
#######################################################
#                                                     #
#                        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:   148      71_A - 218_A       4.85    20.47
  LONGEST_CONTINUOUS_SEGMENT:   148      72_A - 219_A       4.92    20.75
  LONGEST_CONTINUOUS_SEGMENT:   148      75_A - 222_A       4.98    21.61
  LCS_AVERAGE:     58.93

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   132      72_A - 203_A       1.94    18.74
  LONGEST_CONTINUOUS_SEGMENT:   132      75_A - 206_A       1.95    18.95
  LONGEST_CONTINUOUS_SEGMENT:   132      76_A - 207_A       1.99    18.92
  LCS_AVERAGE:     41.65

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   126      75_A - 200_A       0.84    18.74
  LCS_AVERAGE:     35.53

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    3   84      0    3    3    3    5   12   24   27   30   32   35   50   57   74   90  108  120  130  134  136 
LCS_GDT     P     2_A     P     2_A      3   24   86      3    3    4    4    4    4    7   12   29   32   33   36   56   59   61   67   75   78   82   94 
LCS_GDT     H     3_A     H     3_A      3   27   86      3    3    4    4    9   15   24   27   32   39   47   60   63   68   71   80   88   90  100  114 
LCS_GDT     M     4_A     M     4_A     19   29   87      6   13   17   23   25   29   33   39   52   63   69   71   75   83   84   88   91   93   95  100 
LCS_GDT     E     5_A     E     5_A     19   29   87      6   13   19   23   25   29   34   41   57   65   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     Q     6_A     Q     6_A     19   29   87      6   13   19   23   25   29   34   50   62   65   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     L     7_A     L     7_A     19   29   87      6   13   19   23   25   29   35   50   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     E     8_A     E     8_A     19   29   87      6   13   19   23   25   29   36   50   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     G     9_A     G     9_A     19   29   87      6   14   19   23   25   30   39   54   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     I    10_A     I    10_A     19   29   87      6   14   19   23   25   29   39   53   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     M    11_A     M    11_A     19   29   87      6   13   19   23   25   29   39   54   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     L    12_A     L    12_A     19   29   87      6   14   19   23   26   34   45   59   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     S    13_A     S    13_A     19   29   87      9   14   19   23   28   36   50   59   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     P    14_A     P    14_A     19   29   87      9   14   19   23   28   39   51   59   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     A    15_A     A    15_A     19   29   87      9   14   19   23   25   38   51   59   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     F    16_A     F    16_A     19   29   87      6   14   19   23   26   34   47   59   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     Q    17_A     Q    17_A     19   29   87      9   14   19   23   28   39   51   59   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     E    18_A     E    18_A     19   29   87      9   14   19   23   28   39   51   59   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     Q    19_A     Q    19_A     19   29   87      9   14   19   23   28   38   51   59   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     M    20_A     M    20_A     19   29   87      9   14   19   23   28   35   51   59   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     N    21_A     N    21_A     19   29   87      9   14   19   23   30   39   51   59   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     A    22_A     A    22_A     19   29   87      9   14   19   25   30   39   51   59   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     L    23_A     L    23_A     19   29   87      9   14   19   23   28   39   51   59   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     M    24_A     M    24_A     19   32   87      4   13   17   23   26   37   51   59   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     L    25_A     L    25_A     19   33   87      9   13   17   23   31   39   51   59   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     D    26_A     D    26_A     18   33   87      4   13   19   23   31   39   51   59   62   66   69   72   79   83   85   89   91   93   95   97 
LCS_GDT     P    27_A     P    27_A     17   33   87      9   13   19   25   31   39   51   59   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     R    28_A     R    28_A     17   33   87      9   13   19   25   31   39   51   59   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     M    29_A     M    29_A     17   33   87      4   13   19   25   31   39   51   59   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     L    30_A     L    30_A     17   33   87      9   13   19   25   31   39   51   59   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     D    31_A     D    31_A     17   33   87      9   13   19   25   31   39   51   59   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     M    32_A     M    32_A     17   33   87      9   13   19   25   31   39   51   59   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     M    33_A     M    33_A     17   33   87      9   13   19   25   31   38   51   59   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     I    34_A     I    34_A     17   33   87      9   11   19   25   31   39   51   59   62   66   69   74   79   83   85   89   91   93  105  139 
LCS_GDT     D    35_A     D    35_A     17   33   87      9   13   19   25   31   39   51   59   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     Q    36_A     Q    36_A     17   33   87      9   13   19   25   31   39   51   59   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     N    37_A     N    37_A     17   33   87      6   13   19   25   30   38   51   59   62   66   69   74   83   88   99  127  131  137  138  141 
