
#######################################################
#                                                     #
#                        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  302 ( 2523),  selected  285 , name one
# Molecule2: number of CA atoms  285 ( 2384),  selected  285 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:B  -ch2:B  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   253      21_B - 273_B       5.00     6.82
  LCS_AVERAGE:     82.97

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    85      19_B - 103_B       1.93    10.07
  LONGEST_CONTINUOUS_SEGMENT:    85      20_B - 104_B       1.91     9.76
  LONGEST_CONTINUOUS_SEGMENT:    85      21_B - 105_B       1.93     9.13
  LCS_AVERAGE:     20.95

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    69      35_B - 103_B       0.99    10.28
  LCS_AVERAGE:     11.80

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  285
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     E    18_B     E    18_B      3    3  250      3    3    3    3    6   12   18   23   36   44   52   68   77  111  143  173  200  219  246  251 
LCS_GDT     N    19_B     N    19_B      3   85  251      3    3    3   12   19   24   32   36  105  119  133  144  192  205  224  234  241  247  254  261 
LCS_GDT     T    20_B     T    20_B      7   85  252      3    4    4   11   16   18   25   73  115  127  133  144  148  192  210  230  241  247  251  258 
LCS_GDT     Y    21_B     Y    21_B      7   85  253      3    6    8   10   18   24   32   36  105  147  180  189  204  214  226  237  244  249  255  261 
LCS_GDT     L    22_B     L    22_B      7   85  253      5    6   16   39  121  132  140  149  166  185  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     S    23_B     S    23_B      7   85  253      5   30   83  113  125  132  140  149  166  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     K    24_B     K    24_B      7   85  253      5   25   82  109  125  131  139  146  161  176  194  211  220  228  231  237  244  249  255  261 
LCS_GDT     S    25_B     S    25_B      8   85  253      5   10   39  107  124  131  140  146  164  178  198  212  220  228  231  237  244  249  255  261 
LCS_GDT     Q    26_B     Q    26_B      8   85  253      5   11   82  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Q    27_B     Q    27_B      8   85  253      3   21   86  113  125  132  140  146  166  178  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     D    28_B     D    28_B      8   85  253     15   42   81  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     T    29_B     T    29_B      8   85  253     17   52   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Q    30_B     Q    30_B      8   85  253      5   47   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     V    31_B     V    31_B      8   85  253      3   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     N    32_B     N    32_B      8   85  253     17   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     C    33_B     C    33_B      3   85  253      3    3    9   23   54   94  133  146  160  183  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Q    34_B     Q    34_B     40   85  253      3   19   57  103  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     L    35_B     L    35_B     69   85  253      8   40   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     K    36_B     K    36_B     69   85  253      7   47   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     I    37_B     I    37_B     69   85  253     18   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     N    38_B     N    38_B     69   85  253     11   50   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     S    39_B     S    39_B     69   85  253     11   50   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     S    40_B     S    40_B     69   85  253      7   29   83  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Q    41_B     Q    41_B     69   85  253     13   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     H    42_B     H    42_B     69   85  253     13   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     L    43_B     L    43_B     69   85  253     18   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     V    44_B     V    44_B     69   85  253      3   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     V    45_B     V    45_B     69   85  253      3   10   82  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     N    46_B     N    46_B     69   85  253     17   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     S    47_B     S    47_B     69   85  253      5   44   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Q    48_B     Q    48_B     69   85  253     17   52   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     T    49_B     T    49_B     69   85  253     17   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     R    50_B     R    50_B     69   85  253     17   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     D    51_B     D    51_B     69   85  253     17   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     C    52_B     C    52_B     69   85  253     18   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     F    53_B     F    53_B     69   85  253     18   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     E    54_B     E    54_B     69   85  253     18   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Y    55_B     Y    55_B     69   85  253     17   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     F    56_B     F    56_B     69   85  253     11   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     I    57_B     I    57_B     69   85  253     11   52   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     T    58_B     T    58_B     69   85  253     11   50   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Q    59_B     Q    59_B     69   85  253     11   48   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Y    60_B     Y    60_B     69   85  253      9   52   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     G    61_B     G    61_B     69   85  253      9   50   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     E    62_B     E    62_B     69   85  253     17   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     S    63_B     S    63_B     69   85  253     17   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     N    64_B     N    64_B     69   85  253     17   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     L    65_B     L    65_B     69   85  253     17   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Q    66_B     Q    66_B     69   85  253     13   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     K    67_B     K    67_B     69   85  253     13   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     V    68_B     V    68_B     69   85  253     13   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     K    69_B     K    69_B     69   85  253     15   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     T    70_B     T    70_B     69   85  253     18   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     H    71_B     H    71_B     69   85  253     17   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     F    72_B     F    72_B     69   85  253     14   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     E    73_B     E    73_B     69   85  253     18   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     K    74_B     K    74_B     69   85  253     12   48   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     F    75_B     F    75_B     69   85  253     12   41   85  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     I    76_B     I    76_B     69   85  253     12   44   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Q    77_B     Q    77_B     69   85  253     10   48   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     D    78_B     D    78_B     69   85  253     10   34   83  113  125  132  140  146  166  181  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Q    79_B     Q    79_B     69   85  253     12   40   84  113  125  132  140  149  166  185  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Y    80_B     Y    80_B     69   85  253     18   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     L    81_B     L    81_B     69   85  253     11   41   86  113  125  132  140  146  166  184  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     E    82_B     E    82_B     69   85  253     11   30   83  113  