
#######################################################
#                                                     #
#                        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  289 ( 2320),  selected  288 , name one
# Molecule2: number of CA atoms  411 ( 3330),  selected  288 , 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:   288      36_A - 348_A       4.80     4.80
  LCS_AVERAGE:     70.07

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    32     204_A - 235_A       1.90     5.67
  LONGEST_CONTINUOUS_SEGMENT:    32     281_A - 312_A       1.69     6.72
  LCS_AVERAGE:      5.41

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    27     286_A - 312_A       0.74     7.39
  LCS_AVERAGE:      3.73

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  288
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     N    36_A     N    36_A     13   14  288     10   17   21   28   44   57   89  127  175  195  221  242  258  266  272  275  280  282  284  286 
LCS_GDT     E    37_A     E    37_A     13   14  288     10   17   21   28   44   83  113  144  175  203  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     L    38_A     L    38_A     13   14  288     10   17   21   28   50  100  116  149  175  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     I    39_A     I    39_A     13   14  288     10   17   21   28   44   57   96  144  175  202  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     E    40_A     E    40_A     13   14  288     10   17   21   28   44   73   96  144  175  200  225  243  258  266  272  275  280  282  284  286 
LCS_GDT     L    41_A     L    41_A     13   14  288     10   17   21   37   63   95  121  148  175  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     V    42_A     V    42_A     13   14  288     10   17   21   37   63   95  125  155  175  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     I    43_A     I    43_A     13   14  288     10   17   21   28   49   78  111  144  175  204  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     E    44_A     E    44_A     13   14  288     10   17   21   28   49   73  113  144  175  203  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     C    45_A     C    45_A     13   14  288     10   17   22   38   64   96  123  148  175  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     G    46_A     G    46_A     13   14  288      5   17   22   38   50   95  115  144  175  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     L    47_A     L    47_A     13   14  288      8   17   22   41   63  104  133  159  176  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     C    48_A     C    48_A     13   14  288      6   17   21   34   65   99  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     D    49_A     D    49_A      5   14  288      3    7   13   29   46   78  103  141  171  199  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     K    50_A     K    50_A      6    9  288      4    6    6   12   29   57   83  101  133  179  205  225  253  266  272  275  280  282  284  286 
LCS_GDT     T    51_A     T    51_A      6    9  288      5    6   22   38   58   89  124  150  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     S    52_A     S    52_A      6    9  288      5    6    6    9   14   29   53  102  134  181  219  243  258  266  272  275  280  282  284  286 
LCS_GDT     I    53_A     I    53_A      6    9  288      5    6    6    9   10   16   30   53   76  107  142  183  229  252  267  275  277  281  284  286 
LCS_GDT     K    54_A     K    54_A      6    9  288      5    6    6   11   20   39   77  105  131  189  225  243  258  266  272  275  280  282  284  286 
LCS_GDT     K    55_A     K    55_A      6    9  288      5    6    6   13   23   45   83  116  160  198  225  243  258  266  272  275  280  282  284  286 
LCS_GDT     M    56_A     M    56_A      4    9  288      4    4    7   11   17   21   26   38   51   63  112  165  223  249  267  275  277  280  284  285 
LCS_GDT     Y    57_A     Y    57_A      4    9  288      4    4    5    9   15   37   53   90  129  171  223  243  258  266  272  275  280  282  284  286 
LCS_GDT     D    58_A     D    58_A      4    9  288      3    4    7   20   51   76  111  149  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     K    59_A     K    59_A      4    5  288      3    4    4    8   15   29   50   97  136  175  203  223  246  259  272  275  280  282  284  286 
LCS_GDT     I    60_A     I    60_A      4    5  288      3    4    6   13   14   34   57   76  102  157  183  209  246  259  272  275  280  282  284  286 
LCS_GDT     N    61_A     N    61_A      4   11  288      3    6   14   33   59   86  122  153  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     T    62_A     T    62_A      4   11  288      3    4    8   14   28   54   88  138  172  202  225  243  258  266  272  275  280  282  284  286 
LCS_GDT     Y    63_A     Y    63_A      9   11  288      8    8   14   26   39   71  110  150  176  203  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     Q    64_A     Q    64_A      9   11  288      8    8   15   26   46   73  110  149  176  202  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     F    65_A     F    65_A      9   11  288      8    8   11   29   63  105  124  153  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     M    66_A     M    66_A      9   11  288      8    8   10   18   41   77  115  153  176  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     W    67_A     W    67_A      9   11  288      8    8   14   26   41   75  110  150  175  203  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     C    68_A     C    68_A      9   11  288      8    8    9   29   63  105  124  153  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     I    69_A     I    69_A      9   11  288      8    8    9   14   37   75  115  153  174  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     V    70_A     V    70_A      9   11  288      8    8    9   17   37   66   89  138  172  200  225  243  258  266  272  275  280  282  284  286 
LCS_GDT     D    71_A     D    71_A      9   11  288      3    7   14   23   41   68  100  142  173  202  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     T    72_A     T    72_A      4    5  288      4    4    5    8   16   30   76  108  149  195  223  243  258  266  272  275  280  282  284  286 
LCS_GDT     I    73_A     I    73_A      4    5  288      4    6    8   14   21   44   99  136  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     P    74_A     P    74_A      4    5  288      4    4    8   28   44   58  125  155  176  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     A    75_A     A    75_A      4    5  288      4    4    8   14   25   40   71  106  146  197  225  243  258  266  272  275  280  282  284  286 
LCS_GDT     S    76_A     S    76_A      4    5  288      3    4    4   17   29   42   80  113  150  197  225  243  258  266  272  275  280  282  284  286 
LCS_GDT     Q    77_A     Q    77_A      3   10  288      2    3    6   12   28   37   59  103  167  197  223  242  258  266  272  275  280  282  284  286 
LCS_GDT     Y    78_A     Y    78_A     11   14  288      8    9   13   27   46   71  100  133  167  202  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     A    79_A     A    79_A     11   14  288      8    9   11   16   32   54   84  129  160  196  225  243  258  266  272  275  280  282  284  286 
LCS_GDT     E    80_A     E    80_A     11   14  288      8    9   11   41   67  106  130  155  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     E    81_A     E    81_A     11   14  288      8    9   11   34   89  115  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     I    82_A     I    82_A     11   14  288      8    9   19   34   48   82  110  147  175  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     F    83_A     F    83_A     11   14  288      8    9   11   25   52   92  122  153  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     K    84_A     K    84_A     11   18  288      8   27   40   64   93  117  133  159  177  205  226  242  258  266  272  275  280  282  284  286 
LCS_GDT     S    85_A     S    85_A     11   19  288      8    9   11   18   30   61  124  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     S    86_A     S    86_A     11   19  288      4   14   25   53   74  106  126  158  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     L    87_A     L    87_A     11   19  288      4    5   22   49   87  117  130  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     H    88_A     H    88_A     11   19  288      4   20   38   67  100  117  133  159  177  205  226  242  258  266  272  275  280  282  284  286 
