
#######################################################
#                                                     #
#                        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  313 ( 2327),  selected  281 , name one
# Molecule2: number of CA atoms  281 ( 1997),  selected  281 , 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:   281       6_B - 313_B       3.97     3.97
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   137      13_B - 149_B       2.00     4.22
  LCS_AVERAGE:     39.02

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   100      51_B - 150_B       0.96     5.09
  LONGEST_CONTINUOUS_SEGMENT:   100      52_B - 151_B       0.98     5.02
  LCS_AVERAGE:     23.20

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  281
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     H     6_B     H     6_B      3   16  281      3    3   36   71  101  152  200  233  242  249  253  255  258  261  267  270  272  274  276  276 
LCS_GDT     H     7_B     H     7_B     12   16  281      5   21   69   91  108  143  156  176  196  225  249  254  257  259  261  267  271  273  276  276 
LCS_GDT     T     8_B     T     8_B     12   16  281      4    6   69   91  124  147  170  221  242  249  253  255  257  261  264  270  272  274  276  276 
LCS_GDT     K     9_B     K     9_B     12   16  281      4   12   69   91  117  143  159  184  240  249  253  255  257  261  264  270  272  274  276  276 
LCS_GDT     I    10_B     I    10_B     12   16  281      7   63   97  115  138  170  204  233  242  249  253  255  258  261  267  270  272  274  276  276 
LCS_GDT     T    11_B     T    11_B     12   16  281      7   63   97  121  146  173  215  234  242  249  253  255  258  261  267  270  272  274  276  276 
LCS_GDT     N    12_B     N    12_B     12   16  281      7   12   97  119  146  174  215  233  242  249  253  255  258  261  267  270  272  274  276  276 
LCS_GDT     S    13_B     S    13_B     12  137  281      7   12   97  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     I    14_B     I    14_B     12  137  281     11   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     V    15_B     V    15_B     12  137  281      7   76   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     N    16_B     N    16_B     12  137  281     52   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     L    17_B     L    17_B     12  137  281      6   76   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     I    18_B     I    18_B     29  137  281     12   74  112  126  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G    19_B     G    19_B     29  137  281      5   57  115  127  133  153  210  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     N    20_B     N    20_B     29  137  281     12   99  116  127  133  153  215  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     T    21_B     T    21_B     29  137  281     73   99  116  127  145  191  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     P    22_B     P    22_B     29  137  281     68   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     I    23_B     I    23_B     29  137  281     65   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     V    24_B     V    24_B     29  137  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     K    25_B     K    25_B     29  137  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     L    26_B     L    26_B     29  137  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     N    27_B     N    27_B     29  137  281     72   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     R    28_B     R    28_B     29  137  281     74   99  116  127  152  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     V    29_B     V    29_B     29  137  281     74   99  116  127  152  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     V    30_B     V    30_B     29  137  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     P    31_B     P    31_B     29  137  281     73   99  116  127  151  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     E    32_B     E    32_B     29  137  281     69   99  116  127  150  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     D    33_B     D    33_B     29  137  281     73   99  116  127  133  191  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     A    34_B     A    34_B     29  137  281     74   99  116  127  149  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     A    35_B     A    35_B     29  137  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     D    36_B     D    36_B     29  137  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     V    37_B     V    37_B     29  137  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     Y    38_B     Y    38_B     29  137  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     V    39_B     V    39_B     29  137  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     K    40_B     K    40_B     29  137  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     L    41_B     L    41_B     29  137  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     E    42_B     E    42_B     29  137  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     F    43_B     F    43_B     29  137  281     64   99  116  127  148  191  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     F    44_B     F    44_B     29  137  281      5   95  114  127  134  170  204  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     N    45_B     N    45_B     29  137  281     36   93  114  127  133  143  204  