125  132  140  146  161  177  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     P    83_B     P    83_B     69   85  253     18   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     A    84_B     A    84_B     69   85  253     22   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     R    85_B     R    85_B     69   85  253     22   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     S    86_B     S    86_B     69   85  253     22   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Q    87_B     Q    87_B     69   85  253     22   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     I    88_B     I    88_B     69   85  253     22   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     I    89_B     I    89_B     69   85  253     22   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     D    90_B     D    90_B     69   85  253     22   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     L    91_B     L    91_B     69   85  253     22   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     W    92_B     W    92_B     69   85  253     22   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     T    93_B     T    93_B     69   85  253     20   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     R    94_B     R    94_B     69   85  253     22   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Y    95_B     Y    95_B     69   85  253     22   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     L    96_B     L    96_B     69   85  253     22   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     K    97_B     K    97_B     69   85  253     13   41   85  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Y    98_B     Y    98_B     69   85  253     18   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     R    99_B     R    99_B     69   85  253     22   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     E   100_B     E   100_B     69   85  253     22   48   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Q   101_B     Q   101_B     69   85  253     22   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     L   102_B     L   102_B     69   85  253     22   53   86  113  125  132  140  148  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     A   103_B     A   103_B     69   85  253      9   48   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Q   104_B     Q   104_B      7   85  253      5   19   35   48   69   89  117  147  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     I   105_B     I   105_B      7   85  253      5    6    9   42   61   83  103  128  163  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Q   106_B     Q   106_B      7   11  253      5    6    9   27   43   78  103  128  162  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     P   107_B     P   107_B      7   11  253      5    6    9   10   19   31   69  107  150  183  198  211  220  228  231  237  244  249  255  261 
LCS_GDT     S   108_B     S   108_B      7   11  253      5    6    9   10   19   31   39   43   45  138  189  203  214  227  231  235  242  249  254  261 
LCS_GDT     Q   109_B     Q   109_B      7   11  253      3    6    9   10   19   23   39   43   45  153  189  203  214  226  231  235  241  247  254  260 
LCS_GDT     S   110_B     S   110_B      7   11  253      3    5    8   13   19   34   66  113  154  183  198  211  220  228  231  237  244  249  255  261 
LCS_GDT     K   111_B     K   111_B      3    9  253      3   11   29   55   88  118  133  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Q   112_B     Q   112_B      3   45  253      3    3    4    5   44  108  131  146  166  178  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Q   113_B     Q   113_B     21   47  253      8   48   86  113  125  132  140  146  153  160  172  190  211  223  230  237  244  249  255  261 
LCS_GDT     D   114_B     D   114_B     21   47  253     11   48   86  113  125  132  140  146  153  162  183  203  215  224  231  237  244  249  255  261 
LCS_GDT     Q   115_B     Q   115_B     21   47  253     14   37   82  113  125  132  140  149  167  184  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     N   116_B     N   116_B     21   47  253      9   45   81  113  125  132  140  149  166  184  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Y   117_B     Y   117_B     21   47  253     22   53   86  113  125  132  140  146  153  167  186  207  217  225  231  237  244  249  255  261 
LCS_GDT     F   118_B     F   118_B     21   47  253     13   50   86  113  125  132  140  146  155  175  196  212  220  228  231  237  244  249  255  261 
LCS_GDT     Q   119_B     Q   119_B     21   47  253     21   52   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     K   120_B     K   120_B     21   47  253     17   53   86  113  125  132  140  146  161  178  199  212  220  228  231  237  244  249  255  261 
LCS_GDT     V   121_B     V   121_B     21   47  253     11   53   86  113  125  132  140  146  154  175  196  211  220  228  231  237  244  249  255  261 
LCS_GDT     F   122_B     F   122_B     21   47  253     22   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     N   123_B     N   123_B     21   47  253     17   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     S   124_B     S   124_B     21   47  253      9   53   86  113  125  132  140  146  161  181  200  212  220  228  231  237  244  249  255  261 
LCS_GDT     I   125_B     I   125_B     21   47  253     22   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Q   126_B     Q   126_B     21   47  253     22   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     D   127_B     D   127_B     21   47  253     21   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     I   128_B     I   128_B     21   47  253     22   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     R   129_B     R   129_B     21   47  253      9   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     K   130_B     K   130_B     21   47  253      9   52   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     R   131_B     R   131_B     21   47  253     22   53   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     F   132_B     F   132_B     21   47  253     17   52   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     F   133_B     F   133_B     21   47  253      6   34   83  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     S   134_B     S   134_B      3   47  253      0    6   40   82  117  129  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     A   135_B     A   135_B     13   54  253      3    4   14   51   99  122  129  141  152  173  196  212  220  228  231  237  244  249  255  261 
LCS_GDT     S   136_B     S   136_B     18   58  253     10   32   83  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     E   137_B     E   137_B     18   58  253     11   35   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     I   138_B     I   138_B     19   58  253     11   46   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     E   139_B     E   139_B     19   58  253     11   35   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     G   140_B     G   140_B     19   58  253     11   47   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     L   141_B     L   141_B     21   58  253     11   47   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     F   142_B     F   142_B     21   58  253     11   35   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     S   143_B     S   143_B     21   58  253     11   44   86  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     T   144_B     T   144_B     21   58  253     11   33   84  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     E   145_B     E   145_B     34   58  253     11   35   84  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     D   146_B     D   146_B     34   58  253     11   32   84  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     I   147_B     I   147_B     34   58  253      9   30   72  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Y   148_B     Y   148_B     34   58  253      9   30   83  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Q   149_B     Q   149_B     34   58  253      9   40   83  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     N   150_B     N   150_B     34   58  253      9   35   80  112  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Y   151_B     Y   151_B     34   58  253     11   40   81  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     T   152_B     T   152_B     34   58  253     16   39   80  112  