LCS_GDT     F    89_A     F    89_A     13   19  288      4    8   19   41   76  100  133  159  176  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     L    90_A     L    90_A     13   19  288      6   32   48   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     C    91_A     C    91_A     13   19  288     14   32   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     A    92_A     A    92_A     13   19  288      6   32   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     L    93_A     L    93_A     13   19  288      6   32   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     F    94_A     F    94_A     13   19  288      6   32   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     L    95_A     L    95_A     13   19  288      6   32   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     V    96_A     V    96_A     13   19  288     13   32   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     D    97_A     D    97_A     13   19  288      6   32   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     D    98_A     D    98_A     13   19  288      5   23   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     A    99_A     A    99_A     13   19  288      6   32   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     V   100_A     V   100_A     13   19  288      6   23   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     E   101_A     E   101_A     13   19  288      4   24   50   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     S   102_A     S   102_A     12   19  288      4    8   25   73  103  117  128  155  176  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     Y   103_A     Y   103_A      7   19  288      4   13   43   74  103  117  127  155  176  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     S   104_A     S   104_A      4   18  288      4    4    5   32   68   96  126  140  171  200  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     A   105_A     A   105_A      4   18  288      4    4   24   39   59   87  123  154  175  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     N   106_A     N   106_A      4   20  288      4   14   27   51   84  109  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     E   107_A     E   107_A     17   20  288     12   13   25   40   62   92  123  150  176  198  224  243  258  266  272  275  280  282  284  286 
LCS_GDT     M   108_A     M   108_A     17   20  288     12   13   25   45   73  105  127  151  176  203  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     Q   109_A     Q   109_A     17   20  288     12   22   39   73  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     D   110_A     D   110_A     17   20  288     12   14   29   51   87  109  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     L   111_A     L   111_A     17   20  288     12   13   29   46   69  100  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     S   112_A     S   112_A     17   20  288     12   19   36   64   97  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     R   113_A     R   113_A     17   20  288     12   13   28   46   80  109  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     S   114_A     S   114_A     17   20  288     12   13   27   36   52   81  119  154  175  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     Y   115_A     Y   115_A     17   20  288     12   13   27   37   55   93  126  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     D   116_A     D   116_A     17   20  288     12   13   21   39   65  104  126  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     I   117_A     I   117_A     17   20  288     12   13   16   21   49   73   96  137  175  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     L   118_A     L   118_A     17   20  288     11   13   16   22   34   60   95  128  161  194  225  243  258  266  272  275  280  282  284  286 
LCS_GDT     E   119_A     E   119_A     17   20  288     12   13   16   22   49   73   95  137  175  202  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     K   120_A     K   120_A     17   20  288      3   13   16   21   43   73   95  127  167  202  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     E   121_A     E   121_A     17   20  288      3   11   16   20   29   44   59  108  150  173  210  242  258  266  272  275  280  282  284  286 
LCS_GDT     V   122_A     V   122_A     17   20  288      3   11   16   20   27   31   57   85  107  167  207  240  255  266  272  275  280  282  284  286 
LCS_GDT     C   123_A     C   123_A     17   20  288      3   11   16   22   34   46   95  137  170  202  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     K   124_A     K   124_A     13   20  288      4    8   14   21   32   46   84  120  157  197  225  243  258  266  272  275  280  282  284  286 
LCS_GDT     T   125_A     T   125_A      9   20  288      3    4   13   19   27   42   65  108  150  176  223  243  258  266  272  275  280  282  284  286 
LCS_GDT     F   126_A     F   126_A      3    4  288      3    3    5    8   12   30   64   89  126  168  205  234  252  266  272  275  280  282  284  286 
LCS_GDT     P   127_A     P   127_A      3    4  288      0    3    3    4   10   13   16   23   45   50   63  107  139  187  223  256  263  275  278  284 
LCS_GDT     T   152_A     T   152_A     16   19  288      5   12   15   18   27   65   96  144  175  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     F   153_A     F   153_A     16   19  288      6   12   15   19   23   65   88  138  173  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     C   154_A     C   154_A     16   19  288      6   12   15   19   23   58   92  138  173  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     M   155_A     M   155_A     16   19  288      6   13   15   19   47   77  112  149  175  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     Q   156_A     Q   156_A     16   19  288      5   13   15   19   37   69  111  149  176  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     Y   157_A     Y   157_A     16   19  288      6   13   15   19   23   43   88  129  159  198  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     V   158_A     V   158_A     16   19  288      6   13   15   19   37   70  102  142  175  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     N   159_A     N   159_A     16   19  288      6   13   16   31   54   82  118  149  176  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     K   160_A     K   160_A     16   19  288      6   13   16   29   50   84  117  149  176  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     I   161_A     I   161_A     16   19  288      6   13   15   19   40   75  103  142  175  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     T   162_A     T   162_A     16   19  288      6   13   18   31   53   81  112  148  176  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     A   163_A     A   163_A     16   19  288      6   13   25   42   61   93  127  154  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     I   164_A     I   164_A     16   19  288      5   13   25   42   62   92  127  154  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     L   165_A     L   165_A     16   19  288      5   13   15   29   53   75  104  148  176  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     L   166_A     L   166_A     16   19  288      5   13   15   30   49   71  105  148  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     E   167_A     E   167_A     16   19  288      5   13   15   34   58   93  130  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     E   168_A     E   168_A     15   19  288      5   12   15   19   29   62  102  148  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     G   169_A     G   169_A     15   19  288      3    8   12   19   23   26   38   94  125  182  218  241  254  266  272  275  280  282  284  286 
LCS_GDT     N   170_A     N   170_A      3   29  288      3    5   18   28   53   83  123  152  177  205  226  242  258  266  272  275  280  282  284  286 
LCS_GDT     T   171_A     T   171_A      3   29  288      3    3    7   23   27   50   80  130  162  188  220  237  255  266  272  275  280  282  284  286 