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     P    46_B     P    46_B     29  137  281      8   21   47  125  133  139  148  186  237  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G    47_B     G    47_B     33  137  281     22   72   93  113  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G    48_B     G    48_B     33  137  281      9   18   29   68  100  166  213  231  240  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     S    49_B     S    49_B     33  137  281      4   27   65   96  123  186  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     I    50_B     I    50_B     99  137  281      3   27   61   93  121  186  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     K    51_B     K    51_B    100  137  281      7   22   64   97  119  180  216  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     D    52_B     D    52_B    100  137  281     37   76   96  116  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     R    53_B     R    53_B    100  137  281     20   76   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     I    54_B     I    54_B    100  137  281      9   40   88  116  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     A    55_B     A    55_B    100  137  281      9   63   91  116  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     L    56_B     L    56_B    100  137  281     53   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     A    57_B     A    57_B    100  137  281     26   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     M    58_B     M    58_B    100  137  281     27   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     I    59_B     I    59_B    100  137  281     53   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     E    60_B     E    60_B    100  137  281     53   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     E    61_B     E    61_B    100  137  281     51   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     A    62_B     A    62_B    100  137  281     53   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     E    63_B     E    63_B    100  137  281     48   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     K    64_B     K    64_B    100  137  281     42   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     A    65_B     A    65_B    100  137  281     53   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G    66_B     G    66_B    100  137  281     51   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     K    67_B     K    67_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     L    68_B     L    68_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     Q    69_B     Q    69_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     A    70_B     A    70_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G    71_B     G    71_B    100  137  281     53   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G    72_B     G    72_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     T    73_B     T    73_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     I    74_B     I    74_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     V    75_B     V    75_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     E    76_B     E    76_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     P    77_B     P    77_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     T    78_B     T    78_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     S    79_B     S    79_B    100  137  281     39   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G    80_B     G    80_B    100  137  281     16   46   97  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     N    81_B     N    81_B    100  137  281     16   70  109  123  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     T    82_B     T    82_B    100  137  281     17   48  106  123  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G    83_B     G    83_B    100  137  281     17   69   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     V    84_B     V    84_B    100  137  281     19   69   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G    85_B     G    85_B    100  137  281     19   63   97  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     L    86_B     L    86_B    100  137  281     19   68   98  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     A    87_B     A    87_B    100  137  281     46   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     M    88_B     M    88_B    100  137  281     42   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     V    89_B     V    89_B    100  137  281     19   72   97  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     A    90_B     A    90_B    100  137  281     19   76   97  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     A    91_B     A    91_B    100  137  281     48   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     A    92_B     A    92_B    100  137  281     23   76   97  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     K    93_B     K    93_B    100  137  281     19   74   97  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G    94_B     G    94_B    100  137  281     38   77   97  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     Y    95_B     Y    95_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     H    96_B     H    96_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     L    97_B     L    97_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     V    98_B     V    98_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     