    40_A    57.475     0    0.121   0.212    60.466    0.000    0.000
LGA    R    41_A      R    41_A    63.542     0    0.084   1.301    68.742    0.000    0.000
LGA    N    42_A      N    42_A    67.406     0    0.032   1.105    70.925    0.000    0.000
LGA    M    43_A      M    43_A    63.616     0    0.119   0.723    66.406    0.000    0.000
LGA    G    44_A      G    44_A    68.408     0    0.087   0.087    68.408    0.000    0.000
LGA    P    45_A      P    45_A    67.849     0    0.049   0.279    72.556    0.000    0.000
LGA    E    46_A      E    46_A    66.454     0    0.039   1.183    73.377    0.000    0.000
LGA    A    47_A      A    47_A    60.307     0    0.021   0.033    62.991    0.000    0.000
LGA    R    48_A      R    48_A    57.891     0    0.018   1.067    65.535    0.000    0.000
LGA    Q    49_A      Q    49_A    58.802     0    0.045   1.202    64.837    0.000    0.000
LGA    M    50_A      M    50_A    54.572     0    0.226   0.787    58.364    0.000    0.000
LGA    L    51_A      L    51_A    48.762     0    0.062   0.218    51.370    0.000    0.000
LGA    R    52_A      R    52_A    47.285     0    0.058   0.766    55.455    0.000    0.000
LGA    P    53_A      P    53_A    47.090     0    0.055   0.326    51.397    0.000    0.000
LGA    M    54_A      M    54_A    43.097     0    0.095   1.060    48.914    0.000    0.000
LGA    F    55_A      F    55_A    38.218     0    0.037   1.190    40.512    0.000    0.000
LGA    R    56_A      R    56_A    38.291     0    0.038   1.294    48.926    0.000    0.000
LGA    E    57_A      E    57_A    37.790     0    0.014   0.756    44.706    0.000    0.000
LGA    M    58_A      M    58_A    31.843     0    0.077   1.068    34.360    0.000    0.000
LGA    M    59_A      M    59_A    29.048     0    0.060   1.047    31.302    0.000    0.000
LGA    S    60_A      S    60_A    31.281     0    0.121   0.703    36.000    0.000    0.000
LGA    N    61_A      N    61_A    28.426     0    0.248   1.193    32.423    0.000    0.000
LGA    P    62_A      P    62_A    23.318     0    0.385   0.423    24.807    0.000    0.000
LGA    E    63_A      E    63_A    23.781     0    0.147   1.057    28.319    0.000    0.000
LGA    S    64_A      S    64_A    24.790     0    0.072   0.623    26.783    0.000    0.000
LGA    M    65_A      M    65_A    20.898     0    0.046   0.881    23.501    0.000    0.000
LGA    R    66_A      R    66_A    15.893     0    0.667   1.505    17.858    0.000    0.130
LGA    S    67_A      S    67_A    17.585     0    0.277   0.288    18.830    0.000    0.000
LGA    M    68_A      M    68_A    18.297     0    0.030   1.146    26.115    0.000    0.000
LGA    M    69_A      M    69_A    13.163     0    0.113   0.652    15.101    0.000    0.000
LGA    N    70_A      N    70_A    10.356     0    0.035   1.095    11.496    0.119    0.060
LGA    M    71_A      M    71_A    13.606     0    0.016   1.233    21.544    0.000    0.000
LGA    G    72_A      G    72_A    11.561     0    0.127   0.127    12.238    1.071    1.071
LGA    R    73_A      R    73_A     4.939     0    0.035   0.938     7.352   30.714   37.706
LGA    A    74_A      A    74_A     7.490     0    0.019   0.021    10.102   10.833    8.667
LGA    W    75_A      W    75_A     8.058     0    0.040   0.106    17.415   10.595    3.027
LGA    G    76_A      G    76_A     5.211     0    0.284   0.284     5.211   31.786   31.786
LGA    S    77_A      S    77_A     1.367     0    0.617   0.620     3.777   81.548   71.111
LGA    K    78_A      K    78_A     0.135     0    0.027   0.751     1.518   95.357   88.677