LCS_GDT     P    38_A     P    38_A     17   33   87      6   13   19   25   30   39   51   59   62   66   69   74   79   87   96  103  108  113  124  129 
LCS_GDT     Q    39_A     Q    39_A     17   33   87      6   13   19   25   28   38   50   59   62  127  129  131  134  137  138  138  142  142  144  146 
LCS_GDT     L    40_A     L    40_A     17   33   87      6   13   19   25   28   40   58   99  126  128  130  131  132  134  134  135  136  139  140  141 
LCS_GDT     R    41_A     R    41_A     17   33   87      4   13   19   25   31   39   51   59   62   66   69   82  100  114  131  134  136  137  138  141 
LCS_GDT     N    42_A     N    42_A     17   33   87      4    7   17   25   31   39   51   59   71   83   93  113  132  134  134  135  136  139  140  141 
LCS_GDT     M    43_A     M    43_A     11   33   87      4   12   20   32   66   90  124  126  127  128  130  131  132  134  134  135  136  139  140  141 
LCS_GDT     G    44_A     G    44_A      9   33   87      4    8   16   25   31   38   50  105  118  125  128  128  129  130  133  135  136  137  138  141 
LCS_GDT     P    45_A     P    45_A      9   33   87      5    8   19   25   31   39   51   59   62   66   69   74  121  130  131  132  133  134  137  140 
LCS_GDT     E    46_A     E    46_A      9   33   87      5    8   16   23   31   39   54   94  118  123  127  128  129  130  131  132  133  135  135  138 
LCS_GDT     A    47_A     A    47_A      9   33   87      5    8   13   23   31   39   65   94  118  125  127  128  129  130  131  132  133  136  137  140 
LCS_GDT     R    48_A     R    48_A      9   33   87      5    8   19   25   31   39   51   59   62   80   99  114  124  129  130  132  132  134  134  136 
LCS_GDT     Q    49_A     Q    49_A     13   33   87      5    8   16   23   31   39   51   59   62   66   76   93  108  122  126  131  132  134  134  136 
LCS_GDT     M    50_A     M    50_A     13   33   87      4    8   16   23   31   38   50   59   77   94  109  120  125  128  130  131  132  134  134  135 
LCS_GDT     L    51_A     L    51_A     13   33   87     11   11   16   23   31   38   51   59   62   66   69   74  116  126  130  131  132  134  134  136 
LCS_GDT     R    52_A     R    52_A     13   33   87     11   11   16   23   31   38   51   59   62   66   69   74   79   83   85   89   91   98  117  128 
LCS_GDT     P    53_A     P    53_A     13   33   87     11   11   16   23   31   39   51   59   62   66   69   74   79   83   85  103  119  129  132  134 
LCS_GDT     M    54_A     M    54_A     13   33   87     11   11   16   23   31   39   51   59   62   66   74   84  101  113  121  126  131  131  132  134 
LCS_GDT     F    55_A     F    55_A     13   33   87     11   11   13   21   31   39   51   59   62   66   69   74   79   83   85  103  123  129  132  134 
LCS_GDT     R    56_A     R    56_A     13   33   87     11   11   13   21   31   39   51   59   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     E    57_A     E    57_A     13   33   87     11   11   13   21   31   39   51   59   62   66   69   74   79   83   85   89   91  102  113  129 
LCS_GDT     M    58_A     M    58_A     13   23   87     11   11   13   21   31   39   51   59   62   66   69   74   79   83   85   98  109  122  131  134 
LCS_GDT     M    59_A     M    59_A     13   23   87     11   11   13   17   27   38   51   59   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     S    60_A     S    60_A     13   23   87     11   11   13   16   27   39   51   59   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     N    61_A     N    61_A     13   23   87     11   11   13   17   28   39   51   59   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     P    62_A     P    62_A     16   23   87      7   15   17   21   28   38   51   59   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     E    63_A     E    63_A     16   23  139      9   15   17   21   28   39   51   59   62   66   69   74   79   83   85   89   91   93   95   97 
LCS_GDT     S    64_A     S    64_A     16   23  142      8   15   17   21   28   39   51   59   62   66   69   74   79   88  102  114  123  128  131  134 
LCS_GDT     M    65_A     M    65_A     16   23  144      9   15   17   21   28   39   51   59   62   66   69   74   79   85  100  112  121  129  132  134 
LCS_GDT     R    66_A     R    66_A     16   23  145      9   15   17   20   28   39   51   59   62   66   69   74   79   83   85   89   91  102  114  127 
LCS_GDT     S    67_A     S    67_A     16   23  146      9   15   17   19   27   39   51   59   62   66   69   74   79   83   93  110  117  128  131  134 
LCS_GDT     M    68_A     M    68_A     16   23  147      9   15   17   19   24   37   48   59   72   91  109  121  127  128  130  130  131  133  134  135 
LCS_GDT     M    69_A     M    69_A     16   23  147      9   15   17   19   27   38   51   59   62   66   74   89  108  121  126  130  131  133  134  135 
LCS_GDT     N    70_A     N    70_A     16   23  147      9   15   17   19   27   38   48   59   62   66   69   74   82   98  112  125  129  132  132  134 
LCS_GDT     M    71_A     M    71_A     16  130  148      9   15   17   19   21   30   44   68   94  112  124  128  129  129  130  130  130  132  132  135 
LCS_GDT     G    72_A     G    72_A     16  132  148      9   15   17   32   67  101  120  125  125  126  127  128  129  129  131  132  134  136  137  140 
LCS_GDT     R    73_A     R    73_A     16  132  148      9   15   17   19   26   41   58   82  106  120  126  128  129  129  130  130  132  134  134  138 
LCS_GDT     A    74_A     A    74_A     16  132  148      6   15   17   19   21   25   32   39   52   61  113  123  129  129  130  130  131  132  134  136 
LCS_GDT     W    75_A     W    75_A    126  132  148      6   15   17   19  115  124  126  126  126  127  130  130  132  134  136  138  139  141  144  146 
LCS_GDT     G    76_A     G    76_A    126  132  148     22  121  124  124  124  125  126  126  127  128  130  132  134  137  138  138  142  142  144  146 