I    99_B     I    99_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     T   100_B     T   100_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     M   101_B     M   101_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     P   102_B     P   102_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     E   103_B     E   103_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     T   104_B     T   104_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     M   105_B     M   105_B    100  137  281     11   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     S   106_B     S   106_B    100  137  281      3    3   65  117  150  188  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     V   107_B     V   107_B    100  137  281      6   53   97  121  152  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     E   108_B     E   108_B    100  137  281     16   48   96  121  150  190  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     R   109_B     R   109_B    100  137  281     15   73   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     R   110_B     R   110_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     K   111_B     K   111_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     L   112_B     L   112_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     M   113_B     M   113_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     Q   114_B     Q   114_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G   115_B     G   115_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     Y   116_B     Y   116_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G   117_B     G   117_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     A   118_B     A   118_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     E   119_B     E   119_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     L   120_B     L   120_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     I   121_B     I   121_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     L   122_B     L   122_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     T   123_B     T   123_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     P   124_B     P   124_B    100  137  281     54   77   99  121  153  189  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G   125_B     G   125_B    100  137  281     54   77   99  121  153  188  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     A   126_B     A   126_B    100  137  281     36   77   97  120  145  175  205  227  240  249  252  254  258  262  267  270  272  274  276  276 
LCS_GDT     D   127_B     D   127_B    100  137  281     54   77   99  121  153  189  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G   128_B     G   128_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     M   129_B     M   129_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     K   130_B     K   130_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G   131_B     G   131_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     A   132_B     A   132_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     I   133_B     I   133_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     A   134_B     A   134_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     K   135_B     K   135_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     A   136_B     A   136_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     E   137_B     E   137_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     E   138_B     E   138_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     L   139_B     L   139_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     V   140_B     V   140_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     K   141_B     K   141_B    100  137  281     53   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     E   142_B     E   142_B    100  137  281     41   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     K   143_B     K   143_B    100  137  281     42   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G   144_B     G   144_B    100  137  281     49   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     Y   145_B     Y   145_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     F   146_B     F   146_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     M   147_B     M   147_B    100  137  281     54   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     P   148_B     P   148_B    100  137  281     53   77   99  121  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     M   149_B     M   149_B    100  137  281      3   27   86  116  150  190  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     Q   150_B     Q   150_B    100  132  281      8   58   87  106  150  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     F   151_B     F   151_B    100  132  281      3    8   45  109  150  190  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     D   152_B     D   152_B      6  131  281     10   34   56   75   99  146  203  233  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     N   153_B     N   153_B      6  121  281      4    6   33   51   73   99  134  147  196  228  246  255  258  262  267  270  272  274  276  276 
LCS_GDT     P   154_B     P   154_B      6  120  281      4   13   35   48   56   91  109  137  177  211  236  251  258  262  267  270  272  274  276  276 
LCS_GDT     A   155_B     A   155_B      6  110  281      4    6    6    7   10   12   23   29   71   85   96  118  150  180  210  245  256  270  272  276 