LCS_GDT     P   172_A     P   172_A      3   29  288      3   16   33   64   99  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     H   173_A     H   173_A     24   29  288      3    9   16   25   45   89  126  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     H   174_A     H   174_A     24   29  288      7   16   22   27   53   80  125  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     V   175_A     V   175_A     24   29  288     10   19   23   40   59   80  124  153  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     V   176_A     V   176_A     24   29  288     10   19   27   40   60   93  130  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     Y   177_A     Y   177_A     24   29  288     10   19   28   38   61   93  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     N   178_A     N   178_A     24   29  288     10   19   23   34   52   84  126  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     L   179_A     L   179_A     24   29  288     10   19   27   40   59   89  128  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     R   180_A     R   180_A     24   29  288     15   20   28   42   64  100  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     R   181_A     R   181_A     24   29  288     10   19   28   42   68  100  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     R   182_A     R   182_A     24   29  288     10   20   28   42   61   93  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     T   183_A     T   183_A     24   29  288     10   19   23   42   64   98  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     S   184_A     S   184_A     24   29  288     11   19   23   36   68  100  128  159  177  203  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     N   185_A     N   185_A     24   29  288     11   20   26   42   67  100  126  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     A   186_A     A   186_A     24   29  288     12   19   23   42   64  100  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     I   187_A     I   187_A     24   29  288     12   19   23   34   57   98  128  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     S   188_A     S   188_A     24   29  288     12   19   23   36   62  100  126  148  177  196  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     I   189_A     I   189_A     24   29  288     12   20   28   44   67  100  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     A   190_A     A   190_A     24   29  288     12   19   23   38   67  100  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     F   191_A     F   191_A     24   29  288     12   19   25   35   53  100  127  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     Q   192_A     Q   192_A     24   29  288     12   19   23   44   68  100  126  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     A   193_A     A   193_A     24   29  288     12   17   23   40   64   98  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     V   194_A     V   194_A     24   29  288     12   17   23   25   62   98  130  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     L   195_A     L   195_A     24   29  288     12   19   23   35   53  100  127  157  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     I   196_A     I   196_A     24   29  288     12   17   23   42   62  100  129  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     K   197_A     K   197_A     24   29  288     12   17   23   40   64   98  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     S   198_A     S   198_A     20   29  288      3    9   22   49   88  116  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     K   199_A     K   199_A      4   28  288      3    6    8   20   48   74  125  155  176  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     C   200_A     C   200_A      4   28  288      3    4    5   18   33   65  121  155  175  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     G   201_A     G   201_A      4   24  288      3    3    4    9   38   55   74  112  156  196  220  239  253  265  272  275  280  282  284  286 
LCS_GDT     S   202_A     S   202_A      4   28  288      0    3    4    7   16   51   73  101  132  177  207  235  250  263  272  275  280  282  284  286 
LCS_GDT     I   204_A     I   204_A     14   32  288      5   13   31   53   72  111  127  149  176  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     T   205_A     T   205_A     14   32  288      8   27   41   71  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     S   206_A     S   206_A     15   32  288     11   28   45   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     H   207_A     H   207_A     15   32  288     11   32   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     E   208_A     E   208_A     15   32  288     11   32   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     M   209_A     M   209_A     15   32  288     11   28   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     L   210_A     L   210_A     15   32  288     11   32   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     W   211_A     W   211_A     15   32  288     11   28   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     R   212_A     R   212_A     15   32  288     11   28   45   79  103  117  127  158  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     R   213_A     R   213_A     15   32  288     11   28   45   79  103  117  131  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     V   214_A     V   214_A     15   32  288      7   28   45   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     F   215_A     F   215_A     15   32  288      6   28   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     D   216_A     D   216_A     15   32  288      6   28   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     G   217_A     G   217_A     16   32  288      9   19   41   68  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     L   218_A     L   218_A     16   32  288      7   32   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     V   219_A     V   219_A     16   32  288      7   26   45   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     I   220_A     I   220_A     16   32  288     12   25   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     L   221_A     L   221_A     16   32  288      9   24   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     F   222_A     F   222_A     16   32  288      7   23   45   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     Y   223_A     Y   223_A     16   32  288      7   24   43   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     Q   224_A     Q   224_A     16   32  288      7   28   43   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     F   225_A     F   225_A     16   32  288      5   28   43   77  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     G   226_A     G   226_A     16   32  288      5   28   43   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     E   227_A     E   227_A     16   32  288      5   17   44   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     L   228_A     L   228_A     16   32  288      5   23   50   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     I   229_A     I   229_A     16   32  288      9   26   50   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     S   230_A     S   230_A     16   32  288      5   25   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     G   231_A     G   231_A     16   32  288      5   15   42   77  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     A   232_A     A   232_A     16   32  288      5   11   37   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     T   233_A     T   233_A     15   32  288      5   25   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     E   234_A     E   234_A      3   32  288      1    3   23   45   67  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     T   235_A     T   235_A      6   32  288      3   11   23   40   70  108  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     A   236_A     A   236_A      6   28  288      4    5   18   34   55   74  109  143  164  187  213  236  251  266  272  275  280  282  284  286 
LCS_GDT     Q   237_A     Q   237_A      6   29  288     13   21   34   56   72  100  122  151  167  184  203  229  243  261  272  275  280  282  284  286 
LCS_GDT     Q   238_A     Q   238_A      6   29  288      4    5   23   35   63   98  127  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     H   239_A     H   239_A      6   29  288      4    5   13   39   67  100  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     I   240_A     I   240_A     24   29  288      3    9   27   44   70  109  133  159  177  196  226  242  258  266  272  275  280  282  284  286 
LCS_GDT     T   241_A     T   241_A     24   29  288     13   27   41   61   88  115  133  159  177  202  226  242  258  266  272  275  280  282  284  286 