LCS_GDT     S    77_A     S    77_A    126  132  148    103  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     K    78_A     K    78_A    126  132  148    103  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     K    79_A     K    79_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     I    80_A     I    80_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     L    81_A     L    81_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     I    82_A     I    82_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     V    83_A     V    83_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     E    84_A     E    84_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     S    85_A     S    85_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     D    86_A     D    86_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     T    87_A     T    87_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     A    88_A     A    88_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     L    89_A     L    89_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     S    90_A     S    90_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     A    91_A     A    91_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     T    92_A     T    92_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     L    93_A     L    93_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     R    94_A     R    94_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     S    95_A     S    95_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     A    96_A     A    96_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     L    97_A     L    97_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     E    98_A     E    98_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     G    99_A     G    99_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     R   100_A     R   100_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     G   101_A     G   101_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     F   102_A     F   102_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     T   103_A     T   103_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     V   104_A     V   104_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     D   105_A     D   105_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     E   106_A     E   106_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     T   107_A     T   107_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     T   108_A     T   108_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     D   109_A     D   109_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     G   110_A     G   110_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     K   111_A     K   111_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     G   112_A     G   112_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     S   113_A     S   113_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     V   114_A     V   114_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     E   115_A     E   115_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     Q   116_A     Q   116_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     I   117_A     I   117_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     R   118_A     R   118_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     R   119_A     R   119_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     D   120_A     D   120_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     R   121_A     R   121_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     P   122_A     P   122_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     D   123_A     D   123_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     L   124_A     L   124_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     V   125_A     V   125_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     V   126_A     V   126_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     L   127_A     L   127_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     A   128_A     A   128_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     V   129_A     V   129_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     D   130_A     D   130_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     L   131_A     L   131_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     S   132_A     S   132_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     A   133_A     A   133_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     G   134_A     G   134_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     Q   135_A     Q   135_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     N   136_A     N   136_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     G   137_A     G   137_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     Y   138_A     Y   138_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     L   139_A     L   139_A    126  132  148     94  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     I   140_A     I   140_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     C   141_A     C   141_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     G   142_A     G   142_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     K   143_A     K   143_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     L   144_A     L   144_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     K   145_A     K   145_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     K   146_A     K   146_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     D   147_A     D   147_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     D   148_A     D   148_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     D   149_A     D   149_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     L   150_A     L   150_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     K   151_A     K   151_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     