LCS_GDT     H   160_B     H   160_B      4   18  281      3    4    5    7   17   20   24   27   34   43   52   88  106  149  232  257  262  267  272  276 
LCS_GDT     E   161_B     E   161_B      4   18  281      3    4    5   15   20   30   53  112  168  204  224  243  254  262  267  270  272  274  276  276 
LCS_GDT     E   162_B     E   162_B     12   18  281      3    6   23   42   66   90  111  144  197  231  241  251  258  262  267  270  272  274  276  276 
LCS_GDT     T   163_B     T   163_B     12   18  281      8   11   14   18   31   55   80  117  158  196  220  238  254  262  267  270  272  274  276  276 
LCS_GDT     T   164_B     T   164_B     12   18  281      9   11   14   18   21   27   44   71  104  157  207  228  247  255  265  268  272  274  276  276 
LCS_GDT     G   165_B     G   165_B     12   18  281      9   11   14   18   33   58   92  149  197  220  238  251  258  262  267  270  272  274  276  276 
LCS_GDT     K   166_B     K   166_B     12   18  281      9   11   14   31   51   82  127  179  212  239  246  255  258  262  267  270  272  274  276  276 
LCS_GDT     E   167_B     E   167_B     12   18  281      9   11   27   46   55   76  103  140  148  170  205  236  254  262  267  270  272  274  276  276 
LCS_GDT     I   168_B     I   168_B     12   18  281      9   11   14   23   48   68  103  133  147  153  176  227  249  262  267  270  272  274  276  276 
LCS_GDT     L   169_B     L   169_B     12   44  281      9   18   48   97  126  138  141  146  163  208  237  251  258  262  267  270  272  274  276  276 
LCS_GDT     E   170_B     E   170_B     12   44  281      9   17   51   95  121  138  141  144  150  165  192  231  249  262  267  270  272  274  276  276 
LCS_GDT     A   171_B     A   171_B     12   44  281      9   11   14   29   65   99  118  138  145  150  155  165  183  229  256  266  270  274  276  276 
LCS_GDT     F   172_B     F   172_B     12   44  281      9   11   14   22   56   99  120  138  145  150  159  176  224  252  260  268  272  274  276  276 
LCS_GDT     G   173_B     G   173_B     12   44  281      6   11   17   35   47   85  115  137  141  150  155  165  202  242  256  266  271  274  276  276 
LCS_GDT     D   174_B     D   174_B      4   44  281      4    6   14   29   47   77  111  136  141  150  155  165  176  198  244  264  269  274  276  276 
LCS_GDT     D   175_B     D   175_B      4   44  281      4    6   17   35   60  102  130  142  147  152  181  225  249  257  267  270  272  274  276  276 
LCS_GDT     I   176_B     I   176_B     37   44  281      8   84  110  127  133  139  159  212  237  247  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     P   177_B     P   177_B     37   44  281     68   99  116  127  143  191  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     D   178_B     D   178_B     37   44  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     A   179_B     A   179_B     37   44  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     F   180_B     F   180_B     37   44  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     V   181_B     V   181_B     37   44  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     A   182_B     A   182_B     37   44  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G   183_B     G   183_B     37   44  281     26   91  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     V   184_B     V   184_B     37   44  281     26   91  114  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G   185_B     G   185_B     37   44  281     18   66   99  124  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     T   186_B     T   186_B     37   44  281      4   24   57  101  130  138  181  215  240  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G   187_B     G   187_B     37   44  281      5   52  112  127  144  190  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G   188_B     G   188_B     37   44  281      6   35   75  115  131  151  208  232  240  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     T   189_B     T   189_B     37   44  281      6   34   55  101  133  181  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     L   190_B     L   190_B     37  100  281     18   54  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     T   191_B     T   191_B     37  100  281     18   75  115  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G   192_B     G   192_B     37  100  281     18   58  112  127  150  191  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     V   193_B     V   193_B     37  100  281     18   69  116  127  150  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G   194_B     G   194_B     37  100  281     18   93  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     H   195_B     H   195_B     37  100  281     18   93  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     A   196_B     A   196_B     37  100  281     19   99  116  127  149  191  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     L   197_B     L   197_B     37  100  281     59   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     K   198_B     K   198_B     37  100  281     35   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     K   199_B     K   199_B     37  100  281     19   98  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     A   200_B     A   200_B     37  100  281     35   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     N   201_B     N   201_B     37  100  281     36   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     P   202_B     P   202_B     37  100  281     19   98  