LGA    K    79_A      K    79_A     0.489     0    0.057   0.910     1.919  100.000   89.735
LGA    I    80_A      I    80_A     0.344     0    0.039   0.072     0.475  100.000  100.000
LGA    L    81_A      L    81_A     0.257     0    0.022   0.045     0.355  100.000  100.000
LGA    I    82_A      I    82_A     0.178     0    0.011   0.100     0.284  100.000  100.000
LGA    V    83_A      V    83_A     0.375     0    0.048   0.060     0.501   97.619   98.639
LGA    E    84_A      E    84_A     0.485     0    0.093   0.207     0.899   95.238   92.593
LGA    S    85_A      S    85_A     0.860     0    0.032   0.036     1.128   90.476   87.460
LGA    D    86_A      D    86_A     0.658     0    0.023   0.144     1.077   90.476   89.345
LGA    T    87_A      T    87_A     0.935     0    0.017   1.014     3.059   90.476   82.109
LGA    A    88_A      A    88_A     1.216     0    0.009   0.010     1.483   81.429   81.429
LGA    L    89_A      L    89_A     0.799     0    0.023   0.090     1.176   92.857   90.536
LGA    S    90_A      S    90_A     0.177     0    0.043   0.051     0.447  100.000  100.000
LGA    A    91_A      A    91_A     0.452     0    0.007   0.012     0.741  100.000   98.095
LGA    T    92_A      T    92_A     0.566     0    0.023   0.080     1.133   97.619   93.265
LGA    L    93_A      L    93_A     0.437     0    0.016   0.076     0.999  100.000   96.429
LGA    R    94_A      R    94_A     0.364     0    0.059   0.156     1.049  100.000   92.338
LGA    S    95_A      S    95_A     0.377     0    0.046   0.100     0.781   97.619   96.825
LGA    A    96_A      A    96_A     0.385     0    0.008   0.015     0.592   97.619   98.095
LGA    L    97_A      L    97_A     0.575     0    0.019   0.110     0.862   90.476   91.667
LGA    E    98_A      E    98_A     0.857     0    0.043   0.124     1.172   85.952   88.466
LGA    G    99_A      G    99_A     1.387     0    0.101   0.101     2.038   75.119   75.119
LGA    R   100_A      R   100_A     0.973     0    0.082   1.564     8.078   88.214   57.965
LGA    G   101_A      G   101_A     0.833     0    0.046   0.046     0.862   90.476   90.476
LGA    F   102_A      F   102_A     0.604     0    0.041   0.112     0.801   90.476   93.939
LGA    T   103_A      T   103_A     0.572     0    0.036   0.062     0.673   90.476   90.476
LGA    V   104_A      V   104_A     0.399     0    0.066   0.110     0.585  100.000   98.639
LGA    D   105_A      D   105_A     0.353     0    0.015   0.314     1.122  100.000   96.488
LGA    E   106_A      E   106_A     0.515     0    0.035   0.646     2.045   97.619   85.873
LGA    T   107_A      T   107_A     0.489     0    0.045   0.068     0.516   97.619   98.639
LGA    T   108_A      T   108_A     0.803     0    0.041   0.201     1.233   90.476   86.599
LGA    D   109_A      D   109_A     1.029     0    0.035   0.121     2.402   85.952   79.464
LGA    G   110_A      G   110_A     0.433     0    0.055   0.055     0.614   92.857   92.857
LGA    K   111_A      K   111_A     0.469     0    0.030   0.766     2.410   95.238   90.053
LGA    G   112_A      G   112_A     0.570     0    0.057   0.057     0.667   90.476   90.476
LGA    S   113_A      S   113_A     0.680     0    0.056   0.579     1.901   92.857   89.127
LGA    V   114_A      V   114_A     0.312     0    0.034   0.055     0.604  100.000   97.279
LGA    E   115_A      E   115_A     0.835     0    0.065   1.044     5.800   90.476   64.392
LGA    Q   116_A      Q   116_A     0.637     0    0.018   0.815     3.223   95.238   80.423
LGA    I   117_A      I   117_A     0.297     0    0.019   0.119     0.422  100.000  100.000