N   152_A     N   152_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     V   153_A     V   153_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     P   154_A     P   154_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     I   155_A     I   155_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     V   156_A     V   156_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     I   157_A     I   157_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     I   158_A     I   158_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     G   159_A     G   159_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     N   160_A     N   160_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     P   161_A     P   161_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     D   162_A     D   162_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     G   163_A     G   163_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     F   164_A     F   164_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     A   165_A     A   165_A    126  132  148    102  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     Q   166_A     Q   166_A    126  132  148    102  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     H   167_A     H   167_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     R   168_A     R   168_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     K   169_A     K   169_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     L   170_A     L   170_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     K   171_A     K   171_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     A   172_A     A   172_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     H   173_A     H   173_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     A   174_A     A   174_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     D   175_A     D   175_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     E   176_A     E   176_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     Y   177_A     Y   177_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     V   178_A     V   178_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     A   179_A     A   179_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     K   180_A     K   180_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     P   181_A     P   181_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     V   182_A     V   182_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     D   183_A     D   183_A    126  132  148     94  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     A   184_A     A   184_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     D   185_A     D   185_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     Q   186_A     Q   186_A    126  132  148     99  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     L   187_A     L   187_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     V   188_A     V   188_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     E   189_A     E   189_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     R   190_A     R   190_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     A   191_A     A   191_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     G   192_A     G   192_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     A   193_A     A   193_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     L   194_A     L   194_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     I   195_A     I   195_A    126  132  148    104  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     G   196_A     G   196_A    126  132  148     84  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     F   197_A     F   197_A    126  132  148    100  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     P   198_A     P   198_A    126  132  148     77  123  124  124  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     E   199_A     E   199_A    126  132  148     48  123  124  124  124  125  126  126  127  128  130  132  134  137  138  138  142  142  144  146 
LCS_GDT     G   200_A     G   200_A    126  132  148      3    3    4    9   82  105  125  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     N   201_A     N   201_A     22  132  148      8   21   25   25   26   27   29   33   76  122  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     S   202_A     S   202_A     22  132  148      8   20   25   25   26   63  115  125  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     M   203_A     M   203_A     22  132  148     17   21   25  118  124  125  126  126  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     M   204_A     M   204_A     22  132  148     17   21   25   25   26   27   29   33   52   96  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     I   205_A     I   205_A     22  132  148     17   21   25   25   26   30   48   73   96  117  129  131  134  137  138  139  142  142  144  146 
LCS_GDT     A   206_A     A   206_A     22  132  148     17   21   25   25   26   31   85  115  125  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     L   207_A     L   207_A     22  132  148     17   21   25   25   48   79  117  125  127  128  130  132  134  137  138  139  142  142  144  146 
LCS_GDT     G   208_A     G   208_A     22   26  148     17   21   25   25   26   27   29   39   59   75  106  125  133  137  138  139  142  142  144  146 
LCS_GDT     V   209_A     V   209_A     22   26  148     17   21   25   25   26   27   37   55   77   94  113  125  133  135  138  139  142  142  144  146 
LCS_GDT     A   210_A     A   210_A     22   26  148     17   21   25   25   26   46   74  103  118  126  129  132  134  137  138  139  142  142  144  146 
LCS_GDT     C   211_A     C   211_A     22   26  148     17   21   25   25   26   27   42   60   81  110  126  131  133  137  138  139  142  142  144  146 
LCS_GDT     A   212_A     A   212_A     22   26  148     17   21   25   25   26   27   29   35   46   60   72   93  116  131  136  139  142  142  144  146 