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     N   203_B     N   203_B     37  100  281     48   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     V   204_B     V   204_B     37  100  281     72   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     Q   205_B     Q   205_B     37  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     I   206_B     I   206_B     37  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     Y   207_B     Y   207_B     37  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     A   208_B     A   208_B     37  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     L   209_B     L   209_B     37  100  281     73   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     E   210_B     E   210_B     37  100  281     73   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     P   211_B     P   211_B     37  100  281     36   96  116  127  146  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     A   212_B     A   212_B     37  100  281     28   85  114  127  146  185  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     P   236_B     P   236_B      3  100  281      0    3    3    7   10   23   34   49   92  136  149  151  157  167  175  186  197  245  254  271 
LCS_GDT     K   237_B     K   237_B      3  100  281      0    3    3    3    4    9   20   94  110  125  134  145  157  167  173  194  231  245  254  271 
LCS_GDT     V   238_B     V   238_B      5  100  281      3    5    8   10   15   28   40   75   82   96  111  130  148  154  173  186  197  232  243  271 
LCS_GDT     L   239_B     L   239_B      5  100  281      5    8   13   29   61  115  139  142  151  167  193  209  255  260  267  270  272  274  276  276 
LCS_GDT     D   240_B     D   240_B     74  100  281      5   11   72  102  129  138  142  174  193  236  246  255  258  262  267  270  272  274  276  276 
LCS_GDT     T   241_B     T   241_B     74  100  281      5   57  110  127  144  185  216  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     D   242_B     D   242_B     74  100  281     68   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     V   243_B     V   243_B     74  100  281     19   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     Y   244_B     Y   244_B     74  100  281     68   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     N   245_B     N   245_B     74  100  281     36   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G   246_B     G   246_B     74  100  281     64   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     I   247_B     I   247_B     74  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     L   248_B     L   248_B     74  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     E   249_B     E   249_B     74  100  281     73   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     I   250_B     I   250_B     74  100  281     74   99  116  127  151  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     K   251_B     K   251_B     74  100  281     74   99  116  127  133  183  216  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     S   252_B     S   252_B     74  100  281     74   99  116  127  133  168  214  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     D   253_B     D   253_B     74  100  281     74   99  116  127  133  168  203  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     D   254_B     D   254_B     74  100  281     74   99  116  127  133  183  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     A   255_B     A   255_B     74  100  281     74   99  116  127  146  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     I   256_B     I   256_B     74  100  281     74   99  116  127  133  168  215  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     T   257_B     T   257_B     74  100  281     74   99  116  127  133  175  216  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     M   258_B     M   258_B     74  100  281     74   99  116  127  151  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     A   259_B     A   259_B     74  100  281     74   99  116  127  151  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     R   260_B     R   260_B     74  100  281     74   99  116  127  133  183  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     E   261_B     E   261_B     74  100  281     74   99  116  127  146  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     V   262_B     V   262_B     74  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G   263_B     G   263_B     74  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     H   264_B     H   264_B     74  100  281     74   99  116  127  146  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     Q   265_B     Q   265_B     74  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     E   266_B     E   266_B     74  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G   267_B     G   267_B     74  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     I   268_B     I   268_B     74  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     L   269_B     L   269_B     74  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     V   270_B     V   270_B     74  100  281     69   99  116  127  151  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G   271_B     G   271_B     74  100  281     73   99  116  127  133  169  216  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     I   272_B     I   272_B     74  100  281     74   99  116  127  133  183  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     S   273_B     S   273_B     74  100  281     74   99  116  127  