LCS_GDT     V   242_A     V   242_A     24   29  288     13   28   41   62   88  115  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     V   243_A     V   243_A     24   29  288     13   28   41   65   88  115  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     T   244_A     T   244_A     24   29  288     13   25   41   62   91  115  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     E   245_A     E   245_A     24   29  288     13   28   45   71  100  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     L   246_A     L   246_A     24   29  288     13   28   45   77  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     R   247_A     R   247_A     24   29  288     13   28   45   73  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     M   248_A     M   248_A     24   29  288     13   28   45   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     L   249_A     L   249_A     24   29  288     13   28   45   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     G   250_A     G   250_A     24   29  288     13   28   45   77  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     C   251_A     C   251_A     24   29  288     13   28   45   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     L   252_A     L   252_A     24   29  288     13   28   45   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     Y   253_A     Y   253_A     24   29  288     12   28   45   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     C   254_A     C   254_A     24   29  288     11   28   45   74  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     I   255_A     I   255_A     24   29  288      9   28   45   76  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     V   256_A     V   256_A     24   29  288      8   28   46   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     I   257_A     I   257_A     24   29  288      9   28   45   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     N   258_A     N   258_A     24   29  288      9   28   45   73  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     D   259_A     D   259_A     24   29  288      9   28   45   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     L   260_A     L   260_A     24   29  288      9   27   45   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     Y   261_A     Y   261_A     24   29  288      9   27   43   77  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     S   262_A     S   262_A     24   29  288      6   27   42   69  100  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     Y   263_A     Y   263_A     24   29  288      4   27   45   76  103  117  130  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     Q   264_A     Q   264_A     24   29  288      4   21   43   76  103  117  127  153  176  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     R   265_A     R   265_A     21   29  288      4    8   21   35   94  115  127  141  166  192  221  241  255  265  272  275  280  282  284  286 
LCS_GDT     D   266_A     D   266_A      4   29  288      3    3    4    5    7    9   16   25   46   86  127  155  175  203  247  261  276  282  284  286 
LCS_GDT     K   267_A     K   267_A      4   29  288      3   11   19   29   61   90  110  140  172  202  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     L   268_A     L   268_A      4   29  288      3   19   43   76  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     A   269_A     A   269_A      4    7  288      3    4   11   32   68   98  127  144  166  196  222  241  255  266  272  275  280  282  284  286 
LCS_GDT     S   270_A     S   270_A      4    7  288      6   12   28   64  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     S   271_A     S   271_A      4    7  288      5   13   33   64  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     D   272_A     D   272_A      4    7  288      6   12   33   64  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     N   273_A     N   273_A      3   10  288      3    5   27   63   96  115  127  146  173  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     M   274_A     M   274_A      9   10  288      8    8   21   39   59  103  127  145  172  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     I   275_A     I   275_A      9   10  288      8    8    9   11   24   59  112  129  152  179  216  241  258  266  272  275  280  282  284  286 
LCS_GDT     K   276_A     K   276_A      9   10  288      8    8    9   17   35   57   90  131  162  188  220  242  258  266  272  275  280  282  284  286 
LCS_GDT     T   277_A     T   277_A      9   10  288      8    8   28   41   80  109  128  153  176  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     W   278_A     W   278_A      9   10  288      8    8   11   41   59   93  123  134  162  188  220  241  255  266  272  275  280  282  284  286 
LCS_GDT     L   279_A     L   279_A      9   10  288      8    8    9   11   16   50   67  123  138  174  216  241  258  266  272  275  280  282  284  286 
LCS_GDT     L   280_A     L   280_A      9   10  288      8    8    9   11   48   90  123  145  173  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     E   281_A     E   281_A      9   32  288      8    8    9   41   59   98  123  137  168  191  224  242  255  266  272  275  280  282  284  286 
LCS_GDT     K   282_A     K   282_A      9   32  288      3    5   14   36   64   95  122  135  162  188  218  241  258  266  272  275  280  282  284  286 
LCS_GDT     T   283_A     T   283_A      4   32  288      3    3    8   36   63   89  115  137  163  196  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     V   284_A     V   284_A      4   32  288      3    4    5   15   40   79   98  131  149  179  209  235  249  260  271  275  280  282  284  286 
LCS_GDT     S   285_A     S   285_A      4   32  288      3    4    6   21   34   75  103  131  158  183  214  241  258  266  272  275  280  282  284  286 
LCS_GDT     S   286_A     S   286_A     27   32  288     15   27   40   66   96  115  127  155  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     L   287_A     L   287_A     27   32  288     15   28   40   64   87  110  124  149  176  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     S   288_A     S   288_A     27   32  288     15   28   45   72   97  116  127  155  176  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     E   289_A     E   289_A     27   32  288     21   32   52   79  103  117  130  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     A   290_A     A   290_A     27   32  288     21   32   52   77  103  117  130  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     T   291_A     T   291_A     27   32  288     21   28   48   72  103  117  127  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     A   292_A     A   292_A     27   32  288     21   32   52   79  103  117  130  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     R   293_A     R   293_A     27   32  288     21   32   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     C   294_A     C   294_A     27   32  288     21   32   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     S   295_A     S   295_A     27   32  288     21   28   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     Q   296_A     Q   296_A     27   32  288     21   32   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     I   297_A     I   297_A     27   32  288     21   32   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     L   298_A     L   298_A     27   32  288     21   32   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     D   299_A     D   299_A     27   32  288     21   32   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     A   300_A     A   300_A     27   32  288     21   32   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     I   301_A     I   301_A     27   32  288     21   32   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     M   302_A     M   302_A     27   32  288     21   32   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     K   303_A     K   303_A     27   32  288     21   32   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     Y   304_A     Y   304_A     27   32  288     21   32   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     M   305_A     M   305_A     27   32  288     21   32   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     Y   306_A     Y   306_A     27   32  288     21   32   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     Q   307_A     Q   307_A     27   32  288     21   32   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     R   308_A     R   308_A     27   32  288     21   32   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     V   309_A     V   309_A     27   32  288     21   32   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     E   310_A     E   310_A     27   32  288      5   26   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     Q   311_A     Q   311_A     27   32  288      5   24   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     C   312_A     C   312_A     27   32  288      5   24   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     M   313_A     M   313_A      3   31  288      3   14   26   40   65  108  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     Q   314_A     Q   314_A      3   29  288      2    5    9   17   42   68  107  142  172  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     S   315_A     S   315_A      3    4  288      3    3    8   15   38   62   82  124  156  188  218  242  258  266  272  275  280  282  284  286 