LCS_GDT     I   213_A     I   213_A     22   26  148     17   21   25   25   26   27   29   34   46   63   90  111  124  132  137  139  142  142  144  146 
LCS_GDT     A   214_A     A   214_A     22   26  148     17   21   25   25   26   38   57   82  102  117  126  131  133  137  138  139  142  142  144  146 
LCS_GDT     L   215_A     L   215_A     22   26  148     17   21   25   25   26   27   29   34   44   59   71   89  109  128  136  139  142  142  144  146 
LCS_GDT     A   216_A     A   216_A     22   26  148     17   21   25   25   26   27   29   33   35   38   39   60   67   86   98  114  130  140  144  146 
LCS_GDT     I   217_A     I   217_A     22   26  148     16   21   25   25   26   27   29   33   41   47   68   81  109  127  135  139  141  142  144  146 
LCS_GDT     A   218_A     A   218_A     22   26  148     17   21   25   25   26   27   30   45   56   73   96  114  124  132  137  139  142  142  144  146 
LCS_GDT     A   219_A     A   219_A     22   26  148     17   21   25   25   26   27   29   33   35   38   39   46   54   68   77   90  105  119  134  142 
LCS_GDT     V   220_A     V   220_A     22   26  148     12   21   25   25   26   27   29   33   35   38   39   43   52   54   61   76   87   97  114  127 
LCS_GDT     Y   221_A     Y   221_A     22   26  148     17   21   25   25   26   27   29   33   41   47   68   77   98  118  131  137  141  142  144  146 
LCS_GDT     F   222_A     F   222_A     22   26  148      3    4   17   23   26   27   29   33   35   47   53   71   84   98  116  129  139  142  144  146 
LCS_AVERAGE  LCS_A:  45.37  (  35.53   41.65   58.93 )

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    104    123    124    124    124    125    126    126    127    128    130    132    134    137    138    139    142    142    144    146 
GDT PERCENT_AT  46.85  55.41  55.86  55.86  55.86  56.31  56.76  56.76  57.21  57.66  58.56  59.46  60.36  61.71  62.16  62.61  63.96  63.96  64.86  65.77
GDT RMS_LOCAL    0.31   0.39   0.42   0.42   0.42   0.54   0.66   0.66   1.08   1.22   1.47   1.98   2.36   2.89   3.05   3.77   3.86   3.86   4.07   4.45
GDT RMS_ALL_AT  18.77  18.76  18.72  18.72  18.72  18.72  18.81  18.81  18.81  18.75  18.95  19.00  19.03  19.36  19.52  20.40  20.24  20.24  20.48  20.91

# Checking swapping
#   possible swapping detected:  E     8_A      E     8_A
#   possible swapping detected:  E    18_A      E    18_A
#   possible swapping detected:  D    31_A      D    31_A
#   possible swapping detected:  D    35_A      D    35_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:  E    98_A      E    98_A
#   possible swapping detected:  F   102_A      F   102_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:  Y   177_A      Y   177_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

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    G     1_A      G     1_A    19.426     0    0.245   0.245    21.454    0.000    0.000
LGA    P     2_A      P     2_A    25.107     0    0.674   0.595    26.813    0.000    0.000
LGA    H     3_A      H     3_A    25.893     0    0.604   1.123    27.088    0.000    0.000
LGA    M     4_A      M     4_A    26.464     0    0.251   0.459    29.444    0.000    0.000
LGA    E     5_A      E     5_A    32.833     0    0.040   1.234    35.852    0.000    0.000
LGA    Q     6_A      Q     6_A    36.171     0    0.030   0.614    43.425    0.000    0.000
LGA    L     7_A      L     7_A    31.580     0    0.034   0.123    32.653    0.000    0.000
LGA    E     8_A      E     8_A    32.568     0    0.051   0.985    36.243    0.000    0.000
LGA    G     9_A      G     9_A    39.705     0    0.030   0.030    41.972    0.000    0.000
LGA    I    10_A      I    10_A    39.500     0    0.054   0.100    40.063    0.000    0.000
LGA    M    11_A      M    11_A    35.235     0    0.027   0.849    37.214    0.000    0.000
LGA    L    12_A      L    12_A    40.745     0    0.023   0.109    45.166    0.000    0.000
LGA    S    13_A      S    13_A    45.957     0    0.066   0.119    46.703    0.000    0.000
LGA    P    14_A      P    14_A    50.017     0    0.017   0.032    53.209    0.000    0.000
LGA    A    15_A      A    15_A    49.922     0    0.026   0.031    50.969    0.000    0.000
LGA    F    16_A      F    16_A    42.796     0    0.068   1.383    45.300    0.000    0.000
LGA    Q    17_A      Q    17_A    42.676     0    0.040   0.661    44.838    0.000    0.000
LGA    E    18_A      E    18_A    47.496     0    0.033   1.115    54.926    0.000    0.000
LGA    Q    19_A      Q    19_A    45.080     0    0.014   0.591    47.433    0.000    0.000
LGA    M    20_A      M    20_A    38.694     0    0.041   1.040    40.897    0.000    0.000
LGA    N    21_A      N    21_A    41.462     0    0.028   0.693    44.808    0.000    0.000
LGA    A    22_A      A    22_A    45.147     0    0.020   0.022    47.309    0.000    0.000
LGA    L    23_A      L    23_A    40.313     0    0.037   1.393    41.842    0.000    0.000
LGA    M    24_A      M    24_A    36.095     0    0.135   0.836    37.768    0.000    0.000
LGA    L    25_A      L    25_A    40.747     0    0.172   1.334    45.920    0.000    0.000
LGA    D    26_A      D    26_A    42.095     0    0.050   1.076    45.461    0.000    0.000
LGA    P    27_A      P    27_A    36.733     0    0.162   0.420    40.788    0.000    0.000
LGA    R    28_A      R    28_A    38.494     0    0.087   1.068    51.295    0.000    0.000
LGA    M    29_A      M    29_A    34.995     0    0.048   0.978    36.651    0.000    0.000
LGA    L    30_A      L    30_A    28.886     0    0.037   0.338    31.466    0.000    0.000
LGA    D    31_A      D    31_A    29.591     0    0.038   1.087    31.861    0.000    0.000
LGA    M    32_A      M    32_A    31.362     0    0.010   0.271    38.727    0.000    0.000
LGA    M    33_A      M    33_A    25.065     0    0.018   0.836    27.517    0.000    0.000
LGA    I    34_A      I    34_A    21.429     0    0.030   0.069    23.039    0.000    0.000
LGA    D    35_A      D    35_A    26.225     0    0.116   1.312    29.293    0.000    0.000