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     L   153_B     L   153_B     34   58  253     13   35   76  111  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     D   154_B     D   154_B     34   58  253     13   28   55   91  120  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     R   155_B     R   155_B     34   58  253     13   35   55   91  120  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     M   156_B     M   156_B     34   58  253     13   28   49   86  116  131  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     K   157_B     K   157_B     34   58  253     13   28   43   77  112  128  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     I   158_B     I   158_B     34   58  253     13   28   43   69  105  126  137  148  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     L   159_B     L   159_B     34   58  253     13   28   43   61   99  123  136  148  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     E   160_B     E   160_B     34   58  253     11   28   43   61   99  123  136  148  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     D   161_B     D   161_B     34   58  253      4   28   43   57   72  100  126  147  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     S   162_B     S   162_B     34   58  253      3    6   33   58   76  112  132  143  163  180  196  212  220  228  231  237  244  249  255  261 
LCS_GDT     S   163_B     S   163_B     34   58  253      3   28   43   52   71   89  109  132  160  185  200  212  220  228  231  237  244  249  255  261 
LCS_GDT     L   164_B     L   164_B     34   58  253      3    5   31   42   55   75   89  108  132  171  193  207  216  227  231  235  242  249  254  260 
LCS_GDT     S   165_B     S   165_B     34   58  253      3   28   43   51   71   84  109  125  160  183  200  212  220  228  231  237  244  249  255  261 
LCS_GDT     E   166_B     E   166_B     34   58  253      4   21   41   51   71   89  109  138  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     I   167_B     I   167_B     34   58  253      9   28   43   59   82  111  132  144  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     E   168_B     E   168_B     34   58  253     13   28   43   59   75  100  131  143  160  183  200  212  220  228  231  237  244  249  255  261 
LCS_GDT     K   169_B     K   169_B     34   58  253     13   28   43   59   87  116  134  147  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     A   170_B     A   170_B     34   58  253     13   28   47   71  105  127  137  147  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     K   171_B     K   171_B     34   58  253     13   28   47   72  105  127  137  147  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     K   172_B     K   172_B     34   58  253     13   28   43   68  105  127  137  147  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     L   173_B     L   173_B     34   58  253     13   30   55   86  116  131  140  148  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     K   174_B     K   174_B     34   58  253     13   32   57   91  120  132  140  148  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     E   175_B     E   175_B     34   58  253     11   28   53   86  120  132  140  148  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     R   176_B     R   176_B     34   58  253     11   28   53   86  120  132  140  148  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     F   177_B     F   177_B     34   58  253     11   35   72  107  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     E   178_B     E   178_B     34   58  253     10   28   72  107  125  132  140  148  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Q   179_B     Q   179_B     32   58  253      5   25   43   88  120  132  140  148  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     L   180_B     L   180_B     19   58  253     11   35   76  111  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     P   181_B     P   181_B     19   58  253      5   28   78  112  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     E   182_B     E   182_B     19   58  253      6   14   58  113  125  131  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     D   183_B     D   183_B     19   58  253      7   14   59  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     W   184_B     W   184_B     19   58  253      6   24   82  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Q   185_B     Q   185_B     19   58  253      9   31   83  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     E   186_B     E   186_B     19   58  253      9   27   77  112  125  131  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     N   187_B     N   187_B     19   58  253      9   51   83  113  125  132  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     L   188_B     L   188_B     19   58  253      9   31   71  104  125  131  140  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Q   189_B     Q   189_B     19   58  253      9   35   64   98  116  129  137  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     E   190_B     E   190_B     19   58  253      9   21   57   92  113  128  136  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     L   191_B     L   191_B     19   58  253      9   14   42   83  102  122  135  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     S   192_B     S   192_B     19   58  253      9   14   32   68   94  111  130  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     K   193_B     K   193_B     19   58  253      9   14   32   61   85  104  125  149  166  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     L   194_B     L   194_B     17   58  253      9   14   20   36   54   71   97  135  155  179  200  212  220  228  231  237  244  249  255  261 
LCS_GDT     D   195_B     D   195_B     15   57  253      9   12   20   51   75  102  117  145  165  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     D   196_B     D   196_B     15   40  253      9   18   36   57   83  102  121  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     L   197_B     L   197_B     16   37  253      9   12   20   51   72   96  117  140  163  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     H   198_B     H   198_B     19   37  253      9   15   20   29   40   57   94  130  146  183  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     T   199_B     T   199_B     19   37  253      9   12   20   35   75   96  114  130  163  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     L   200_B     L   200_B     19   37  253      9   12   20   35   75   96  114  130  158  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     T   201_B     T   201_B     19   37  253      5   15   20   27   49   96  114  130  160  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     K   202_B     K   202_B     19   37  253      8   15   20   27   43   65  106  130  160  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Q   203_B     Q   203_B     19   37  253      8   15   20   27   46   68  106  130  147  183  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     I   204_B     I   204_B     19   37  253      8   15   20   26   49   65   85  121  144  181  198  211  220  228  231  237  244  249  255  261 
LCS_GDT     K   205_B     K   205_B     19   37  253      8   15   20   27   43   65   85  121  158  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     A   206_B     A   206_B     19   37  253      6   15   20   27   43   65  106  121  160  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     R   207_B     R   207_B     19   37  253      4    8   17   27   43   65   85  108  140  178  197  209  220  228  231  237  244  249  255  261 
LCS_GDT     N   208_B     N   208_B     19   37  253      8   15   20   26   49   65   85  108  140  181  198  212  220  228  231  237  244  249  255  261 
LCS_GDT     G   209_B     G   209_B     19   37  253      8   15   20   38   49   65   85   97  128  142  187  205  219  228  231  237  244  249  255  261 
LCS_GDT     S   210_B     S   210_B     19   37  253      6   15   20   26   33   65   81   94  111  136  160  200  214  224  231  236  243  249  255  261 
LCS_GDT     A   211_B     A   211_B     19   37  253      8   15   20   26   49   65   81   97  116  145  185  200  219  228  231  237  244  249  255  261 
LCS_GDT     E   212_B     E   212_B     19   37  253      8   15   20   26   49   65   81   94  116  145  160  177  214  224  231  236  243  249  255  261 
LCS_GDT     E   213_B     E   213_B     19   37  253      7   15   20   26   33   65   81   94  117  136  160  180  207  224  231  236  243  249  255  261 