LCS_GDT     N   316_A     N   316_A      5    5  288      3    5   12   12   38   62   82  107  154  188  216  241  258  266  272  275  280  282  284  286 
LCS_GDT     P   317_A     P   317_A      5    5  288      3    5    5   12   21   36   53   82  105  151  196  228  251  263  271  275  280  282  284  286 
LCS_GDT     G   318_A     G   318_A      5   23  288      3    5    5   10   23   32   59   88  131  182  216  241  258  266  272  275  280  282  284  286 
LCS_GDT     C   319_A     C   319_A     22   23  288     17   21   35   64  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     P   320_A     P   320_A     22   23  288     17   20   36   70  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     Q   321_A     Q   321_A     22   23  288     17   24   37   68  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     L   322_A     L   322_A     22   23  288     17   20   42   73  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     E   323_A     E   323_A     22   23  288     17   27   46   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     S   324_A     S   324_A     22   23  288     17   25   42   77  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     L   325_A     L   325_A     22   23  288     17   22   46   77  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     L   326_A     L   326_A     22   23  288     17   28   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     E   327_A     E   327_A     22   23  288     17   28   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     T   328_A     T   328_A     22   23  288     17   28   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     T   329_A     T   329_A     22   23  288     17   26   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     I   330_A     I   330_A     22   23  288     17   20   43   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     Y   331_A     Y   331_A     22   23  288     17   20   37   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     T   332_A     T   332_A     22   23  288     17   20   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     T   333_A     T   333_A     22   23  288     17   20   34   62  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     V   334_A     V   334_A     22   23  288     17   20   28   48   94  117  130  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     G   335_A     G   335_A     22   23  288     17   20   29   51  103  117  131  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     W   336_A     W   336_A     22   23  288      5   10   33   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     I   337_A     I   337_A     22   23  288      5   21   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     R   338_A     R   338_A     22   23  288      5   24   52   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     S   339_A     S   339_A     22   23  288     12   20   42   79  103  117  133  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     H   340_A     H   340_A     22   23  288      3    4   22   57   97  117  130  159  177  205  226  243  258  266  272  275  280  282  284  286 
LCS_GDT     T   341_A     T   341_A      3    6  288      3    3    3    5   36   49   57   94  114  157  178  201  227  239  257  273  280  282  284  286 
LCS_GDT     T   342_A     T   342_A      3    6  288      3    3    4   34   38   49   52   60   84  101  125  159  195  214  237  246  258  273  283  286 
LCS_GDT     V   343_A     V   343_A      3    6  288      3    3    4   23   31   46   52   58   68   93  108  144  168  205  219  244  251  264  277  286 
LCS_GDT     V   344_A     V   344_A      4    6  288      3    4    4    5    7   18   28   35   65   76  125  159  171  207  235  246  256  270  282  286 
LCS_GDT     P   345_A     P   345_A      4    6  288      3    4    4   10   16   54   78   94  125  157  178  199  221  239  251  264  278  282  284  286 
LCS_GDT     R   346_A     R   346_A      4    6  288      3    4    4   11   22   54   78   95  142  162  179  201  223  242  257  273  280  282  284  286 
LCS_GDT     Y   347_A     Y   347_A      4    6  288      1    4    4   33   47   72   88  126  142  162  179  203  228  242  257  273  280  282  284  286 
LCS_GDT     S   348_A     S   348_A      3    5  288      0    3    3    5    5    7   21   97  113  136  173  199  223  242  257  273  280  282  284  286 
LCS_AVERAGE  LCS_A:  26.40  (   3.73    5.41   70.07 )

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     21     32     52     79    103    117    133    159    177    205    226    243    258    266    272    275    280    282    284    286 
GDT PERCENT_AT   5.11   7.79  12.65  19.22  25.06  28.47  32.36  38.69  43.07  49.88  54.99  59.12  62.77  64.72  66.18  66.91  68.13  68.61  69.10  69.59
GDT RMS_LOCAL    0.26   0.67   1.09   1.45   1.68   1.89   2.46   2.74   3.00   3.38   3.63   3.92   4.11   4.22   4.30   4.36   4.50   4.56   4.61   4.72
GDT RMS_ALL_AT   7.65   5.82   5.66   5.70   5.70   5.59   5.35   5.25   5.07   4.88   4.87   4.83   4.82   4.82   4.82   4.82   4.81   4.81   4.80   4.80

# Checking swapping
#   possible swapping detected:  E    44_A      E    44_A
#   possible swapping detected:  D    49_A      D    49_A
#   possible swapping detected:  Y    57_A      Y    57_A
#   possible swapping detected:  Y    78_A      Y    78_A
#   possible swapping detected:  E    80_A      E    80_A
#   possible swapping detected:  E    81_A      E    81_A
#   possible swapping detected:  F    83_A      F    83_A
#   possible swapping detected:  F    94_A      F    94_A
#   possible swapping detected:  E   107_A      E   107_A
#   possible swapping detected:  E   119_A      E   119_A
#   possible swapping detected:  E   121_A      E   121_A
#   possible swapping detected:  F   153_A      F   153_A
#   possible swapping detected:  E   168_A      E   168_A
#   possible swapping detected:  F   191_A      F   191_A
#   possible swapping detected:  E   208_A      E   208_A
#   possible swapping detected:  E   234_A      E   234_A
#   possible swapping detected:  E   245_A      E   245_A
#   possible swapping detected:  D   266_A      D   266_A
#   possible swapping detected:  Y   304_A      Y   304_A
#   possible swapping detected:  Y   306_A      Y   306_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    N    36_A      N    36_A     8.492     0    0.042   0.120    10.279    4.762    2.798
LGA    E    37_A      E    37_A     7.194     0    0.016   0.851     7.743   10.952   10.159
LGA    L    38_A      L    38_A     5.508     0    0.012   1.395     7.513   20.357   19.762
LGA    I    39_A      I    39_A     7.044     0    0.043   1.242     9.073   10.833    9.405
LGA    E    40_A      E    40_A     8.001     0    0.048   0.108    10.099    7.262    3.915
LGA    L    41_A      L    41_A     6.026     0    0.016   1.402     8.046   18.333   16.845
LGA    V    42_A      V    42_A     5.222     0    0.110   1.197     5.635   25.000   26.395
LGA    I    43_A      I    43_A     7.183     0    0.205   1.293     9.746   11.786    9.167
LGA    E    44_A      E    44_A     7.877     0    0.018   0.928    11.114    8.571    4.339
LGA    C    45_A      C    45_A     6.195     0    0.570   0.622     6.708   25.000   23.095
LGA    G    46_A      G    46_A     6.400     0    0.076   0.076     6.935   22.024   22.024
LGA    L    47_A      L    47_A     4.375     0    0.339   0.377     5.242   30.238   38.452
LGA    C    48_A      C    48_A     4.580     0    0.252   0.700     5.553   31.548   30.794
LGA    D    49_A      D    49_A     6.840     0    0.639   1.177     8.499   15.714   10.238
LGA    K    50_A      K    50_A     9.589     0    0.601   0.891    19.180    1.905    0.847
LGA    T    51_A      T    51_A     5.886     0    0.035   0.971     6.995   15.357   26.395
LGA    S    52_A      S    52_A     9.498     0    0.076   0.677    10.849    1.548    1.270
LGA    I    53_A      I    53_A    11.722     0    0.091   1.128    14.800    0.000    0.000