LGA    Q    36_A      Q    36_A    25.595     0    0.023   1.171    28.487    0.000    0.000
LGA    N    37_A      N    37_A    19.456     0    0.060   0.980    21.529    0.000    0.000
LGA    P    38_A      P    38_A    21.284     0    0.020   0.032    23.365    0.000    0.000
LGA    Q    39_A      Q    39_A    14.797     0    0.122   0.659    16.935    0.000    0.000
LGA    L    40_A      L    40_A    14.212     0    0.135   0.178    16.307    0.000    0.060
LGA    R    41_A      R    41_A    20.363     0    0.138   1.372    29.611    0.000    0.000
LGA    N    42_A      N    42_A    17.156     0    0.120   1.008    21.066    0.000    0.000
LGA    M    43_A      M    43_A    12.824     0    0.613   0.988    16.137    0.000    0.417
LGA    G    44_A      G    44_A    17.182     0    0.155   0.155    18.304    0.000    0.000
LGA    P    45_A      P    45_A    21.601     0    0.029   0.224    23.340    0.000    0.000
LGA    E    46_A      E    46_A    17.377     0    0.018   0.799    18.226    0.000    0.000
LGA    A    47_A      A    47_A    15.028     0    0.030   0.037    17.935    0.000    0.000
LGA    R    48_A      R    48_A    21.943     0    0.015   0.868    27.022    0.000    0.000
LGA    Q    49_A      Q    49_A    24.839     0    0.086   1.293    27.160    0.000    0.000
LGA    M    50_A      M    50_A    21.335     0    0.221   1.033    22.486    0.000    0.000
LGA    L    51_A      L    51_A    22.096     0    0.103   0.171    24.948    0.000    0.000
LGA    R    52_A      R    52_A    29.131     0    0.033   1.366    36.508    0.000    0.000
LGA    P    53_A      P    53_A    30.489     0    0.049   0.316    30.535    0.000    0.000
LGA    M    54_A      M    54_A    25.501     0    0.076   1.148    26.762    0.000    0.000
LGA    F    55_A      F    55_A    27.177     0    0.022   1.375    30.247    0.000    0.000
LGA    R    56_A      R    56_A    33.980     0    0.016   1.113    39.812    0.000    0.000
LGA    E    57_A      E    57_A    33.150     0    0.059   0.724    33.327    0.000    0.000
LGA    M    58_A      M    58_A    28.850     0    0.022   0.420    30.436    0.000    0.000
LGA    M    59_A      M    59_A    33.263     0    0.028   1.003    36.718    0.000    0.000
LGA    S    60_A      S    60_A    38.660     0    0.071   0.181    40.168    0.000    0.000
LGA    N    61_A      N    61_A    35.886     0    0.035   0.928    36.223    0.000    0.000
LGA    P    62_A      P    62_A    33.442     0    0.383   0.421    37.142    0.000    0.000
LGA    E    63_A      E    63_A    30.768     0    0.052   1.314    34.686    0.000    0.000
LGA    S    64_A      S    64_A    24.108     0    0.030   0.619    26.916    0.000    0.000
LGA    M    65_A      M    65_A    23.838     0    0.019   0.914    29.794    0.000    0.000
LGA    R    66_A      R    66_A    25.502     0    0.027   1.271    38.029    0.000    0.000
LGA    S    67_A      S    67_A    21.345     0    0.030   0.190    24.119    0.000    0.000
LGA    M    68_A      M    68_A    14.974     0    0.033   0.930    17.572    0.000    0.000
LGA    M    69_A      M    69_A    17.076     0    0.012   0.807    24.937    0.000    0.000
LGA    N    70_A      N    70_A    17.490     0    0.009   1.107    23.725    0.000    0.000
LGA    M    71_A      M    71_A    11.352     0    0.048   1.266    13.812    2.143    1.071
LGA    G    72_A      G    72_A     7.733     0    0.023   0.023     9.126    9.286    9.286
LGA    R    73_A      R    73_A    10.091     0    0.094   1.037    22.836    1.667    0.606
LGA    A    74_A      A    74_A    10.096     0    0.012   0.026    12.184    2.619    2.095
LGA    W    75_A      W    75_A     4.236     0    0.058   1.008    11.223   45.357   19.388
LGA    G    76_A      G    76_A     2.031     0    0.619   0.619     2.031   77.262   77.262
LGA    S    77_A      S    77_A     0.585     0    0.040   0.261     1.332   90.476   87.460
LGA    K    78_A      K    78_A     0.552     0    0.058   0.735     2.006   97.619   87.831
LGA    K    79_A      K    79_A     0.244     0    0.044   0.674     1.629  100.000   92.804
LGA    I    80_A      I    80_A     0.100     0    0.022   0.135     0.503  100.000   98.810
LGA    L    81_A      L    81_A     0.128     0    0.031   0.063     0.165  100.000  100.000
LGA    I    82_A      I    82_A     0.072     0    0.005   0.075     0.333  100.000  100.000
LGA    V    83_A      V    83_A     0.105     0    0.029   0.036     0.124  100.000  100.000
LGA    E    84_A      E    84_A     0.136     0    0.055   0.170     0.416  100.000  100.000
LGA    S    85_A      S    85_A     0.460     0    0.041   0.068     0.630  100.000   96.825
LGA    D    86_A      D    86_A     0.304     0    0.027   0.105     0.576  100.000   98.810
LGA    T    87_A      T    87_A     0.271     0    0.076   0.115     0.477  100.000  100.000
LGA    A    88_A      A    88_A     0.267     0    0.025   0.037     0.285  100.000  100.000
LGA    L    89_A      L    89_A     0.177     0    0.056   0.094     0.273  100.000  100.000
LGA    S    90_A      S    90_A     0.129     0    0.075   0.076     0.356  100.000  100.000
LGA    A    91_A      A    91_A     0.269     0    0.020   0.022     0.301  100.000  100.000
LGA    T    92_A      T    92_A     0.341     0    0.040   0.141     0.539  100.000   98.639
LGA    L    93_A      L    93_A     0.240     0    0.029   0.058     0.387  100.000  100.000
LGA    R    94_A      R    94_A     0.082     0    0.047   0.375     2.083  100.000   91.775
LGA    S    95_A      S    95_A     0.333     0    0.053   0.599     2.318  100.000   92.540
LGA    A    96_A      A    96_A     0.296     0    0.018   0.022     0.307  100.000  100.000
LGA    L    97_A      L    97_A     0.188     0    0.028   0.072     0.356  100.000  100.000
LGA    E    98_A      E    98_A     0.250     0    0.039   0.119     0.460  100.000  100.000
LGA    G    99_A      G    99_A     0.349     0    0.030   0.030     0.520   97.619   97.619
LGA    R   100_A      R   100_A     0.522     0    0.078   0.249     0.877   92.857   95.671
LGA    G   101_A      G   101_A     0.492     0    0.017   0.017     0.492  100.000  100.000