LCS_GDT     L   214_B     L   214_B     19   39  253      7   15   27   38   49   68   95  130  144  178  198  212  220  228  231  237  244  249  255  261 
LCS_GDT     R   215_B     R   215_B     19   39  253      7   15   27   38   56   86  113  130  144  181  198  212  220  228  231  237  244  249  255  261 
LCS_GDT     Q   216_B     Q   216_B     19   39  253      7   15   20   26   32   48   85  105  133  145  170  194  215  228  231  237  244  249  255  261 
LCS_GDT     M   217_B     M   217_B     26   39  253      6   15   22   31   37   66   85  111  133  153  171  204  218  228  231  237  244  249  255  261 
LCS_GDT     R   218_B     R   218_B     26   39  253      7   16   27   46   71   96  115  131  159  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     T   219_B     T   219_B     26   39  253      7   19   27   46   68   96  114  130  152  185  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     A   220_B     A   220_B     26   39  253      6   17   27   33   37   44   85  111  128  148  165  194  218  228  231  237  244  249  255  261 
LCS_GDT     L   221_B     L   221_B     26   39  253      7   20   27   33   37   42   86  107  128  148  172  205  218  228  231  237  244  249  255  261 
LCS_GDT     V   222_B     V   222_B     26   39  253     11   20   27   33   64  102  117  139  165  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     G   223_B     G   223_B     26   39  253     11   20   27   46   83  102  120  148  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     A   224_B     A   224_B     26   39  253     11   20   36   57   83  102  121  148  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     E   225_B     E   225_B     26   39  253     11   20   36   59   83  107  128  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     A   226_B     A   226_B     26   39  253     11   20   34   59   85  109  128  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     T   227_B     T   227_B     26   39  253     11   20   36   57   83  102  122  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Q   228_B     Q   228_B     26   39  253     11   20   36   57   83  102  124  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     R   229_B     R   229_B     26   39  253     11   20   37   59   85  109  128  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     L   230_B     L   230_B     26   39  253     11   20   31   57   83  102  128  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     E   231_B     E   231_B     26   47  253     11   20   36   56   83  102  123  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     T   232_B     T   232_B     26   47  253      6   20   36   57   83  102  128  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     L   233_B     L   233_B     26   47  253     10   20   31   57   83  102  128  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     D   234_B     D   234_B     26   52  253     11   20   28   54   77  102  122  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     I   235_B     I   235_B     26   58  253      8   20   31   54   77  102  123  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Q   236_B     Q   236_B     26   58  253      8   20   35   54   83  102  128  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     R   237_B     R   237_B     26   58  253     10   20   31   46   77   97  120  149  166  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     N   238_B     N   238_B     26   58  253     10   20   31   39   59   83  114  142  165  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     A   239_B     A   239_B     26   58  253     10   23   35   42   77   97  125  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     W   240_B     W   240_B     32   58  253      7   29   35   46   77  102  127  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Q   241_B     Q   241_B     32   58  253      9   24   35   42   50   55   82  128  155  178  201  211  220  228  231  237  244  249  255  261 
LCS_GDT     Q   242_B     Q   242_B     33   58  253      5   24   35   42   53   86  106  135  163  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     R   243_B     R   243_B     34   58  253     11   29   35   48   77   99  127  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     V   244_B     V   244_B     34   58  253     12   29   35   54   77   98  127  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     T   245_B     T   245_B     34   58  253     12   29   35   42   53   86  106  129  163  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     G   246_B     G   246_B     34   58  253     12   29   35   42   57   86  110  143  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Y   247_B     Y   247_B     34   58  253     12   29   41   55   75   99  128  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     L   248_B     L   248_B     34   58  253     11   29   35   45   75   97  126  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     N   249_B     N   249_B     34   58  253     12   29   35   42   57   86  110  143  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     Q   250_B     Q   250_B     34   58  253     12   29   41   57   72   89  117  144  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     R   251_B     R   251_B     34   58  253     12   29   39   55   72  103  128  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     D   252_B     D   252_B     34   58  253     12   29   35   51   70   96  126  148  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     E   253_B     E   253_B     34   58  253     12   29   39   57   72   89  111  143  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     V   254_B     V   254_B     34   58  253     12   29   35   43   72   89  109  143  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     L   255_B     L   255_B     34   58  253     12   28   37   55   71  104  128  149  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     H   256_B     H   256_B     34   58  253     12   26   41   55   72   89  125  147  167  186  201  212  220  228  231  237  244  249  255  261 
LCS_GDT     S   257_B     S   257_B     34   58  253      5   29   35   56   72   89   98  132  164  186  200  212  220  228  231  237  244  249  255  261 
LCS_GDT     N   258_B     N   258_B     34   58  253      3    3    3   36   48   55   60   64   71   89  164  200  215  224  231  237  244  249  255  261 
LCS_GDT     M   259_B     M   259_B     34   58  253      9   29   35   42   50   55   60   64   71   76   80   98  181  206  227  236  244  249  255  261 
LCS_GDT     S   260_B     S   260_B     34   58  253     11   29   35   42   50   55   60   64   71   76   78  157  163  183  200  216  233  249  255  261 
LCS_GDT     D   261_B     D   261_B     34   58  253     14   29   35   42   50   55   60   64   71   76  148  157  172  191  206  220  234  248  255  261 
LCS_GDT     S   262_B     S   262_B     34   58  253     14   29   35   42   50   55   60   64   71   76   78   80   87   98  124  138  153  208  223  233 
LCS_GDT     A   263_B     A   263_B     34   58  253     14   28   35   42   50   55   60   64   71   76   78   80   90   98  103  137  145  185  222  240 
LCS_GDT     K   264_B     K   264_B     34   58  253     14   29   35   42   50   55   60   64   71  106  145  170  189  206  226  236  244  249  255  261 
LCS_GDT     K   265_B     K   265_B     34   58  253     14   29   35   42   50   55   60   64   71   76   78  157  163  184  204  215  230  245  255  261 
LCS_GDT     Q   266_B     Q   266_B     34   58  253     14   29   35   42   50   55   60   64   71   76   78   80   87   98  103  105  145  185  218  235 
LCS_GDT     A   267_B     A   267_B     34   58  253     14   29   35   42   50   55   60   64   71   76   78   81   98  111  130  208  223  242  252  258 
LCS_GDT     I   268_B     I   268_B     34   58  253     14   29   35   42   50   55   60   64   98  124  162  180  207  221  229  237  244  249  255  261 
LCS_GDT     Q   269_B     Q   269_B     34   58  253     14   29   35   42   50   55   60   64   71   76   78   81   91  173  190  201  216  233  249  261 
LCS_GDT     Q   270_B     Q   270_B     34   58  253     14   29   35   42   50   55   60   64   71   76   78   81   91  100  103  137  153  212  237  250 
LCS_GDT     L   271_B     L   271_B     34   58  253     14   29   35   42   50   55   60   64   71   76  155  175  199  221  230  237  244  249  255  261 
LCS_GDT     R   272_B     R   272_B     34   58  253     14   29   35   42   50   55   60   79   98  124  165  181  207  221  229  237  244  249  255  261 