LGA    K    54_A      K    54_A     9.159     0    0.240   0.785     9.985    3.452    3.492
LGA    K    55_A      K    55_A     8.447     0    0.112   0.151     9.846    2.143    4.815
LGA    M    56_A      M    56_A    11.554     0    0.153   0.209    16.403    0.000    0.000
LGA    Y    57_A      Y    57_A     9.634     0    0.611   1.383    16.502    1.667    0.675
LGA    D    58_A      D    58_A     5.466     0    0.611   1.335     6.791   30.000   25.298
LGA    K    59_A      K    59_A     6.668     0    0.147   0.238    14.241   15.357    7.143
LGA    I    60_A      I    60_A     7.934     0    0.099   0.650    14.259   15.000    7.500
LGA    N    61_A      N    61_A     5.304     0    0.469   0.516     6.495   21.667   21.726
LGA    T    62_A      T    62_A     7.361     0    0.089   1.039     9.025   10.119    8.571
LGA    Y    63_A      Y    63_A     6.603     0    0.207   0.983    13.399   15.238    7.540
LGA    Q    64_A      Q    64_A     6.524     0    0.046   0.170     9.253   18.333   11.534
LGA    F    65_A      F    65_A     4.740     0    0.057   1.031    10.371   30.119   17.532
LGA    M    66_A      M    66_A     5.610     0    0.016   0.932    10.735   21.548   15.774
LGA    W    67_A      W    67_A     6.275     0    0.144   0.188    11.202   20.357    8.061
LGA    C    68_A      C    68_A     4.870     0    0.219   0.223     5.188   30.119   29.683
LGA    I    69_A      I    69_A     5.381     0    0.157   0.681     8.836   23.810   18.750
LGA    V    70_A      V    70_A     7.030     0    0.680   1.036     9.500   18.929   13.129
LGA    D    71_A      D    71_A     6.985     0    0.158   1.236    13.240   12.500    6.607
LGA    T    72_A      T    72_A     7.360     0    0.579   1.025    11.771   16.667    9.796
LGA    I    73_A      I    73_A     5.438     0    0.084   1.039     8.784   20.714   14.405
LGA    P    74_A      P    74_A     5.225     0    0.081   0.360     6.776   23.452   32.177
LGA    A    75_A      A    75_A     9.427     0    0.129   0.136    11.353    2.262    1.810
LGA    S    76_A      S    76_A     9.409     0    0.597   0.781    11.944    5.238    3.492
LGA    Q    77_A      Q    77_A     8.747     0    0.615   1.546    12.916    2.738    1.217
LGA    Y    78_A      Y    78_A     8.477     0    0.636   0.472    11.753    5.357    2.421
LGA    A    79_A      A    79_A     9.220     0    0.049   0.050    11.028    6.905    5.524
LGA    E    80_A      E    80_A     4.233     0    0.059   1.034     6.554   47.024   34.339
LGA    E    81_A      E    81_A     3.326     0    0.052   0.995     9.282   45.357   28.042
LGA    I    82_A      I    82_A     6.704     0    0.043   0.141    12.868   22.976   11.667
LGA    F    83_A      F    83_A     5.265     0    0.046   1.149     9.554   36.429   16.450
LGA    K    84_A      K    84_A     2.896     0    0.063   0.572     9.300   55.595   33.968
LGA    S    85_A      S    85_A     4.236     0    0.040   0.060     6.451   45.238   35.873
LGA    S    86_A      S    86_A     4.342     0    0.007   0.005     7.397   46.786   36.429
LGA    L    87_A      L    87_A     3.284     0    0.058   1.368     7.231   57.262   41.012
LGA    H    88_A      H    88_A     3.043     0    0.144   1.630    10.224   51.071   28.429
LGA    F    89_A      F    89_A     3.940     0    0.194   0.213     8.548   43.810   24.156
LGA    L    90_A      L    90_A     1.362     0    0.041   1.368     3.873   83.810   75.714
LGA    C    91_A      C    91_A     0.568     0    0.033   0.053     1.234   85.952   85.952
LGA    A    92_A      A    92_A     1.776     0    0.115   0.123     2.461   75.000   72.952
LGA    L    93_A      L    93_A     1.409     0    0.024   1.399     4.755   81.429   68.214
LGA    F    94_A      F    94_A     1.059     0    0.072   0.066     1.454   81.429   85.541
LGA    L    95_A      L    95_A     1.303     0    0.050   1.396     4.003   77.143   67.679
LGA    V    96_A      V    96_A     1.872     0    0.012   0.029     2.338   68.810   69.388
LGA    D    97_A      D    97_A     2.607     0    0.026   0.043     2.974   59.048   59.048
LGA    D    98_A      D    98_A     2.576     0    0.051   0.847     3.436   57.262   59.167
LGA    A    99_A      A    99_A     2.726     0    0.038   0.041     2.947   57.143   57.143
LGA    V   100_A      V   100_A     2.084     0    0.169   0.903     3.154   68.810   66.122
LGA    E   101_A      E   101_A     2.068     0    0.223   0.925     6.318   56.190   46.825
LGA    S   102_A      S   102_A     3.971     0    0.399   0.383     5.040   46.786   40.794
LGA    Y   103_A      Y   103_A     4.147     0    0.631   0.554     5.092   34.405   38.810
LGA    S   104_A      S   104_A     4.587     0    0.635   0.561     6.709   54.048   40.476
LGA    A   105_A      A   105_A     4.795     0    0.070   0.066     7.378   32.976   28.381
LGA    N   106_A      N   106_A     2.654     0    0.471   1.020     3.459   61.190   57.381
LGA    E   107_A      E   107_A     5.270     0    0.585   1.062    11.486   37.976   18.677
LGA    M   108_A      M   108_A     4.524     0    0.028   0.098     7.785   41.190   27.321
LGA    Q   109_A      Q   109_A     1.577     0    0.074   1.342     4.347   77.738   66.032
LGA    D   110_A      D   110_A     2.463     0    0.014   0.856     4.908   59.524   50.000
LGA    L   111_A      L   111_A     3.769     0    0.034   0.087     5.638   50.119   38.988
LGA    S   112_A      S   112_A     1.207     0    0.050   0.613     2.245   72.976   71.587
LGA    R   113_A      R   113_A     3.262     0    0.022   1.149     5.807   44.524   45.455
LGA    S   114_A      S   114_A     5.573     0    0.031   0.030     6.412   25.476   22.698
LGA    Y   115_A      Y   115_A     4.403     0    0.021   1.181    11.124   34.405   20.913
LGA    D   116_A      D   116_A     4.313     0    0.016   0.076     6.268   29.762   42.679
LGA    I   117_A      I   117_A     7.270     0    0.009   1.239     9.624    9.286   11.548
LGA    L   118_A      L   118_A     8.003     0    0.040   0.894     9.514    6.667    5.000
LGA    E   119_A      E   119_A     6.853     0    0.193   0.965     9.376   12.500    8.783
LGA    K   120_A      K   120_A     7.632     0    0.140   0.768    11.438    6.190    3.968
LGA    E   121_A      E   121_A     9.501     0    0.033   0.774    12.193    0.952    0.476
LGA    V   122_A      V   122_A     9.113     0    0.185   1.162     9.113    4.048    3.537
LGA    C   123_A      C   123_A     7.064     0    0.119   0.184     7.793    8.571   12.143
LGA    K   124_A      K   124_A     8.577     0    0.038   0.709     9.556    2.381    7.407
LGA    T   125_A      T   125_A     9.627     0    0.212   1.092    11.013    0.595    2.449
LGA    F   126_A      F   126_A    11.109     0    0.088   0.192    18.926    0.119    0.043
LGA    P   127_A      P   127_A    14.478     0    0.017   0.357    15.993    0.000    0.000
LGA    T   152_A      T   152_A     6.537     0    0.618   0.896     7.156   12.500   20.612
LGA    F   153_A      F   153_A     6.770     0    0.049   1.172    12.544   13.333    6.580
LGA    C   154_A      C   154_A     6.736     0    0.028   0.031     6.966   13.333   13.333
LGA    M   155_A      M   155_A     6.218     0    0.083   0.771     8.389   17.143   14.345
LGA    Q   156_A      Q   156_A     6.224     0    0.030   1.501    10.683   15.238   10.265
LGA    Y   157_A      Y   157_A     7.599     0    0.041   0.308    10.878    8.571    3.889
LGA    V   158_A      V   158_A     7.191     0    0.015   0.073     7.307   10.833   11.429
LGA    N   159_A      N   159_A     6.251     0    0.044   0.895     6.493   17.143   17.143
LGA    K   160_A      K   160_A     6.410     0    0.016   0.808     9.035   16.190   10.582
LGA    I   161_A      I   161_A     7.208     0    0.057   1.497    10.483   10.000    9.345
LGA    T   162_A      T   162_A     6.698     0    0.059   0.079     7.138   15.238   14.490
LGA    A   163_A      A   163_A     5.280     0    0.043   0.045     5.800   26.310   26.286
LGA    I   164_A      I   164_A     5.302     0    0.018   0.057     5.948   25.000   23.810
LGA    L   165_A      L   165_A     6.705     0    0.194   1.374     7.487   15.238   15.476
LGA    L   166_A      L   166_A     6.088     0    0.087   1.402     7.016   20.476   22.202
LGA    E   167_A      E   167_A     4.128     0    0.049   0.188     4.735   35.714   47.725
LGA    E   168_A      E   168_A     5.368     0    0.656   1.048     5.974   25.119   25.238
LGA    G   169_A      G   169_A     6.937     0    0.142   0.142     6.937   19.762   19.762
LGA    N   170_A      N   170_A     5.291     0    0.463   0.438     7.938   20.476   29.643