149  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     A   274_B     A   274_B     74  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G   275_B     G   275_B     74  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     A   276_B     A   276_B     74  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     N   277_B     N   277_B     74  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     I   278_B     I   278_B     74  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     K   279_B     K   279_B     74  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G   280_B     G   280_B     74  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     A   281_B     A   281_B     74  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     I   282_B     I   282_B     74  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     E   283_B     E   283_B     74  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     V   284_B     V   284_B     74  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     A   285_B     A   285_B     74  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     K   286_B     K   286_B     74  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     K   287_B     K   287_B     74  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     L   288_B     L   288_B     74  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G   289_B     G   289_B     74  100  281     74   99  116  127  133  191  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     K   290_B     K   290_B     74  100  281     74   99  116  127  133  175  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G   291_B     G   291_B     74  100  281     74   99  116  127  133  175  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     K   292_B     K   292_B     74  100  281     74   99  116  127  133  191  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     Q   293_B     Q   293_B     74  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     V   294_B     V   294_B     74  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     I   295_B     I   295_B     74  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     T   296_B     T   296_B     74  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     V   297_B     V   297_B     74  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     A   298_B     A   298_B     74  100  281     74   99  116  127  153  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     P   299_B     P   299_B     74  100  281     74   99  116  127  148  192  217  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     D   300_B     D   300_B     74  100  281     21   83  115  127  133  154  204  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G   301_B     G   301_B     74  100  281     38   99  116  127  133  173  216  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     G   302_B     G   302_B     74  100  281     64   99  116  127  133  166  215  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     D   303_B     D   303_B     74  100  281     44   99  116  127  133  170  215  234  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     R   304_B     R   304_B     74  100  281     38   99  116  127  133  139  204  233  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     Y   305_B     Y   305_B     74  100  281     40   99  116  127  133  139  161  233  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     L   306_B     L   306_B     74  100  281     61   99  116  127  133  139  182  233  242  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     S   307_B     S   307_B     74  100  281     40   99  116  127  133  139  145  173  236  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     T   308_B     T   308_B     74  100  281     12   83  114  127  133  139  145  161  181  245  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     E   309_B     E   309_B     74  100  281     12   28  108  125  133  139  145  160  173  228  249  255  258  262  267  270  272  274  276  276 
LCS_GDT     L   310_B     L   310_B     74  100  281     12   89  111  127  133  139  152  185  236  247  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     F   311_B     F   311_B     74  100  281     21   97  116  127  133  139  154  222  239  249  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     N   312_B     N   312_B     74  100  281      5   20   95  124  133  139  147  161  197  232  253  255  258  262  267  270  272  274  276  276 
LCS_GDT     Y   313_B     Y   313_B     74  100  281      5   20   30   59  123  137  147  161  187  231  248  255  258  262  267  270  272  274  276  276 
LCS_AVERAGE  LCS_A:  54.07  (  23.20   39.02  100.00 )

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     74     99    116    127    153    192    217    234    242    249    253    255    258    262    267    270    272    274    276    276 
GDT PERCENT_AT  26.33  35.23  41.28  45.20  54.45  68.33  77.22  83.27  86.12  88.61  90.04  90.75  91.81  93.24  95.02  96.09  96.80  97.51  98.22  98.22
GDT RMS_LOCAL    3.68   0.45   0.68   0.83   1.55   1.97   2.18   2.37   2.50   2.61   2.72   2.78   2.87   3.15   3.22   3.30   3.39   3.49   3.58   3.58
GDT RMS_ALL_AT   6.48   6.46   6.18   6.31   4.23   4.08   4.07   4.05   4.06   4.06   4.05   4.04   4.01   3.98   3.98   3.98   3.98   3.98   3.98   3.98