LGA    F   102_A      F   102_A     0.335     0    0.026   0.050     0.461  100.000  100.000
LGA    T   103_A      T   103_A     0.182     0    0.018   0.038     0.324  100.000  100.000
LGA    V   104_A      V   104_A     0.085     0    0.036   0.040     0.249  100.000  100.000
LGA    D   105_A      D   105_A     0.053     0    0.047   0.174     0.791  100.000   98.810
LGA    E   106_A      E   106_A     0.230     0    0.012   0.107     0.357  100.000  100.000
LGA    T   107_A      T   107_A     0.040     0    0.032   0.050     0.291  100.000  100.000
LGA    T   108_A      T   108_A     0.187     0    0.054   0.204     0.817  100.000   95.918
LGA    D   109_A      D   109_A     0.176     0    0.060   0.140     0.522  100.000   98.810
LGA    G   110_A      G   110_A     0.265     0    0.038   0.038     0.412  100.000  100.000
LGA    K   111_A      K   111_A     0.321     0    0.026   0.778     2.206  100.000   89.048
LGA    G   112_A      G   112_A     0.208     0    0.050   0.050     0.213  100.000  100.000
LGA    S   113_A      S   113_A     0.256     0    0.027   0.029     0.378  100.000  100.000
LGA    V   114_A      V   114_A     0.253     0    0.016   0.052     0.322  100.000  100.000
LGA    E   115_A      E   115_A     0.528     0    0.035   0.046     0.856   97.619   93.651
LGA    Q   116_A      Q   116_A     0.387     0    0.033   0.133     0.649  100.000   96.825
LGA    I   117_A      I   117_A     0.177     0    0.014   0.092     0.523  100.000   98.810
LGA    R   118_A      R   118_A     0.221     0    0.030   0.162     0.603  100.000   99.134
LGA    R   119_A      R   119_A     0.194     0    0.012   0.599     2.368  100.000   80.779
LGA    D   120_A      D   120_A     0.404     0    0.061   0.160     0.663   97.619   96.429
LGA    R   121_A      R   121_A     0.142     0    0.022   0.375     1.511  100.000   94.113
LGA    P   122_A      P   122_A     0.251     0    0.031   0.065     0.497  100.000  100.000
LGA    D   123_A      D   123_A     0.202     0    0.016   0.116     0.317  100.000  100.000
LGA    L   124_A      L   124_A     0.203     0    0.031   0.050     0.273  100.000  100.000
LGA    V   125_A      V   125_A     0.249     0    0.038   0.046     0.364  100.000  100.000
LGA    V   126_A      V   126_A     0.152     0    0.020   0.032     0.195  100.000  100.000
LGA    L   127_A      L   127_A     0.152     0    0.028   0.052     0.266  100.000  100.000
LGA    A   128_A      A   128_A     0.374     0    0.035   0.036     0.508  100.000   98.095
LGA    V   129_A      V   129_A     0.291     0    0.013   0.070     0.381  100.000  100.000
LGA    D   130_A      D   130_A     0.309     0    0.021   0.063     0.378  100.000  100.000
LGA    L   131_A      L   131_A     0.304     0    0.012   0.101     0.453  100.000  100.000
LGA    S   132_A      S   132_A     0.244     0    0.018   0.048     0.607  100.000   98.413
LGA    A   133_A      A   133_A     0.244     0    0.041   0.049     0.537   97.619   98.095
LGA    G   134_A      G   134_A     0.308     0    0.018   0.018     0.392  100.000  100.000
LGA    Q   135_A      Q   135_A     0.105     0    0.021   0.378     1.488  100.000   94.815
LGA    N   136_A      N   136_A     0.442     0    0.046   0.224     1.393  100.000   95.298
LGA    G   137_A      G   137_A     0.434     0    0.035   0.035     0.497  100.000  100.000
LGA    Y   138_A      Y   138_A     0.446     0    0.022   0.033     0.483  100.000  100.000
LGA    L   139_A      L   139_A     0.608     0    0.042   0.065     0.983   90.476   90.476
LGA    I   140_A      I   140_A     0.495     0    0.035   0.068     0.616   97.619   96.429
LGA    C   141_A      C   141_A     0.420     0    0.062   0.076     0.486  100.000  100.000
LGA    G   142_A      G   142_A     0.310     0    0.024   0.024     0.379  100.000  100.000
LGA    K   143_A      K   143_A     0.425     0    0.039   0.324     1.252  100.000   94.815
LGA    L   144_A      L   144_A     0.340     0    0.029   0.051     0.395  100.000  100.000
LGA    K   145_A      K   145_A     0.351     0    0.028   0.119     0.413  100.000  100.000
LGA    K   146_A      K   146_A     0.529     0    0.031   0.597     2.508   95.238   86.931
LGA    D   147_A      D   147_A     0.406     0    0.007   0.038     0.472  100.000  100.000
LGA    D   148_A      D   148_A     0.537     0    0.017   0.614     2.294   97.619   89.702
LGA    D   149_A      D   149_A     0.358     0    0.078   0.296     1.055   97.619   96.488
LGA    L   150_A      L   150_A     0.137     0    0.065   1.101     2.436  100.000   90.000
LGA    K   151_A      K   151_A     0.143     0    0.043   0.785     3.797  100.000   87.090
LGA    N   152_A      N   152_A     0.271     0    0.050   0.096     0.898  100.000   96.429
LGA    V   153_A      V   153_A     0.150     0    0.010   0.062     0.405  100.000  100.000
LGA    P   154_A      P   154_A     0.019     0    0.013   0.239     0.717  100.000   98.639
LGA    I   155_A      I   155_A     0.185     0    0.019   0.262     0.780  100.000   97.619
LGA    V   156_A      V   156_A     0.154     0    0.012   0.044     0.234  100.000  100.000
LGA    I   157_A      I   157_A     0.188     0    0.023   0.112     0.308  100.000  100.000
LGA    I   158_A      I   158_A     0.395     0    0.048   0.087     0.426  100.000  100.000
LGA    G   159_A      G   159_A     0.342     0    0.064   0.064     0.511   97.619   97.619
LGA    N   160_A      N   160_A     0.241     0    0.017   0.107     0.371  100.000  100.000
LGA    P   161_A      P   161_A     0.452     0    0.124   0.116     0.694  100.000   97.279
LGA    D   162_A      D   162_A     0.476     0    0.066   1.032     4.356   97.619   77.321
LGA    G   163_A      G   163_A     0.362     0    0.115   0.115     0.362  100.000  100.000
LGA    F   164_A      F   164_A     0.396     0    0.029   0.087     0.757   95.238   92.208
LGA    A   165_A      A   165_A     0.639     0    0.034   0.032     0.851   90.476   90.476
LGA    Q   166_A      Q   166_A     0.618     0    0.029   0.912     3.552   90.476   79.524