LGA    R   118_A      R   118_A     0.452     0    0.023   1.264     4.620   97.619   76.797
LGA    R   119_A      R   119_A     0.563     0    0.067   1.394     5.536   90.476   72.727
LGA    D   120_A      D   120_A     0.286     0    0.046   0.399     1.597  100.000   94.226
LGA    R   121_A      R   121_A     0.268     0    0.021   0.512     3.112  100.000   85.801
LGA    P   122_A      P   122_A     0.391     0    0.022   0.038     0.761  100.000   95.918
LGA    D   123_A      D   123_A     0.300     0    0.046   0.112     0.635  100.000   98.810
LGA    L   124_A      L   124_A     0.226     0    0.052   0.658     1.535  100.000   94.286
LGA    V   125_A      V   125_A     0.532     0    0.015   0.040     0.638   90.476   90.476
LGA    V   126_A      V   126_A     0.649     0    0.013   0.021     0.879   95.238   93.197
LGA    L   127_A      L   127_A     0.281     0    0.036   1.326     3.304  100.000   84.762
LGA    A   128_A      A   128_A     0.305     0    0.010   0.013     0.438  100.000  100.000
LGA    V   129_A      V   129_A     0.381     0    0.602   0.799     2.883   86.905   82.449
LGA    D   130_A      D   130_A     1.385     0    0.176   0.322     2.195   79.286   75.060
LGA    L   131_A      L   131_A     0.691     0    0.382   0.479     1.869   86.071   88.274
LGA    S   132_A      S   132_A     1.605     0    0.072   0.669     1.801   72.857   72.857
LGA    A   133_A      A   133_A     2.320     0    0.060   0.063     2.684   64.762   63.238
LGA    G   134_A      G   134_A     1.741     0    0.063   0.063     1.899   77.143   77.143
LGA    Q   135_A      Q   135_A     1.172     0    0.059   0.364     2.816   85.952   73.386
LGA    N   136_A      N   136_A     0.990     0    0.049   0.191     1.314   90.476   85.952
LGA    G   137_A      G   137_A     1.046     0    0.021   0.021     1.073   85.952   85.952
LGA    Y   138_A      Y   138_A     0.487     0    0.017   1.327     9.623   92.857   53.810
LGA    L   139_A      L   139_A     0.984     0    0.032   0.055     1.319   90.476   85.952
LGA    I   140_A      I   140_A     1.038     0    0.018   0.042     1.115   81.429   81.429
LGA    C   141_A      C   141_A     0.886     0    0.062   0.067     0.957   90.476   90.476
LGA    G   142_A      G   142_A     0.818     0    0.100   0.100     1.228   88.214   88.214
LGA    K   143_A      K   143_A     0.876     0    0.028   0.355     1.660   88.214   86.508
LGA    L   144_A      L   144_A     0.807     0    0.033   0.112     1.118   88.214   89.345
LGA    K   145_A      K   145_A     0.909     0    0.086   0.213     1.507   83.810   85.503
LGA    K   146_A      K   146_A     0.994     0    0.116   0.625     1.913   85.952   82.487
LGA    D   147_A      D   147_A     0.944     0    0.071   0.119     1.183   85.952   87.083
LGA    D   148_A      D   148_A     0.897     0    0.038   1.176     5.014   90.476   74.107
LGA    D   149_A      D   149_A     0.950     0    0.105   0.355     1.925   88.214   84.881
LGA    L   150_A      L   150_A     0.793     0    0.020   1.092     2.962   90.476   84.286
LGA    K   151_A      K   151_A     1.040     0    0.018   0.807     5.434   83.690   67.937
LGA    N   152_A      N   152_A     1.170     0    0.011   0.095     1.886   83.690   79.345
LGA    V   153_A      V   153_A     0.757     0    0.017   0.030     1.156   90.476   89.184
LGA    P   154_A      P   154_A     0.497     0    0.058   0.096     0.512   95.238   95.918
LGA    I   155_A      I   155_A     0.647     0    0.061   0.244     1.029   90.476   89.345