LGA    T   171_A      T   171_A     6.301     0    0.623   0.655     9.672   29.405   18.095
LGA    P   172_A      P   172_A     1.827     0    0.707   0.640     4.741   74.405   62.449
LGA    H   173_A      H   173_A     3.791     0    0.521   1.367    10.474   55.714   25.143
LGA    H   174_A      H   174_A     4.208     0    0.146   1.150     4.698   35.714   39.524
LGA    V   175_A      V   175_A     4.843     0    0.055   1.213     7.850   34.286   25.578
LGA    V   176_A      V   176_A     4.019     0    0.027   0.031     4.736   40.238   38.095
LGA    Y   177_A      Y   177_A     3.531     0    0.063   0.155     5.555   43.333   37.500
LGA    N   178_A      N   178_A     3.948     0    0.043   0.139     5.413   43.333   36.726
LGA    L   179_A      L   179_A     4.071     0    0.007   0.956     6.706   41.786   34.345
LGA    R   180_A      R   180_A     3.501     0    0.021   0.874     3.553   46.667   57.100
LGA    R   181_A      R   181_A     3.389     0    0.000   1.473     6.383   50.000   37.229
LGA    R   182_A      R   182_A     3.629     0    0.082   1.427     8.351   48.333   38.918
LGA    T   183_A      T   183_A     3.635     0    0.041   0.092     4.768   45.000   40.816
LGA    S   184_A      S   184_A     3.985     0    0.005   0.620     4.515   41.786   41.429
LGA    N   185_A      N   185_A     3.904     0    0.030   0.056     5.639   43.333   35.536
LGA    A   186_A      A   186_A     3.389     0    0.030   0.035     3.723   50.000   48.667
LGA    I   187_A      I   187_A     3.944     0    0.037   0.077     5.574   43.452   34.940
LGA    S   188_A      S   188_A     4.579     0    0.042   0.688     5.321   35.714   35.397
LGA    I   189_A      I   189_A     3.656     0    0.047   0.651     5.661   46.667   38.512
LGA    A   190_A      A   190_A     3.363     0    0.042   0.047     3.757   50.000   48.667
LGA    F   191_A      F   191_A     4.022     0    0.016   1.321    12.120   41.786   19.524
LGA    Q   192_A      Q   192_A     4.084     0    0.016   1.009     7.111   41.786   29.894
LGA    A   193_A      A   193_A     3.556     0    0.003   0.008     4.041   48.333   46.095
LGA    V   194_A      V   194_A     3.837     0    0.051   0.954     5.696   45.000   39.456
LGA    L   195_A      L   195_A     4.186     0    0.067   0.076     7.256   41.786   29.702
LGA    I   196_A      I   196_A     4.056     0    0.077   0.072     6.319   41.786   33.512
LGA    K   197_A      K   197_A     3.544     0    0.231   0.546     5.781   46.667   39.101
LGA    S   198_A      S   198_A     2.495     0    0.666   0.821     4.703   57.262   52.937
LGA    K   199_A      K   199_A     4.867     0    0.703   0.833    10.090   27.738   17.460
LGA    C   200_A      C   200_A     5.150     0    0.209   0.193     7.665   27.738   24.048
LGA    G   201_A      G   201_A     6.782     0    0.415   0.415     6.782   21.786   21.786
LGA    S   202_A      S   202_A     6.837     0    0.041   0.670    10.138    7.381   10.714
LGA    I   204_A      I   204_A     4.699     0    0.510   0.912     9.546   37.262   21.786
LGA    T   205_A      T   205_A     3.075     0    0.040   0.177     3.471   53.571   55.170
LGA    S   206_A      S   206_A     2.819     0    0.321   0.613     4.308   53.690   51.508
LGA    H   207_A      H   207_A     1.901     0    0.017   1.205     7.381   66.786   47.524
LGA    E   208_A      E   208_A     2.454     0    0.034   0.953     4.824   60.952   52.857
LGA    M   209_A      M   209_A     3.163     0    0.020   0.671     5.500   53.571   47.143
LGA    L   210_A      L   210_A     2.063     0    0.032   0.195     2.512   62.857   68.988
LGA    W   211_A      W   211_A     2.664     0    0.031   1.606     5.054   55.476   50.408
LGA    R   212_A      R   212_A     3.636     0    0.074   1.384     7.159   45.000   34.675
LGA    R   213_A      R   213_A     3.457     0    0.009   0.995     3.890   50.000   50.043
LGA    V   214_A      V   214_A     3.400     0    0.096   0.144     3.749   48.333   49.048
LGA    F   215_A      F   215_A     3.298     0    0.171   0.159     3.990   48.333   46.970
LGA    D   216_A      D   216_A     3.168     0    0.170   0.777     4.408   51.786   46.845
LGA    G   217_A      G   217_A     2.632     0    0.056   0.056     2.769   60.952   60.952
LGA    L   218_A      L   218_A     1.921     0    0.232   0.202     3.021   63.095   68.036
LGA    V   219_A      V   219_A     2.338     0    0.026   0.084     3.027   64.762   60.476
LGA    I   220_A      I   220_A     2.021     0    0.053   1.386     4.813   64.762   61.012
LGA    L   221_A      L   221_A     1.890     0    0.033   0.191     2.268   68.810   72.976
LGA    F   222_A      F   222_A     2.289     0    0.069   0.362     3.154   64.762   61.342
LGA    Y   223_A      Y   223_A     2.421     0    0.071   0.146     3.008   64.762   60.357
LGA    Q   224_A      Q   224_A     2.107     0    0.130   0.949     5.007   68.810   61.587
LGA    F   225_A      F   225_A     1.895     0    0.135   0.829     4.724   77.381   61.169
LGA    G   226_A      G   226_A     1.408     0    0.047   0.047     1.660   81.548   81.548
LGA    E   227_A      E   227_A     1.972     0    0.000   0.532     4.976   72.857   58.148
LGA    L   228_A      L   228_A     1.265     0    0.008   0.091     1.902   79.286   80.417
LGA    I   229_A      I   229_A     0.745     0    0.093   0.948     3.814   90.595   79.345
LGA    S   230_A      S   230_A     1.291     0    0.021   0.025     2.256   77.381   78.730
LGA    G   231_A      G   231_A     2.247     0    0.060   0.060     3.069   61.190   61.190
LGA    A   232_A      A   232_A     2.884     0    0.463   0.451     3.547   57.262   54.476
LGA    T   233_A      T   233_A     2.390     0    0.621   0.596     4.199   57.857   59.728
LGA    E   234_A      E   234_A     2.912     0    0.621   1.080     9.339   67.024   34.762
LGA    T   235_A      T   235_A     4.001     0    0.667   0.661     6.849   45.595   34.082
LGA    A   236_A      A   236_A     5.900     0    0.069   0.075     8.212   27.857   23.238
LGA    Q   237_A      Q   237_A     5.069     0    0.088   1.147    11.650   31.548   15.608
LGA    Q   238_A      Q   238_A     3.675     0    0.091   0.762     5.176   42.500   40.370
LGA    H   239_A      H   239_A     3.440     0    0.071   0.110     9.341   48.571   25.286
LGA    I   240_A      I   240_A     3.950     0    0.068   0.296     6.965   42.262   35.298
LGA    T   241_A      T   241_A     3.623     0    0.233   0.284     4.501   48.333   45.442
LGA    V   242_A      V   242_A     3.500     0    0.028   0.036     3.689   46.667   46.190
LGA    V   243_A      V   243_A     3.627     0    0.036   0.063     3.844   45.000   44.286
LGA    T   244_A      T   244_A     3.460     0    0.006   0.026     3.954   50.119   47.211
LGA    E   245_A      E   245_A     2.817     0    0.033   0.657     4.162   55.357   52.540
LGA    L   246_A      L   246_A     2.608     0    0.040   0.114     2.719   59.048   58.095
LGA    R   247_A      R   247_A     2.882     0    0.025   1.004     6.373   57.143   49.177
LGA    M   248_A      M   248_A     2.514     0    0.013   0.683     5.286   60.952   53.631
LGA    L   249_A      L   249_A     2.208     0    0.023   0.061     2.335   64.762   65.774
LGA    G   250_A      G   250_A     2.553     0    0.018   0.018     2.617   59.048   59.048
LGA    C   251_A      C   251_A     2.767     0    0.040   0.047     3.010   57.143   55.952
LGA    L   252_A      L   252_A     2.213     0    0.012   1.394     4.743   64.762   58.810
LGA    Y   253_A      Y   253_A     2.115     0    0.000   0.463     2.537   64.762   70.357
LGA    C   254_A      C   254_A     2.571     0    0.010   0.797     5.592   59.048   52.460
LGA    I   255_A      I   255_A     2.924     0    0.041   0.632     4.871   57.143   51.250
LGA    V   256_A      V   256_A     2.214     0    0.087   0.118     2.391   64.762   64.762
LGA    I   257_A      I   257_A     2.099     0    0.030   0.096     2.199   64.762   66.786
LGA    N   258_A      N   258_A     2.536     0    0.031   0.640     4.287   59.048   54.702
LGA    D   259_A      D   259_A     2.628     0    0.093   0.224     3.262   59.048   57.202
LGA    L   260_A      L   260_A     2.135     0    0.082   0.093     2.249   64.762   66.786
LGA    Y   261_A      Y   261_A     2.114     0    0.014   0.783     4.429   60.952   57.937
LGA    S   262_A      S   262_A     3.205     0    0.199   0.607     5.233   46.905   42.857
LGA    Y   263_A      Y   263_A     3.374     0    0.145   0.161     5.123   44.167   43.333
LGA    Q   264_A      Q   264_A     4.138     0    0.318   1.003     6.280   33.929   33.333
LGA    R   265_A      R   265_A     5.279     0    0.645   1.158     7.276   20.238   30.303