LGA    H   167_A      H   167_A     0.440     0    0.066   0.108     0.570  100.000   96.190
LGA    R   168_A      R   168_A     0.377     0    0.058   0.667     2.166   97.619   87.532
LGA    K   169_A      K   169_A     0.496     0    0.012   0.588     3.119  100.000   90.212
LGA    L   170_A      L   170_A     0.337     0    0.026   0.107     0.537  100.000   98.810
LGA    K   171_A      K   171_A     0.429     0    0.014   0.201     1.661  100.000   90.847
LGA    A   172_A      A   172_A     0.340     0    0.111   0.115     0.570   97.619   98.095
LGA    H   173_A      H   173_A     0.373     0    0.033   1.148     2.443  100.000   90.048
LGA    A   174_A      A   174_A     0.288     0    0.046   0.068     0.722   97.619   98.095
LGA    D   175_A      D   175_A     0.386     0    0.082   0.163     0.582   97.619   98.810
LGA    E   176_A      E   176_A     0.437     0    0.061   0.770     1.842  100.000   90.847
LGA    Y   177_A      Y   177_A     0.519     0    0.085   0.179     0.659   90.476   93.651
LGA    V   178_A      V   178_A     0.584     0    0.045   0.111     0.746   95.238   93.197
LGA    A   179_A      A   179_A     0.565     0    0.014   0.031     0.599   90.476   90.476
LGA    K   180_A      K   180_A     0.594     0    0.031   0.356     1.035   90.476   91.587
LGA    P   181_A      P   181_A     0.404     0    0.025   0.045     0.704   97.619   94.558
LGA    V   182_A      V   182_A     0.423     0    0.066   1.143     2.713  100.000   87.483
LGA    D   183_A      D   183_A     0.661     0    0.016   0.719     4.104   92.857   74.643
LGA    A   184_A      A   184_A     0.267     0    0.029   0.030     0.478  100.000  100.000
LGA    D   185_A      D   185_A     0.486     0    0.061   0.397     1.465   95.238   91.726
LGA    Q   186_A      Q   186_A     0.575     0    0.029   1.153     4.894   90.476   77.354
LGA    L   187_A      L   187_A     0.371     0    0.021   0.029     0.405  100.000  100.000
LGA    V   188_A      V   188_A     0.328     0    0.019   0.082     0.370  100.000  100.000
LGA    E   189_A      E   189_A     0.349     0    0.026   0.066     0.590  100.000   98.942
LGA    R   190_A      R   190_A     0.377     0    0.020   1.589     7.530  100.000   68.528
LGA    A   191_A      A   191_A     0.395     0    0.062   0.071     0.446  100.000  100.000
LGA    G   192_A      G   192_A     0.417     0    0.087   0.087     0.695   97.619   97.619
LGA    A   193_A      A   193_A     0.152     0    0.079   0.079     0.385  100.000  100.000
LGA    L   194_A      L   194_A     0.202     0    0.064   0.082     0.484  100.000  100.000
LGA    I   195_A      I   195_A     0.511     0    0.749   0.674     3.347   80.476   85.476
LGA    G   196_A      G   196_A     0.827     0    0.053   0.053     1.173   90.595   90.595
LGA    F   197_A      F   197_A     0.694     0    0.039   0.130     0.902   92.857   91.342
LGA    P   198_A      P   198_A     0.942     0    0.660   0.636     2.465   81.786   79.184
LGA    E   199_A      E   199_A     1.434     0    0.581   1.288     8.123   65.357   40.159
LGA    G   200_A      G   200_A     7.038     0    0.594   0.594     8.725   14.286   14.286
LGA    N   201_A      N   201_A     9.168     0    0.249   0.417    13.174    3.452    1.726
LGA    S   202_A      S   202_A     6.897     0    0.033   0.076     7.499   13.452   13.492
LGA    M   203_A      M   203_A     3.723     0    0.016   1.025     6.155   29.762   36.786
LGA    M   204_A      M   204_A     9.923     0    0.020   0.935    14.794    1.905    0.952
LGA    I   205_A      I   205_A    12.593     0    0.027   0.119    14.989    0.000    0.000
LGA    A   206_A      A   206_A     9.231     0    0.018   0.032     9.852    1.310    3.048
LGA    L   207_A      L   207_A     8.697     0    0.027   0.236    11.833    1.905    3.571
LGA    G   208_A      G   208_A    15.165     0    0.022   0.022    17.444    0.000    0.000
LGA    V   209_A      V   209_A    16.598     0    0.030   0.068    18.027    0.000    0.000
LGA    A   210_A      A   210_A    12.651     0    0.007   0.011    14.135    0.000    0.000
LGA    C   211_A      C   211_A    15.260     0    0.009   0.654    18.452    0.000    0.000
LGA    A   212_A      A   212_A    21.135     0    0.023   0.030    22.971    0.000    0.000
LGA    I   213_A      I   213_A    20.366     0    0.010   0.069    21.169    0.000    0.000
LGA    A   214_A      A   214_A    17.199     0    0.008   0.011    19.821    0.000    0.000
LGA    L   215_A      L   215_A    22.559     0    0.032   0.144    25.786    0.000    0.000
LGA    A   216_A      A   216_A    26.833     0    0.015   0.028    28.309    0.000    0.000
LGA    I   217_A      I   217_A    24.327     0    0.016   0.080    25.702    0.000    0.000
LGA    A   218_A      A   218_A    23.604     0    0.034   0.036    26.954    0.000    0.000
LGA    A   219_A      A   219_A    30.238     0    0.123   0.122    33.550    0.000    0.000
LGA    V   220_A      V   220_A    32.357     0    0.016   0.168    33.780    0.000    0.000
LGA    Y   221_A      Y   221_A    28.280     0    0.133   0.157    30.123    0.000    0.000
LGA    F   222_A      F   222_A    28.731     0    0.605   0.802    32.263    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):    15.058         15.059                 15.433           55.261   53.581

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  222  222    4.0    126    0.66    57.658    53.539    16.567

LGA_LOCAL      RMSD:   0.661  Number of atoms:  126  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  18.806  Number of assigned atoms:  222 
Std_ASGN_ATOMS RMSD:  15.058  Standard rmsd on all 222 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.124750 * X  +  -0.473240 * Y  +   0.872056 * Z  +  29.657068
  Y_new =  -0.002401 * X  +  -0.879063 * Y  +  -0.476700 * Z  +  38.499962
  Z_new =   0.992185 * X  +   0.057375 * Y  +  -0.110800 * Z  +  29.443041 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -0.019244 -1.445697  2.663788   [DEG:   -1.1026  -82.8323  152.6238 ]
ZXZ:  1.070537  1.681824  1.513034   [DEG:   61.3373   96.3614   86.6905 ]
 
# END of job