# Checking swapping
#   possible swapping detected:  D    33_B      D    33_B
#   possible swapping detected:  F    43_B      F    43_B
#   possible swapping detected:  E    60_B      E    60_B
#   possible swapping detected:  E    63_B      E    63_B
#   possible swapping detected:  Y    95_B      Y    95_B
#   possible swapping detected:  E   138_B      E   138_B
#   possible swapping detected:  F   146_B      F   146_B
#   possible swapping detected:  F   151_B      F   151_B
#   possible swapping detected:  E   162_B      E   162_B
#   possible swapping detected:  E   167_B      E   167_B
#   possible swapping detected:  F   172_B      F   172_B
#   possible swapping detected:  F   180_B      F   180_B
#   possible swapping detected:  E   210_B      E   210_B
#   possible swapping detected:  D   240_B      D   240_B
#   possible swapping detected:  D   242_B      D   242_B
#   possible swapping detected:  Y   244_B      Y   244_B
#   possible swapping detected:  D   253_B      D   253_B
#   possible swapping detected:  E   283_B      E   283_B
#   possible swapping detected:  D   300_B      D   300_B
#   possible swapping detected:  D   303_B      D   303_B
#   possible swapping detected:  Y   313_B      Y   313_B

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    H     6_B      H     6_B     5.148     0    0.174   1.078    11.355   39.405   18.238
LGA    H     7_B      H     7_B     7.948     0    0.636   1.264    12.825    7.619    3.048
LGA    T     8_B      T     8_B     6.339     0    0.069   0.367     6.596   17.262   19.728
LGA    K     9_B      K     9_B     6.727     4    0.021   0.103     7.674   16.310    8.042
LGA    I    10_B      I    10_B     4.737     0    0.030   0.593     6.556   28.810   27.202
LGA    T    11_B      T    11_B     3.937     0    0.024   0.114     4.053   41.786   43.401
LGA    N    12_B      N    12_B     3.818     0    0.054   1.117     6.401   46.667   38.690
LGA    S    13_B      S    13_B     2.710     0    0.074   0.124     3.146   59.167   58.492
LGA    I    14_B      I    14_B     1.343     0    0.053   0.098     1.879   79.286   82.619
LGA    V    15_B      V    15_B     0.957     0    0.034   0.309     2.031   83.690   77.959
LGA    N    16_B      N    16_B     2.367     0    0.018   0.117     3.647   61.190   54.762
LGA    L    17_B      L    17_B     2.487     0    0.109   0.139     3.100   62.857   60.060
LGA    I    18_B      I    18_B     2.249     0    0.045   0.087     2.980   62.976   69.048
LGA    G    19_B      G    19_B     4.118     0    0.679   0.679     4.609   40.476   40.476
LGA    N    20_B      N    20_B     4.007     0    0.063   0.269     5.024   41.905   39.702
LGA    T    21_B      T    21_B     3.210     0    0.025   0.121     3.957   50.119   48.163
LGA    P    22_B      P    22_B     1.962     0    0.019   0.088     2.295   70.833   70.544
LGA    I    23_B      I    23_B     1.656     0    0.099   0.092     3.191   77.143   68.155
LGA    V    24_B      V    24_B     1.233     0    0.091   1.067     3.664   81.429   72.517
LGA    K    25_B      K    25_B     1.396     0    0.023   0.147     2.847   81.429   72.222
LGA    L    26_B      L    26_B     1.314     0    0.030   0.066     1.852   77.143   81.548
LGA    N    27_B      N    27_B     2.192     0    0.035   0.167     2.922   64.881   64.821
LGA    R    28_B      R    28_B     2.527     0    0.062   1.346     7.500   57.262   49.091
LGA    V    29_B      V    29_B     2.532     0    0.056   0.068     2.585   59.048   62.653
LGA    V    30_B      V    30_B     2.357     0    0.023   1.364     3.836   60.952   59.592
LGA    P    31_B      P    31_B     2.893     0    0.013   0.052     3.056   57.143   57.211
LGA    E    32_B      E    32_B     3.063     4    0.072   0.083     3.300   50.000   27.778
LGA    D    33_B      D    33_B     3.639     0    0.026   0.554     4.830   46.667   41.964
LGA    A    34_B      A    34_B     3.053     0    0.009   0.016     3.302   51.786   52.857
LGA    A    35_B      A    35_B     2.706     0    0.022   0.046     2.848   60.952   60.190
LGA    D    36_B      D    36_B     2.103     0    0.053   0.139     2.986   68.810   63.929
LGA    V    37_B      V    37_B     1.268     0    0.057   0.101     1.641   79.286   81.497
LGA    Y    38_B      Y    38_B     1.279     0    0.026   0.249     3.318   83.690   67.381
LGA    V    39_B      V    39_B     1.073     0    0.043   0.056     1.439   81.429   84.014
LGA    K    40_B      K    40_B     1.945     0    0.032   0.506     4.287   68.810   57.196
LGA    L    41_B      L    41_B     2.079     0    0.047   0.061     2.813   64.881   68.929
LGA    E    42_B      E    42_B     2.614     0    0.116   0.979     5.970   59.048   48.942
LGA    F    43_B      F    43_B     3.266     0    0.021   0.258     4.068   48.452   48.398
LGA    F    44_B      F    44_B     4.228     0    0.237   0.741     6.271   30.952   41.299
LGA    N    45_B      N    45_B     4.463     0    0.099   1.030     5.536   41.905   36.131
LGA    P    46_B      P    46_B     5.761     0    0.040   0.185     8.085   26.548   19.184
LGA    G    47_B      G    47_B     2.471     0    0.171   0.171     5.372   49.762   49.762
LGA    G    48_B      G    48_B     4.072     0    0.094   0.094     5.675   36.429   36.429
LGA    S    49_B      S    49_B     3.362     0    0.059   0.066     3.409   50.000   50.000
LGA    I    50_B      I    50_B     3.364     0    0.177   1.122     5.712   51.786   48.274
LGA    K    51_B      K    51_B     3.413     2    0.161   0.785     3.794   48.333   39.048
LGA    D    52_B      D    52_B     2.576     0    0.035   0.266     3.861   65.000   56.726
LGA    R    53_B      R    53_B     0.789     0    0.103   0.939     7.068   83.690   54.632
LGA    I    54_B      I    54_B     2.255     0    0.087   1.365     5.536   64.881   52.679