LGA    V   156_A      V   156_A     0.231     0    0.067   0.081     0.628   97.619   98.639
LGA    I   157_A      I   157_A     0.352     0    0.013   0.555     1.857  100.000   95.417
LGA    I   158_A      I   158_A     0.089     0    0.070   1.151     2.473   97.619   86.607
LGA    G   159_A      G   159_A     0.831     0    0.104   0.104     0.892   90.476   90.476
LGA    N   160_A      N   160_A     1.122     0    0.020   0.341     1.441   81.429   81.429
LGA    P   161_A      P   161_A     1.296     0    0.165   0.393     1.401   83.690   84.014
LGA    D   162_A      D   162_A     1.017     0    0.044   1.372     5.056   86.071   70.774
LGA    G   163_A      G   163_A     1.661     0    0.260   0.260     1.661   81.548   81.548
LGA    F   164_A      F   164_A     1.080     0    0.051   0.121     1.404   83.690   88.009
LGA    A   165_A      A   165_A     1.832     0    0.018   0.019     2.252   68.810   68.000
LGA    Q   166_A      Q   166_A     2.473     0    0.038   0.737     5.267   68.810   52.275
LGA    H   167_A      H   167_A     1.305     0    0.048   1.103     5.192   83.810   63.238
LGA    R   168_A      R   168_A     1.191     0    0.013   1.022     3.835   77.381   72.684
LGA    K   169_A      K   169_A     2.928     0    0.083   0.551     5.859   57.262   49.312
LGA    L   170_A      L   170_A     2.867     0    0.127   0.231     3.421   55.357   53.571
LGA    K   171_A      K   171_A     3.692     0    0.188   0.244     4.834   43.333   39.947
LGA    A   172_A      A   172_A     3.744     0    0.121   0.129     5.275   50.357   45.524
LGA    H   173_A      H   173_A     0.961     0    0.419   1.181     4.807   88.214   65.810
LGA    A   174_A      A   174_A     0.606     0    0.025   0.036     0.706   90.476   90.476
LGA    D   175_A      D   175_A     0.614     0    0.038   0.104     0.816   90.476   90.476
LGA    E   176_A      E   176_A     0.615     0    0.049   0.521     1.519   90.476   87.513
LGA    Y   177_A      Y   177_A     0.748     0    0.059   0.068     0.909   90.476   90.476
LGA    V   178_A      V   178_A     0.632     0    0.027   0.042     0.702   92.857   91.837
LGA    A   179_A      A   179_A     0.509     0    0.021   0.025     0.576   95.238   96.190
LGA    K   180_A      K   180_A     0.448     0    0.014   0.370     0.972   95.238   92.593
LGA    P   181_A      P   181_A     0.360     0    0.049   0.363     0.731   97.619   97.279
LGA    V   182_A      V   182_A     0.382     0    0.089   1.069     2.277   97.619   87.211
LGA    D   183_A      D   183_A     0.437     0    0.048   0.666     3.542  100.000   81.964
LGA    A   184_A      A   184_A     0.337     0    0.064   0.075     0.544   97.619   98.095
LGA    D   185_A      D   185_A     0.628     0    0.020   0.587     2.842   95.238   83.155
LGA    Q   186_A      Q   186_A     0.633     0    0.055   1.374     3.622   90.476   76.720
LGA    L   187_A      L   187_A     0.500     0    0.060   1.206     2.591   95.238   86.667
LGA    V   188_A      V   188_A     0.766     0    0.027   0.149     1.465   90.476   89.184
LGA    E   189_A      E   189_A     0.649     0    0.023   1.364     5.706   90.476   71.111
LGA    R   190_A      R   190_A     0.393     0    0.013   0.386     0.800   95.238   93.939
LGA    A   191_A      A   191_A     0.990     0    0.034   0.037     1.229   85.952   85.048
LGA    G   192_A      G   192_A     1.240     0    0.172   0.172     1.954   79.286   79.286
LGA    A   193_A      A   193_A     0.905     0    0.011   0.014     0.984   90.476   90.476
LGA    L   194_A      L   194_A     0.808     0    0.143   1.036     2.606   86.071   80.893