LCS_GDT     Q   273_B     Q   273_B     34   58  253     14   29   35   42   50   55   60   64   71   76   78   81   91  100  110  201  214  229  247  255 
LCS_GDT     Q   274_B     Q   274_B     34   58  102     14   29   35   42   50   55   60   64   71   76   78   81   91  111  151  213  233  243  252  260 
LCS_GDT     Q   275_B     Q   275_B     34   58  102     14   28   35   42   50   55   79  113  147  173  195  211  220  228  231  237  244  249  255  261 
LCS_GDT     F   276_B     F   276_B     34   58  102     14   28   35   42   50   55   62   79  143  162  183  202  215  224  231  237  244  249  255  261 
LCS_GDT     S   277_B     S   277_B     31   58  102      5   23   32   40   48   54   57   63   68   89  126  145  163  176  211  224  242  249  255  261 
LCS_GDT     S   278_B     S   278_B     20   58  102      5   11   20   31   41   51   55   59   62  113  145  150  170  188  207  219  231  238  252  261 
LCS_GDT     S   279_B     S   279_B     14   58  102      3    7   14   28   39   51   55   59   62   64   68   72  150  170  174  201  214  221  235  248 
LCS_GDT     Q   280_B     Q   280_B     13   58  102      5   23   35   42   51   75  104  118  127  141  153  164  170  185  196  212  222  233  249  258 
LCS_GDT     E   281_B     E   281_B     13   58  102      7   23   35   42   74  113  128  142  152  162  178  194  201  214  226  236  244  249  255  261 
LCS_GDT     Q   282_B     Q   282_B     13   58  102      7   23   32   41   60   93  125  142  152  162  176  194  200  214  226  236  244  249  255  261 
LCS_GDT     L   283_B     L   283_B     13   58  102      7   20   44   57   74  110  125  140  152  160  165  181  193  204  214  227  239  249  255  261 
LCS_GDT     R   284_B     R   284_B     13   58  102      7   23   32   59   79  113  128  142  152  162  178  194  201  212  225  235  243  249  255  261 
LCS_GDT     L   285_B     L   285_B     13   58  102      7   23   38   61   85  114  130  142  155  176  186  197  210  220  229  237  244  249  255  261 
LCS_GDT     R   286_B     R   286_B     13   58  102      7   20   32   61   85  113  130  142  152  168  184  194  203  216  226  237  244  249  255  261 
LCS_GDT     T   287_B     T   287_B     13   58  102      7   20   32   39   49   55  119  136  152  162  175  187  200  212  224  235  243  249  255  261 
LCS_GDT     F   288_B     F   288_B     13   58  102      7   23   32   42   52   70  100  130  152  170  184  195  207  218  228  237  244  249  255  261 
LCS_GDT     E   289_B     E   289_B     13   58  102      9   23   34   42   69   97  117  135  155  174  186  197  207  218  229  237  244  249  255  261 
LCS_GDT     T   290_B     T   290_B     13   58  102      7   23   32   42   50   55   75   89  144  158  175  185  199  212  224  234  241  249  254  261 
LCS_GDT     V   291_B     V   291_B     12   58  102      7   20   32   42   50   55   60   80  103  121  142  158  191  211  223  234  241  248  254  261 
LCS_GDT     H   292_B     H   292_B      3   58   99      3    3   10   22   33   46   58   80  102  123  153  168  189  211  218  226  239  247  252  261 
LCS_GDT     D   293_B     D   293_B      3    5   95      3    4    9   13   18   26   33   57   89  101  110  123  142  160  169  184  195  203  215  223 
LCS_GDT     Q   294_B     Q   294_B      4    6   93      3    3    4    5    6   31   39   43   44   62   76   91  130  147  155  165  172  180  210  217 
LCS_GDT     G   295_B     G   295_B      4    6   93      3    3    4   12   19   31   39   72   89  101  110  122  137  147  167  184  195  201  213  220 
LCS_GDT     G   296_B     G   296_B      4    6   93      3    3    4    5    6    6    7   21   45   54   60   67  130  147  167  184  195  201  213  222 
LCS_GDT     E   297_B     E   297_B      4    6   93      3    4    4    5    6    6    7    8   13   14   14   19   20   45   67  115  122  191  199  203 
LCS_GDT     L   298_B     L   298_B      4    6   91      3    4    4    5    6    6    7    8    9    9   11   12   17   18   19   32   33   34   38   41 
LCS_GDT     P   299_B     P   299_B      4    6   89      3    4    4    5    6    6    7    8    9   11   12   13   17   18   27   32   33   34   38   41 
LCS_GDT     F   300_B     F   300_B      4    6   15      3    4    4    4    5    6    7    9   10   11   12   13   17   18   19   22   25   28   28   41 
LCS_GDT     N   301_B     N   301_B      3    6   15      3    3    4    5    5    6    7    8    9   11   12   13   15   16   16   19   20   20   23   23 
LCS_GDT     Y   302_B     Y   302_B      3    4   15      3    3    3    5    5    6    7    8    9   11   12   14   15   16   17   19   20   20   36   36 
LCS_AVERAGE  LCS_A:  38.57  (  11.80   20.95   82.97 )

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     22     53     86    113    125    132    140    149    167    186    201    212    220    228    231    237    244    249    255    261 
GDT PERCENT_AT   7.72  18.60  30.18  39.65  43.86  46.32  49.12  52.28  58.60  65.26  70.53  74.39  77.19  80.00  81.05  83.16  85.61  87.37  89.47  91.58
GDT RMS_LOCAL    0.35   0.67   0.99   1.24   1.42   1.62   1.79   2.72   3.00   3.31   3.51   3.70   3.83   4.00   4.07   4.23   4.44   4.57   4.80   5.00
GDT RMS_ALL_AT  10.43   9.46   9.52   9.39   9.35   9.34   9.06   6.66   6.90   6.99   6.92   6.97   6.99   7.01   6.97   6.90   6.81   6.85   6.73   6.70

# Checking swapping
#   possible swapping detected:  Y    21_B      Y    21_B
#   possible swapping detected:  E    54_B      E    54_B
#   possible swapping detected:  F    56_B      F    56_B
#   possible swapping detected:  Y    60_B      Y    60_B
#   possible swapping detected:  E    62_B      E    62_B
#   possible swapping detected:  F    75_B      F    75_B
#   possible swapping detected:  Y    80_B      Y    80_B
#   possible swapping detected:  D    90_B      D    90_B
#   possible swapping detected:  Y    98_B      Y    98_B
#   possible swapping detected:  F   118_B      F   118_B
#   possible swapping detected:  F   122_B      F   122_B
#   possible swapping detected:  F   132_B      F   132_B
#   possible swapping detected:  E   137_B      E   137_B
#   possible swapping detected:  E   145_B      E   145_B
#   possible swapping detected:  Y   148_B      Y   148_B
#   possible swapping detected:  E   160_B      E   160_B
#   possible swapping detected:  E   168_B      E   168_B
#   possible swapping detected:  E   175_B      E   175_B
#   possible swapping detected:  F   177_B      F   177_B
#   possible swapping detected:  E   190_B      E   190_B
#   possible swapping detected:  E   212_B      E   212_B
#   possible swapping detected:  E   213_B      E   213_B
#   possible swapping detected:  E   231_B      E   231_B
#   possible swapping detected:  E   253_B      E   253_B
#   possible swapping detected:  E   281_B      E   281_B
#   possible swapping detected:  D   293_B      D   293_B
#   possible swapping detected:  Y   302_B      Y   302_B

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    E    18_B      E    18_B    15.271     0    0.682   0.642    16.810    0.000    0.000
LGA    N    19_B      N    19_B    10.332     0    0.565   0.572    12.112    1.310    0.893
LGA    T    20_B      T    20_B    11.079     0    0.672   0.611    14.458    0.119    0.068
LGA    Y    21_B      Y    21_B     8.299     0    0.113   0.531    14.014    8.571    3.294
LGA    L    22_B      L    22_B     3.850     0    0.052   1.125     5.425   34.762   43.333
LGA    S    23_B      S    23_B     2.917     0    0.031   0.641     3.197   53.571   54.841
LGA    K    24_B      K    24_B     4.693     0    0.081   0.843     6.588   33.095   24.762
LGA    S    25_B      S    25_B     4.425     0    0.193   0.586     4.430   38.690   38.175
LGA    Q    26_B      Q    26_B     3.213     0    0.138   0.959     3.679   45.000   60.688
LGA    Q    27_B      Q    27_B     4.121     0    0.595   1.237     8.153   32.738   24.974
LGA    D    28_B      D    28_B     2.166     0    0.027   1.031     3.721   64.762   61.131
LGA    T    29_B      T    29_B     2.629     0    0.057   0.957     4.067   57.143   53.265
LGA    Q    30_B      Q    30_B     2.581     0    0.056   1.138     7.136   57.143   41.111
LGA    V    31_B      V    31_B     2.770     0    0.559   1.312     5.458   47.619   51.088
LGA    N    32_B      N    32_B     1.338     0    0.745   1.222     3.646   75.119   66.429
LGA    C    33_B      C    33_B     5.003     0    0.387   0.727     9.557   39.167   27.381
LGA    Q    34_B      Q    34_B     1.735     0    0.352   0.602     4.286   68.929   57.037