LGA    D   266_A      D   266_A     9.629     0    0.015   1.397    15.733    3.810    1.905
LGA    K   267_A      K   267_A     5.892     0    0.634   0.469    13.782   28.810   15.450
LGA    L   268_A      L   268_A     1.809     0    0.644   1.390     7.480   63.214   43.095
LGA    A   269_A      A   269_A     5.429     0    0.223   0.235     7.139   30.238   26.190
LGA    S   270_A      S   270_A     2.689     0    0.658   0.751     4.749   47.262   49.365
LGA    S   271_A      S   271_A     2.057     0    0.224   0.335     3.265   61.071   62.302
LGA    D   272_A      D   272_A     2.062     0    0.262   0.874     6.825   66.786   47.857
LGA    N   273_A      N   273_A     5.150     0    0.258   0.876    10.289   25.238   13.690
LGA    M   274_A      M   274_A     4.830     0    0.652   1.074     8.005   31.548   22.976
LGA    I   275_A      I   275_A     6.490     0    0.018   1.149     9.108   20.476   13.155
LGA    K   276_A      K   276_A     5.623     0    0.007   0.659    10.691   27.619   17.989
LGA    T   277_A      T   277_A     3.872     0    0.000   0.076     5.783   40.238   34.286
LGA    W   278_A      W   278_A     6.608     0    0.066   1.354    13.104   15.714    5.374
LGA    L   279_A      L   279_A     7.406     0    0.092   1.404    12.551   10.952    6.071
LGA    L   280_A      L   280_A     4.623     0    0.070   0.910     5.837   30.119   31.726
LGA    E   281_A      E   281_A     6.061     0    0.043   1.471     7.626   15.952   19.894
LGA    K   282_A      K   282_A     7.807     0    0.399   0.651     8.365    8.095   11.481
LGA    T   283_A      T   283_A     7.743     0    0.678   0.932     9.243    8.571   11.020
LGA    V   284_A      V   284_A     9.727     0    0.564   0.569    12.282    2.381    1.361
LGA    S   285_A      S   285_A     8.787     0    0.085   0.121    10.513    4.048    2.698
LGA    S   286_A      S   286_A     4.942     0    0.422   0.720     6.284   27.857   29.048
LGA    L   287_A      L   287_A     5.758     0    0.020   1.389    10.062   23.810   15.298
LGA    S   288_A      S   288_A     4.934     0    0.032   0.589     5.125   32.976   32.460
LGA    E   289_A      E   289_A     3.506     0    0.024   0.600     4.071   48.452   44.921
LGA    A   290_A      A   290_A     3.534     0    0.021   0.027     4.062   45.000   43.429
LGA    T   291_A      T   291_A     3.830     0    0.029   0.029     4.387   45.000   41.633
LGA    A   292_A      A   292_A     3.095     0    0.035   0.036     3.386   55.476   54.381
LGA    R   293_A      R   293_A     2.237     0    0.014   1.569     4.063   62.857   59.654
LGA    C   294_A      C   294_A     2.814     0    0.013   0.022     3.441   57.143   54.762
LGA    S   295_A      S   295_A     2.780     0    0.016   0.653     3.190   60.952   58.492
LGA    Q   296_A      Q   296_A     1.787     0    0.027   0.298     2.163   72.976   73.862
LGA    I   297_A      I   297_A     1.659     0    0.017   0.035     2.190   75.000   72.917
LGA    L   298_A      L   298_A     2.013     0    0.030   1.418     3.918   68.810   68.274
LGA    D   299_A      D   299_A     1.772     0    0.038   0.071     2.514   77.143   71.012
LGA    A   300_A      A   300_A     0.902     0    0.003   0.007     1.255   88.214   88.667
LGA    I   301_A      I   301_A     0.794     0    0.022   0.659     3.620   90.476   81.190
LGA    M   302_A      M   302_A     1.032     0    0.034   1.424     5.816   88.214   75.417
LGA    K   303_A      K   303_A     1.077     0    0.031   0.215     1.238   85.952   85.450
LGA    Y   304_A      Y   304_A     0.688     0    0.057   0.391     1.958   88.214   84.603
LGA    M   305_A      M   305_A     0.689     0    0.015   1.024     4.309   88.214   82.679
LGA    Y   306_A      Y   306_A     1.374     0    0.074   0.256     2.527   77.143   71.667
LGA    Q   307_A      Q   307_A     1.397     0    0.020   1.400     4.372   79.286   68.624
LGA    R   308_A      R   308_A     1.368     0    0.034   1.120     5.619   81.429   58.268
LGA    V   309_A      V   309_A     1.378     0    0.202   1.232     3.612   75.119   70.000
LGA    E   310_A      E   310_A     0.875     0    0.066   0.905     5.381   88.214   67.302
LGA    Q   311_A      Q   311_A     0.986     0    0.391   0.947     5.469   86.071   65.344
LGA    C   312_A      C   312_A     1.555     0    0.667   0.612     5.110   79.405   65.635
LGA    M   313_A      M   313_A     4.556     0    0.613   0.670    13.564   37.500   20.357
LGA    Q   314_A      Q   314_A     6.889     0    0.663   1.047     7.902   12.262   10.741
LGA    S   315_A      S   315_A     8.889     0    0.242   0.250    10.331    4.286    2.857
LGA    N   316_A      N   316_A     8.685     0    0.356   0.405    10.910    1.905    1.905
LGA    P   317_A      P   317_A    10.551     0    0.568   0.830    12.674    1.071    0.612
LGA    G   318_A      G   318_A     8.169     0    0.371   0.371     8.597   10.595   10.595
LGA    C   319_A      C   319_A     1.866     0    0.539   0.504     3.865   65.476   69.365
LGA    P   320_A      P   320_A     1.688     0    0.074   0.346     2.079   75.000   75.442
LGA    Q   321_A      Q   321_A     1.631     0    0.064   0.573     3.582   72.857   67.778
LGA    L   322_A      L   322_A     1.446     0    0.007   0.039     1.620   81.429   78.214
LGA    E   323_A      E   323_A     1.435     0    0.035   0.138     1.497   81.429   81.429
LGA    S   324_A      S   324_A     1.502     0    0.016   0.603     2.054   79.286   75.794
LGA    L   325_A      L   325_A     1.316     0    0.028   0.094     1.673   81.429   79.286
LGA    L   326_A      L   326_A     1.498     0    0.009   0.035     1.829   77.143   75.000
LGA    E   327_A      E   327_A     1.654     0    0.016   0.886     5.011   72.857   59.788
LGA    T   328_A      T   328_A     1.358     0    0.027   0.054     1.512   79.286   80.204
LGA    T   329_A      T   329_A     1.749     0    0.015   0.083     2.329   68.810   69.388
LGA    I   330_A      I   330_A     2.457     0    0.012   0.086     3.021   62.857   59.107
LGA    Y   331_A      Y   331_A     2.285     0    0.011   1.269     6.823   64.762   54.127
LGA    T   332_A      T   332_A     1.767     0    0.106   1.070     3.035   66.905   65.170
LGA    T   333_A      T   333_A     2.567     0    0.044   0.058     3.189   57.262   56.190
LGA    V   334_A      V   334_A     3.092     0    0.057   0.066     3.552   53.571   50.136
LGA    G   335_A      G   335_A     2.679     0    0.164   0.164     2.786   60.952   60.952
LGA    W   336_A      W   336_A     2.299     0    0.044   0.043     3.301   66.905   58.435
LGA    I   337_A      I   337_A     1.398     0    0.019   0.278     1.804   83.810   82.619
LGA    R   338_A      R   338_A     1.142     0    0.066   0.972     5.839   81.429   60.693
LGA    S   339_A      S   339_A     1.701     0    0.036   0.669     2.368   77.143   74.365
LGA    H   340_A      H   340_A     3.373     0    0.659   1.166     9.035   35.833   20.667
LGA    T   341_A      T   341_A     9.099     0    0.600   0.895    12.591    3.810    2.177
LGA    T   342_A      T   342_A    11.380     0    0.648   0.862    14.728    0.000    0.000
LGA    V   343_A      V   343_A    12.468     0    0.645   1.016    16.382    0.000    0.000
LGA    V   344_A      V   344_A    11.676     0    0.384   1.283    14.195    0.000    0.000
LGA    P   345_A      P   345_A     9.391     0    0.290   0.349     9.593    2.976    2.517
LGA    R   346_A      R   346_A     8.506     0    0.454   0.845    10.125    2.143    2.468
LGA    Y   347_A      Y   347_A     8.195     0    0.457   1.393     8.781    4.881   14.881
LGA    S   348_A      S   348_A     8.332     0    0.585   0.968     8.656    4.286    6.905

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      288    1152   1152  100.00    2312   2312  100.00               411
SUMMARY(RMSD_GDC):     4.801          4.719                  5.559           29.049   26.082

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  289  411    4.0    159    2.74    33.151    28.105     5.600

LGA_LOCAL      RMSD:   2.739  Number of atoms:  159  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   5.249  Number of assigned atoms:  288 
Std_ASGN_ATOMS RMSD:   4.801  Standard rmsd on all 288 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.395857 * X  +   0.863425 * Y  +  -0.312720 * Z  +   7.332264
  Y_new =   0.269082 * X  +  -0.434651 * Y  +  -0.859461 * Z  + -48.398880
  Z_new =  -0.878005 * X  +   0.256077 * Y  +  -0.404392 * Z  +  51.004372 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  0.597002  1.071677  2.577090   [DEG:   34.2057   61.4026  147.6564 ]
ZXZ: -0.348965  1.987110 -1.287010   [DEG:  -19.9942  113.8530  -73.7403 ]
 
# END of job