LGA    I   195_A      I   195_A     0.702     0    0.726   0.901     3.348   80.476   78.214
LGA    G   196_A      G   196_A     2.954     0    0.676   0.676     5.172   49.524   49.524
LGA    F   197_A      F   197_A     3.572     0    0.068   1.149     7.177   31.905   54.156
LGA    P   198_A      P   198_A    10.108     0    0.626   0.577    11.409    1.786    2.041
LGA    E   199_A      E   199_A    12.886     0    0.040   1.026    15.072    0.000    0.000
LGA    G   200_A      G   200_A    11.043     0    0.112   0.112    12.983    0.000    0.000
LGA    N   201_A      N   201_A    11.991     0    0.220   0.748    14.569    0.000    0.000
LGA    S   202_A      S   202_A    16.251     0    0.066   0.615    19.031    0.000    0.000
LGA    M   203_A      M   203_A    17.850     0    0.035   0.655    21.085    0.000    0.000
LGA    M   204_A      M   204_A    17.391     0    0.047   1.183    20.759    0.000    0.000
LGA    I   205_A      I   205_A    20.078     0    0.031   0.137    23.934    0.000    0.000
LGA    A   206_A      A   206_A    24.568     0    0.021   0.028    27.759    0.000    0.000
LGA    L   207_A      L   207_A    25.926     0    0.012   1.407    28.961    0.000    0.000
LGA    G   208_A      G   208_A    26.447     0    0.016   0.016    29.992    0.000    0.000
LGA    V   209_A      V   209_A    29.891     0    0.024   0.052    33.913    0.000    0.000
LGA    A   210_A      A   210_A    33.759     0    0.030   0.033    37.134    0.000    0.000
LGA    C   211_A      C   211_A    34.976     0    0.034   0.082    38.625    0.000    0.000
LGA    A   212_A      A   212_A    36.571     0    0.011   0.011    40.718    0.000    0.000
LGA    I   213_A      I   213_A    40.873     0    0.022   0.120    45.042    0.000    0.000
LGA    A   214_A      A   214_A    44.019     0    0.017   0.023    47.781    0.000    0.000
LGA    L   215_A      L   215_A    45.533     0    0.021   0.102    49.215    0.000    0.000
LGA    A   216_A      A   216_A    47.580     0    0.020   0.020    51.992    0.000    0.000
LGA    I   217_A      I   217_A    52.277     0    0.024   0.060    56.207    0.000    0.000
LGA    A   218_A      A   218_A    54.633     0    0.022   0.031    58.258    0.000    0.000
LGA    A   219_A      A   219_A    55.613     0    0.000   0.005    59.594    0.000    0.000
LGA    V   220_A      V   220_A    59.784     0    0.075   0.153    63.973    0.000    0.000
LGA    Y   221_A      Y   221_A    63.593     0    0.015   1.382    66.510    0.000    0.000
LGA    F   222_A      F   222_A    64.089     0    0.427   1.402    64.291    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      222     888    888  100.00    1696   1696  100.00               222
SUMMARY(RMSD_GDC):    16.179         16.181                 16.597           48.744   46.245

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  222  222    4.0    122    1.19    53.153    50.005     9.439

LGA_LOCAL      RMSD:   1.192  Number of atoms:  122  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  26.742  Number of assigned atoms:  222 
Std_ASGN_ATOMS RMSD:  16.179  Standard rmsd on all 222 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.936236 * X  +   0.350694 * Y  +  -0.021791 * Z  +  16.245813
  Y_new =   0.251839 * X  +  -0.626492 * Y  +   0.737621 * Z  +  23.502415
  Z_new =   0.245027 * X  +  -0.696076 * Y  +  -0.674863 * Z  +  20.816063 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  0.262771 -0.247548 -2.340723   [DEG:   15.0557  -14.1835 -134.1135 ]
ZXZ: -3.112059  2.311575  2.803126   [DEG: -178.3078  132.4435  160.6073 ]
 
# END of job