LGA    L    35_B      L    35_B     1.817     0    0.173   0.873     3.025   70.833   69.167
LGA    K    36_B      K    36_B     2.342     0    0.127   0.689     5.214   64.762   52.857
LGA    I    37_B      I    37_B     2.726     0    0.029   0.161     3.193   57.143   57.202
LGA    N    38_B      N    38_B     2.678     0    0.069   0.945     6.009   57.143   48.869
LGA    S    39_B      S    39_B     3.172     0    0.399   0.384     4.405   46.786   50.238
LGA    S    40_B      S    40_B     2.866     0    0.697   1.002     5.538   46.429   47.698
LGA    Q    41_B      Q    41_B     2.188     0    0.146   0.845     3.862   66.786   57.619
LGA    H    42_B      H    42_B     2.465     0    0.124   1.149     5.708   62.857   50.714
LGA    L    43_B      L    43_B     2.227     0    0.119   1.164     3.094   64.762   61.012
LGA    V    44_B      V    44_B     2.331     0    0.086   0.097     4.275   75.357   63.673
LGA    V    45_B      V    45_B     2.049     0    0.127   0.184     3.813   68.810   59.796
LGA    N    46_B      N    46_B     0.757     0    0.036   1.138     4.925   85.952   73.452
LGA    S    47_B      S    47_B     1.326     0    0.121   0.590     1.896   85.952   83.016
LGA    Q    48_B      Q    48_B     0.921     0    0.049   0.821     3.378   90.476   81.058
LGA    T    49_B      T    49_B     0.345     0    0.015   1.107     2.501   97.619   87.483
LGA    R    50_B      R    50_B     1.038     0    0.077   0.353     1.465   83.690   83.896
LGA    D    51_B      D    51_B     1.358     0    0.030   1.229     3.308   81.429   75.357
LGA    C    52_B      C    52_B     0.837     0    0.042   0.100     1.286   88.214   87.460
LGA    F    53_B      F    53_B     0.576     0    0.063   0.442     1.341   88.214   88.095
LGA    E    54_B      E    54_B     1.445     0    0.021   1.064     3.354   77.143   68.783
LGA    Y    55_B      Y    55_B     2.185     0    0.053   0.235     4.734   66.786   52.619
LGA    F    56_B      F    56_B     1.811     0    0.061   1.137     7.358   72.857   48.788
LGA    I    57_B      I    57_B     1.474     0    0.036   0.143     1.662   75.000   78.214
LGA    T    58_B      T    58_B     2.044     0    0.044   0.099     2.474   66.786   65.918
LGA    Q    59_B      Q    59_B     2.228     0    0.103   0.917     2.782   68.810   65.714
LGA    Y    60_B      Y    60_B     1.353     0    0.630   1.141     8.137   73.214   48.056
LGA    G    61_B      G    61_B     1.757     0    0.060   0.060     2.297   68.810   68.810
LGA    E    62_B      E    62_B     1.752     0    0.042   1.274     4.799   72.857   61.005
LGA    S    63_B      S    63_B     1.453     0    0.064   0.721     2.623   77.143   74.524
LGA    N    64_B      N    64_B     0.887     0    0.023   0.875     4.523   88.214   70.238
LGA    L    65_B      L    65_B     0.758     0    0.090   1.020     3.635   90.476   78.155
LGA    Q    66_B      Q    66_B     0.755     0    0.033   0.675     2.172   90.476   80.847
LGA    K    67_B      K    67_B     1.129     0    0.051   1.155     7.153   81.429   63.862
LGA    V    68_B      V    68_B     1.109     0    0.073   0.984     2.752   83.690   78.027
LGA    K    69_B      K    69_B     0.982     0    0.076   0.697     2.108   83.690   82.804
LGA    T    70_B      T    70_B     1.139     0    0.136   1.121     2.809   81.429   75.782
LGA    H    71_B      H    71_B     1.815     0    0.109   0.671     2.930   70.833   72.286
LGA    F    72_B      F    72_B     1.460     0    0.028   0.267     1.561   77.143   84.805
LGA    E    73_B      E    73_B     1.397     0    0.059   0.733     5.087   75.119   59.577
LGA    K    74_B      K    74_B     3.042     0    0.044   0.851     7.926   53.690   34.603
LGA    F    75_B      F    75_B     3.240     0    0.043   1.472     7.508   48.333   34.892
LGA    I    76_B      I    76_B     2.507     0    0.025   1.488     3.964   55.357   58.631
LGA    Q    77_B      Q    77_B     3.257     0    0.051   1.065     4.856   46.905   49.788
LGA    D    78_B      D    78_B     4.319     0    0.191   1.063     7.500   40.238   29.107
LGA    Q    79_B      Q    79_B     3.911     0    0.046   0.356     5.607   41.786   37.619
LGA    Y    80_B      Y    80_B     3.106     0    0.139   0.229     4.096   51.786   49.008
LGA    L    81_B      L    81_B     4.184     0    0.355   0.615     6.328   31.786   27.917
LGA    E    82_B      E    82_B     5.158     0    0.168   0.956    11.759   34.524   16.614
LGA    P    83_B      P    83_B     3.455     0    0.070   0.423     4.659   50.119   43.741
LGA    A    84_B      A    84_B     2.858     0    0.052   0.077     3.210   57.262   57.238
LGA    R    85_B      R    85_B     2.464     0    0.078   1.278     3.205   64.881   63.593
LGA    S    86_B      S    86_B     2.684     0    0.119   0.808     3.067   60.952   62.540
LGA    Q    87_B      Q    87_B     2.438     0    0.037   0.640     3.846   64.881   59.153
LGA    I    88_B      I    88_B     1.511     0    0.079   1.403     4.195   77.143   68.571
LGA    I    89_B      I    89_B     1.403     0    0.047   1.334     3.481   77.143   72.321
LGA    D    90_B      D    90_B     1.964     0    0.064   0.658     3.391   72.857   69.048
LGA    L    91_B      L    91_B     1.429     0    0.054   1.057     3.691   79.286   73.512
LGA    W    92_B      W    92_B     0.918     0    0.059   0.280     2.379   85.952   77.959
LGA    T    93_B      T    93_B     1.886     0    0.040   1.052     4.284   68.810   63.197
LGA    R    94_B      R    94_B     2.079     0    0.126   1.466     6.210   70.833   55.801
LGA    Y    95_B      Y    95_B     1.491     0    0.015   0.165     1.973   75.000   80.833
LGA    L    96_B      L    96_B     2.200     0    0.051   0.089     2.754   62.976   63.869
LGA    K    97_B      K    97_B     2.979     0    0.093   1.022     3.944   57.143   57.354
LGA    Y    98_B      Y    98_B     2.245     0    0.014   0.106     2.641   62.857   74.524
LGA    R    99_B      R    99_B     2.698     0    0.030   1.189     9.410   55.476   33.160
LGA    E   100_B      E   100_B     3.476     0    0.042   0.872     3.965   46.667   52.857
LGA    Q   101_B      Q   101_B     3.679     0    0.238   0.462     5.840   43.333   40.952
LGA    L   102_B      L   102_B     3.832     0    0.244   1.388     5.367   37.500   43.631
LGA    A   103_B      A   103_B     3.675     0    0.698   0.639     4.445   46.905   44.952
LGA    Q   104_B      Q   104_B     5.054     0    0.477   1.328     7.941   29.762   21.270
LGA    I   105_B      I   105_B     6.158     0    0.084   1.085     8.843   18.214   16.964
LGA    Q   106_B      Q   106_B     6.624     0    0.102   1.005     7.883   11.905   20.423
LGA    P   107_B      P   107_B     8.099     0    0.227   0.267     8.361    6.667    6.939
LGA    S   108_B      S   108_B     9.362     0    0.060   0.226    10.268    0.952    0.714
LGA    Q   109_B      Q   109_B     9.889     0    0.168   0.743    11.713    0.952    0.423
LGA    S   110_B      S   110_B     8.416     0    0.168   0.609     9.795   11.190    7.619
LGA    K   111_B      K   111_B     3.873     0    0.300   0.875     8.421   49.762   28.942
LGA    Q   112_B      Q   112_B     4.013     0    0.552   0.739    11.193   34.524   18.466
LGA    Q   113_B      Q   113_B     6.811     0    0.458   0.976    12.005   19.762   10.053
LGA    D   114_B      D   114_B     6.074     0    0.040   0.222     6.583   22.024   20.952
LGA    Q   115_B      Q   115_B     3.750     0    0.114   1.578     5.784   43.690   38.042
LGA    N   116_B      N   116_B     3.348     0    0.191   1.315     4.047   43.571   48.036
LGA    Y   117_B      Y   117_B     5.704     0    0.107   0.260    10.020   26.310   12.063
LGA    F   118_B      F   118_B     4.976     0    0.054   0.227     7.771   34.524   22.338
LGA    Q   119_B      Q   119_B     3.101     0    0.111   1.185     5.435   48.333   49.841
LGA    K   120_B      K   120_B     4.443     0    0.039   0.567     5.987   35.833   32.910
LGA    V   121_B      V   121_B     5.116     0    0.059   0.085     5.717   28.810   26.327
LGA    F   122_B      F   122_B     3.543     0    0.056   1.257     5.542   46.667   46.407
LGA    N   123_B      N   123_B     3.660     0    0.042   1.122     4.554   43.333   41.071
LGA    S   124_B      S   124_B     4.400     0    0.053   0.686     5.833   38.690   34.603
LGA    I   125_B      I   125_B     3.049     0    0.058   0.154     3.474   55.476   54.524
LGA    Q   126_B      Q   126_B     2.544     0    0.054   1.020     4.325   57.143   49.630
LGA    D   127_B      D   127_B     3.569     0    0.054   0.109     4.424   46.667   43.452
LGA    I   128_B      I   128_B     3.196     0    0.043   0.124     3.421   53.571   51.786
LGA    R   129_B      R   129_B     2.100     0    0.051   1.290     6.179   64.762   57.619
LGA    K   130_B      K   130_B     2.709     0    0.188   0.227     3.644   53.810   53.333
LGA    R   131_B      R   131_B     3.472     0    0.199   0.824     8.553   50.119   27.662
LGA    F   132_B      F   132_B     1.430     0    0.193   0.346     3.925   77.143   64.848
LGA    F   133_B      F   133_B     1.774     0    0.583   0.596     4.764   60.714   77.186
LGA    S   134_B      S   134_B     3.417     0    0.590   0.740     5.685   43.333   38.492
LGA    A   135_B      A   135_B     5.440     0    0.494   0.507     7.625   35.952   30.190
LGA    S   136_B      S   136_B     1.874     0    0.157   0.700     3.223   69.286   67.857
LGA    E   137_B      E   137_B     1.396     0    0.092   0.180     3.010   79.286   69.630
LGA    I   138_B      I   138_B     1.814     0    0.021   0.241     3.595   72.857   64.226
LGA    E   139_B      E   139_B     1.566     0    0.034   0.931     4.025   75.000   68.148
LGA    G   140_B      G   140_B     0.948     0    0.037   0.037     1.809   83.810   83.810
LGA    L   141_B      L   141_B     1.337     0    0.115   0.229     1.733   77.143   82.679
LGA    F   142_B      F   142_B     2.261     0    0.271   0.356     3.748   57.500   68.139
LGA    S   143_B      S   143_B     2.118     0    0.038   0.089     2.845   62.976   66.270
LGA    T   144_B      T   144_B     3.008     0    0.128   0.209     3.401   51.786   54.082
LGA    E   145_B      E   145_B     3.499     0    0.057   0.730     5.486   46.667   37.196
LGA    D   146_B      D   146_B     3.438     0    0.034   1.071     5.394   46.667   42.143
LGA    I   147_B      I   147_B     3.630     0    0.062   1.368     7.095   48.333   40.179
LGA    Y   148_B      Y   148_B     3.340     0    0.017   0.161     4.049   50.000   44.524
LGA    Q   149_B      Q   149_B     3.253     0    0.054   1.024     3.345   50.000   57.513
LGA    N   150_B      N   150_B     3.278     0    0.031   1.422     5.379   50.000   44.583
LGA    Y   151_B      Y   151_B     3.349     0    0.027   0.196     3.558   50.000   47.778
LGA    T   152_B      T   152_B     3.030     0    0.059   0.153     3.168   50.000   50.000
LGA    L   153_B      L   153_B     3.032     0    0.088   1.465     5.327   50.119   43.333
LGA    D   154_B      D   154_B     3.660     0    0.119   0.907     4.016   45.000   45.060
LGA    R   155_B      R   155_B     3.725     0    0.058   1.211     6.495   41.786   31.342
LGA    M   156_B      M   156_B     3.827     0    0.045   0.871     4.358   40.238   42.619
LGA    K   157_B      K   157_B     4.099     0    0.064   0.078     5.012   34.524   41.640
LGA    I   158_B      I   158_B     4.905     0    0.090   0.164     5.843   29.048   29.583
LGA    L   159_B      L   159_B     5.036     0    0.067   0.213     5.327   27.500   26.845
LGA    E   160_B      E   160_B     4.996     0    0.569   1.051     7.115   32.857   25.820
LGA    D   161_B      D   161_B     6.416     0    0.265   1.098     8.799   11.786   12.143
LGA    S   162_B      S   162_B     7.171     0    0.441   0.829     7.870   11.071   13.810
LGA    S   163_B      S   163_B     8.135     0    0.507   0.729     9.427    5.119    4.841
LGA    L   164_B      L   164_B     9.876     0    0.076   1.049    13.366    1.190    0.595
LGA    S   165_B      S   165_B     8.431     0    0.047   0.667     8.981    4.286    4.841
LGA    E   166_B      E   166_B     7.227     0    0.049   0.114     7.668   10.952   14.444
LGA    I   167_B      I   167_B     6.783     0    0.106   0.134     7.605   11.667   11.429
LGA    E   168_B      E   168_B     7.552     0    0.036   0.880    10.030   10.119    6.931
LGA    K   169_B      K   169_B     6.433     0    0.042   1.083     7.850   17.262   14.127
LGA    A   170_B      A   170_B     5.569     0    0.027   0.049     5.897   22.619   23.333
LGA    K   171_B      K   171_B     6.194     0    0.033   0.568     7.656   18.214   14.074
LGA    K   172_B      K   172_B     5.994     0    0.052   0.635     9.266   22.738   14.392
LGA    L   173_B      L   173_B     4.810     0    0.032   0.134     5.251   30.119   30.774
LGA    K   174_B      K   174_B     4.966     0    0.020   1.217    10.500   30.119   18.942
LGA    E   175_B      E   175_B     5.166     0    0.036   0.911     6.655   28.810   27.143
LGA    R   176_B      R   176_B     4.729     0    0.031   1.362    10.445   34.286   20.736
LGA    F   177_B      F   177_B     3.964     0    0.143   1.248     9.622   40.238   25.541
LGA    E   178_B      E   178_B     4.744     0    0.083   0.888     5.300   31.429   34.286
LGA    Q   179_B      Q   179_B     4.523     0    0.048   1.334     5.642   38.810   38.042
LGA    L   180_B      L   180_B     3.197     0    0.063   0.951     3.658   48.333   51.012
LGA    P   181_B      P   181_B     3.482     0    0.140   0.228     3.803   53.571   49.184
LGA    E   182_B      E   182_B     2.906     0    0.032   0.262     5.887   57.262   42.751
LGA    D   183_B      D   183_B     2.852     0    0.037   0.993     6.744   57.262   43.393
LGA    W   184_B      W   184_B     2.062     0    0.030   0.208     3.052   68.810   68.435
LGA    Q   185_B      Q   185_B     2.169     0    0.076   0.702     2.510   66.786   72.222
LGA    E   186_B      E   186_B     2.334     0    0.051   0.847     2.925   68.810   64.921
LGA    N   187_B      N   187_B     1.428     0    0.047   0.536     1.842   81.548   80.476
LGA    L   188_B      L   188_B     0.941     0    0.065   0.938     3.099   81.548   76.488
LGA    Q   189_B      Q   189_B     1.789     0    0.045   1.362     5.123   70.952   60.741
LGA    E   190_B      E   190_B     2.011     0    0.027   1.147     3.793   64.881   65.132
LGA    L   191_B      L   191_B     2.424     0    0.167   0.134     4.159   56.190   57.679
LGA    S   192_B      S   192_B     3.439     0    0.205   0.186     3.835   48.452   46.746
LGA    K   193_B      K   193_B     3.835     0    0.059   0.874     4.422   40.238   39.894
LGA    L   194_B      L   194_B     5.120     0    0.051   0.102     6.939   27.738   23.095
LGA    D   195_B      D   195_B     4.539     0    0.063   1.061     6.312   34.286   30.476
LGA    D   196_B      D   196_B     3.850     0    0.024   0.876     6.461   38.690   33.690
LGA    L   197_B      L   197_B     4.984     0    0.072   1.386     7.065   26.429   21.548
LGA    H   198_B      H   198_B     6.322     0    0.067   0.466     8.245   17.262   12.143
LGA    T   199_B      T   199_B     6.020     0    0.138   1.153     6.557   17.262   18.571
LGA    L   200_B      L   200_B     6.232     0    0.038   0.176     6.581   16.190   16.667
LGA    T   201_B      T   201_B     6.456     0    0.028   0.094     6.781   15.238   15.510
LGA    K   202_B      K   202_B     6.816     0    0.039   1.231     7.607   10.952   22.434
LGA    Q   203_B      Q   203_B     7.330     0    0.112   1.063     9.832    8.571    8.783
LGA    I   204_B      I   204_B     8.245     0    0.034   0.601     8.779    4.881    5.000
LGA    K   205_B      K   205_B     7.799     0    0.168   0.641     7.845    7.143   10.635
LGA    A   206_B      A   206_B     7.596     0    0.199   0.197     8.964    5.476    6.381
LGA    R   207_B      R   207_B     8.791     0    0.193   0.928    12.681    2.976    1.126
LGA    N   208_B      N   208_B     8.900     0    0.101   1.142    10.275    1.548    4.762
LGA    G   209_B      G   209_B     9.729     0    0.090   0.090     9.924    0.714    0.714
LGA    S   210_B      S   210_B    10.850     0    0.086   0.096    11.988    0.119    0.079
LGA    A   211_B      A   211_B     9.814     0    0.059   0.059    10.345    0.595    0.476
LGA    E   212_B      E   212_B    10.664     0    0.023   1.189    13.653    0.000    0.000
LGA    E   213_B      E   213_B    10.467     0    0.053   0.696    12.864    0.476    0.212
LGA    L   214_B      L   214_B     7.994     0    0.030   0.959    10.175    6.429    5.060
LGA    R   215_B      R   215_B     7.567     0    0.027   1.218    10.870    7.857    4.805
LGA    Q   216_B      Q   216_B     9.133     0    0.020   1.208    10.191    2.500    3.228
LGA    M   217_B      M   217_B     8.335     0    0.026   1.046     8.519    5.476    6.190
LGA    R   218_B      R   218_B     5.643     0    0.100   1.882     6.582   19.405   30.216
LGA    T   219_B      T   219_B     6.135     0    0.057   0.990     6.723   16.190   15.510
LGA    A   220_B      A   220_B     7.959     0    0.026   0.051     8.574    7.857    6.857
LGA    L   221_B      L   221_B     7.080     0    0.150   1.173    11.353   11.786    8.512
LGA    V   222_B      V   222_B     4.550     0    0.035   1.328     7.057   34.524   33.605
LGA    G   223_B      G   223_B     4.248     0    0.064   0.064     4.466   38.690   38.690
LGA    A   224_B      A   224_B     4.277     0    0.139   0.167     4.676   38.690   37.238
LGA    E   225_B      E   225_B     2.492     0    0.041   0.236     2.957   62.857   68.466
LGA    A   226_B      A   226_B     2.185     0    0.104   0.128     2.605   62.857   63.238
LGA    T   227_B      T   227_B     3.884     0    0.084   0.949     5.952   43.452   36.259
LGA    Q   228_B      Q   228_B     3.679     0    0.059   0.216     6.005   46.667   36.772
LGA    R   229_B      R   229_B     1.798     0    0.080   1.276     3.557   66.786   70.996
LGA    L   230_B      L   230_B     3.001     0    0.062   0.128     3.412   51.786   50.893
LGA    E   231_B      E   231_B     3.896     0    0.021   1.484     9.162   43.333   26.614
LGA    T   232_B      T   232_B     2.932     0    0.036   1.154     3.213   57.262   56.190
LGA    L   233_B      L   233_B     2.528     0    0.037   1.165     4.344   57.143   52.917
LGA    D   234_B      D   234_B     3.946     0    0.073   0.879     6.402   40.238   32.857
LGA    I   235_B      I   235_B     4.035     0    0.060   1.335     5.547   40.238   37.560
LGA    Q   236_B      Q   236_B     3.218     0    0.024   0.692     3.506   46.667   63.280
LGA    R   237_B      R   237_B     4.137     0    0.043   1.022     7.026   38.690   26.017
LGA    N   238_B      N   238_B     5.224     0    0.080   0.948     8.222   27.500   18.869
LGA    A   239_B      A   239_B     4.150     0    0.163   0.189     4.387   38.690   39.619
LGA    W   240_B      W   240_B     3.356     0    0.055   0.169     5.741   45.119   39.932
LGA    Q   241_B      Q   241_B     6.075     0    0.110   0.913    10.570   19.405   10.000
LGA    Q   242_B      Q   242_B     6.588     0    0.061   0.548    10.111   18.333    9.894
LGA    R   243_B      R   243_B     3.964     0    0.042   1.094     5.349   40.357   48.528
LGA    V   244_B      V   244_B     3.754     0    0.038   1.048     6.798   38.810   34.694
LGA    T   245_B      T   245_B     6.766     0    0.137   0.195     8.910   14.524   10.748
LGA    G   246_B      G   246_B     7.094     0    0.097   0.097     7.094   14.405   14.405
LGA    Y   247_B      Y   247_B     3.913     0    0.043   0.113     4.907   40.357   53.056
LGA    L   248_B      L   248_B     4.383     0    0.040   1.014    10.008   31.667   19.762
LGA    N   249_B      N   249_B     7.459     0    0.023   1.364    12.745   11.786    6.250
LGA    Q   250_B      Q   250_B     6.755     0    0.068   0.938     9.565   17.381   11.111
LGA    R   251_B      R   251_B     3.399     0    0.041   1.279     8.994   45.119   40.346
LGA    D   252_B      D   252_B     5.204     0    0.021   0.114     8.170   25.119   19.167
LGA    E   253_B      E   253_B     7.937     0    0.016   0.838    13.715    9.405    4.339
LGA    V   254_B      V   254_B     6.375     0    0.068   0.092     7.334   20.714   17.619
LGA    L   255_B      L   255_B     3.189     0    0.056   0.211     4.162   45.119   55.000
LGA    H   256_B      H   256_B     6.507     0    0.240   1.338    13.245   14.167    6.048
LGA    S   257_B      S   257_B     8.173     0    0.641   0.597     9.889    9.524    6.667
LGA    N   258_B      N   258_B     8.166     0    0.106   0.360     9.961    3.214    4.881
LGA    M   259_B      M   259_B     9.529     0    0.549   1.358    13.718    1.905    0.952
LGA    S   260_B      S   260_B     9.800     0    0.083   0.139    12.496    0.476    0.317
LGA    D   261_B      D   261_B     9.867     0    0.026   0.942    10.986    0.238    0.179
LGA    S   262_B      S   262_B    13.476     0    0.067   0.640    16.451    0.000    0.000
LGA    A   263_B      A   263_B    12.917     0    0.032   0.049    13.005    0.000    0.000
LGA    K   264_B      K   264_B     8.398     0    0.029   0.981     9.941    3.214    5.397
LGA    K   265_B      K   265_B     9.831     0    0.047   1.251    13.309    0.476    0.212
LGA    Q   266_B      Q   266_B    13.156     0    0.043   0.906    18.269    0.000    0.000
LGA    A   267_B      A   267_B    11.137     0    0.049   0.068    11.585    0.238    0.190
LGA    I   268_B      I   268_B     7.212     0    0.099   0.175     8.601    6.190   15.714
LGA    Q   269_B      Q   269_B    10.413     0    0.075   1.399    14.850    0.357    0.159
LGA    Q   270_B      Q   270_B    12.198     0    0.024   0.896    14.082    0.000    0.000
LGA    L   271_B      L   271_B     8.601     0    0.047   1.458     9.645    4.405    5.238
LGA    R   272_B      R   272_B     6.913     0    0.090   1.281     8.223    9.524   11.039
LGA    Q   273_B      Q   273_B    10.944     0    0.122   1.089    14.660    0.119    0.053
LGA    Q   274_B      Q   274_B    11.081     0    0.224   0.912    12.900    0.119    0.053
LGA    Q   275_B      Q   275_B     6.409     0    0.040   0.676     7.684   20.476   22.804
LGA    F   276_B      F   276_B     5.675     0    0.022   0.148     8.469   14.405   38.918
LGA    S   277_B      S   277_B     8.729     0    0.111   0.137    10.724    3.571    4.524
LGA    S   278_B      S   278_B     9.712     0    0.059   0.613    10.065    1.190    0.952
LGA    S   279_B      S   279_B    11.794     0    0.092   0.720    15.392    0.000    0.000
LGA    Q   280_B      Q   280_B    10.533     0    0.110   0.735    14.069    1.071    0.476
LGA    E   281_B      E   281_B     7.082     0    0.055   0.714     8.251   11.310   22.169
LGA    Q   282_B      Q   282_B     7.101     0    0.092   1.158    12.499   10.000    5.291
LGA    L   283_B      L   283_B     8.725     0    0.099   0.178    11.441    4.286    2.202
LGA    R   284_B      R   284_B     7.569     0    0.036   0.639     9.244    9.405    5.671
LGA    L   285_B      L   285_B     5.616     0    0.116   1.204     6.129   20.357   29.048
LGA    R   286_B      R   286_B     6.700     0    0.044   1.323    14.951   12.619    5.801
LGA    T   287_B      T   287_B     8.157     0    0.096   0.191     9.202    5.476    3.946
LGA    F   288_B      F   288_B     6.784     0    0.048   1.475    10.944   12.500    8.528
LGA    E   289_B      E   289_B     6.450     0    0.065   0.449     7.461   13.571   19.153
LGA    T   290_B      T   290_B     8.876     0    0.036   1.089    11.092    2.976    1.769
LGA    V   291_B      V   291_B     9.712     0    0.593   0.624    10.186    0.952    0.816
LGA    H   292_B      H   292_B    10.400     0    0.599   0.611    13.530    0.000    0.000
LGA    D   293_B      D   293_B    15.366     0    0.167   1.183    19.019    0.000    0.000
LGA    Q   294_B      Q   294_B    18.284     0    0.681   0.617    24.647    0.000    0.000
LGA    G   295_B      G   295_B    16.731     0    0.573   0.573    17.289    0.000    0.000
LGA    G   296_B      G   296_B    15.459     0    0.070   0.070    16.506    0.000    0.000
LGA    E   297_B      E   297_B    15.757     0    0.251   0.830    17.419    0.000    0.000
LGA    L   298_B      L   298_B    19.814     0    0.112   0.971    23.491    0.000    0.000
LGA    P   299_B      P   299_B    20.568     0    0.247   0.267    23.909    0.000    0.000
LGA    F   300_B      F   300_B    21.616     0    0.627   1.432    23.641    0.000    0.000
LGA    N   301_B      N   301_B    24.754     0    0.138   0.821    27.741    0.000    0.000
LGA    Y   302_B      Y   302_B    27.345     0    0.556   0.929    35.854    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      285    1140   1140  100.00    2384   2384  100.00               285
SUMMARY(RMSD_GDC):     6.635          6.620                  7.159           38.082   35.324

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  302  285    4.0    149    2.72    48.421    44.101     5.290

LGA_LOCAL      RMSD:   2.717  Number of atoms:  149  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   6.659  Number of assigned atoms:  285 
Std_ASGN_ATOMS RMSD:   6.635  Standard rmsd on all 285 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.910100 * X  +   0.365425 * Y  +   0.195402 * Z  + -10.196881
  Y_new =  -0.400462 * X  +   0.896812 * Y  +   0.188036 * Z  + -16.484463
  Z_new =  -0.106526 * X  +  -0.249383 * Y  +   0.962528 * Z  + -52.614716 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -0.414523  0.106728 -0.253517   [DEG:  -23.7504    6.1151  -14.5255 ]
ZXZ:  2.336988  0.274621 -2.737897   [DEG:  133.8996   15.7346 -156.8699 ]
 
# END of job