LGA    A    55_B      A    55_B     2.581     0    0.059   0.072     2.942   62.857   61.714
LGA    L    56_B      L    56_B     1.411     0    0.051   0.156     1.802   79.286   82.619
LGA    A    57_B      A    57_B     1.374     0    0.072   0.068     1.493   81.429   81.429
LGA    M    58_B      M    58_B     1.638     0    0.091   0.244     2.558   72.857   67.917
LGA    I    59_B      I    59_B     1.330     0    0.046   0.643     2.452   81.429   79.345
LGA    E    60_B      E    60_B     1.294     0    0.007   0.135     1.341   81.429   81.429
LGA    E    61_B      E    61_B     1.290     0    0.033   1.323     4.353   81.429   65.397
LGA    A    62_B      A    62_B     1.294     0    0.024   0.035     1.462   81.429   81.429
LGA    E    63_B      E    63_B     1.545     0    0.018   0.336     1.903   77.143   74.762
LGA    K    64_B      K    64_B     1.564     4    0.037   0.050     1.580   75.000   41.429
LGA    A    65_B      A    65_B     1.319     0    0.074   0.086     1.523   81.429   79.714
LGA    G    66_B      G    66_B     1.502     0    0.152   0.152     1.622   77.143   77.143
LGA    K    67_B      K    67_B     1.328     4    0.067   0.094     1.430   81.429   45.238
LGA    L    68_B      L    68_B     1.409     0    0.051   0.134     1.687   77.143   79.286
LGA    Q    69_B      Q    69_B     2.107     4    0.060   0.108     2.737   70.833   37.831
LGA    A    70_B      A    70_B     1.696     0    0.067   0.082     1.863   72.857   72.857
LGA    G    71_B      G    71_B     1.572     0    0.070   0.070     1.804   72.857   72.857
LGA    G    72_B      G    72_B     1.582     0    0.031   0.031     1.582   75.000   75.000
LGA    T    73_B      T    73_B     1.520     0    0.044   0.067     1.926   77.143   76.531
LGA    I    74_B      I    74_B     1.103     0    0.021   0.109     1.333   81.429   82.560
LGA    V    75_B      V    75_B     1.188     0    0.028   0.086     1.602   81.429   80.204
LGA    E    76_B      E    76_B     1.026     0    0.031   0.209     1.145   81.429   86.455
LGA    P    77_B      P    77_B     1.321     0    0.038   0.089     1.565   81.429   78.980
LGA    T    78_B      T    78_B     1.362     0    0.183   0.350     2.040   77.262   76.599
LGA    S    79_B      S    79_B     1.213     0    0.707   0.632     3.299   73.571   74.762
LGA    G    80_B      G    80_B     1.783     0    0.013   0.013     1.783   75.000   75.000
LGA    N    81_B      N    81_B     2.052     3    0.089   0.114     2.682   64.762   39.524
LGA    T    82_B      T    82_B     2.261     0    0.054   0.197     2.923   68.810   63.810
LGA    G    83_B      G    83_B     1.093     0    0.029   0.029     1.381   83.690   83.690
LGA    V    84_B      V    84_B     1.352     0    0.020   0.092     1.826   81.429   77.755
LGA    G    85_B      G    85_B     1.959     0    0.019   0.019     1.975   72.857   72.857
LGA    L    86_B      L    86_B     1.676     0    0.023   1.337     2.735   75.000   74.345
LGA    A    87_B      A    87_B     1.061     0    0.012   0.028     1.267   81.429   83.238
LGA    M    88_B      M    88_B     1.653     0    0.075   0.960     2.278   75.000   73.988
LGA    V    89_B      V    89_B     2.306     0    0.026   0.036     2.621   64.762   62.585
LGA    A    90_B      A    90_B     1.975     0    0.025   0.046     2.357   68.810   69.619
LGA    A    91_B      A    91_B     1.659     0    0.031   0.045     2.247   68.810   71.333
LGA    A    92_B      A    92_B     2.576     0    0.119   0.111     2.655   59.048   58.667
LGA    K    93_B      K    93_B     2.794     0    0.030   0.691     3.030   55.357   61.640
LGA    G    94_B      G    94_B     2.612     0    0.126   0.126     2.612   60.952   60.952
LGA    Y    95_B      Y    95_B     1.666     0    0.040   0.151     1.929   72.857   75.714
LGA    H    96_B      H    96_B     1.501     0    0.019   1.440     7.055   77.143   50.095
LGA    L    97_B      L    97_B     0.991     0    0.020   0.103     1.090   83.690   87.083
LGA    V    98_B      V    98_B     1.251     0    0.040   0.069     1.406   81.429   81.429
LGA    I    99_B      I    99_B     1.108     0    0.025   0.648     1.926   81.429   81.488
LGA    T   100_B      T   100_B     1.445     0    0.039   0.047     1.614   77.143   75.306
LGA    M   101_B      M   101_B     1.676     0    0.019   0.356     1.869   72.857   75.000
LGA    P   102_B      P   102_B     2.029     0    0.017   0.248     2.134   66.786   68.299
LGA    E   103_B      E   103_B     2.226     0    0.044   0.245     3.415   64.762   61.429
LGA    T   104_B      T   104_B     2.472     0    0.026   0.044     2.868   64.762   61.497
LGA    M   105_B      M   105_B     2.560     0    0.096   1.138     3.781   53.810   59.821
LGA    S   106_B      S   106_B     3.161     0    0.366   0.649     4.675   57.262   48.651
LGA    V   107_B      V   107_B     2.864     0    0.643   0.650     4.099   51.905   47.347
LGA    E   108_B      E   108_B     3.243     0    0.064   1.375     6.140   57.381   43.333
LGA    R   109_B      R   109_B     1.378     4    0.050   0.645     1.984   83.810   52.727
LGA    R   110_B      R   110_B     1.037     0    0.144   0.982     3.474   83.690   73.247
LGA    K   111_B      K   111_B     1.300     0    0.041   0.466     3.399   81.429   71.481
LGA    L   112_B      L   112_B     0.883     0    0.044   1.362     3.691   90.476   74.524
LGA    M   113_B      M   113_B     0.643     0    0.005   0.236     1.542   90.476   88.274
LGA    Q   114_B      Q   114_B     0.659     0    0.030   0.101     1.419   90.476   86.455
LGA    G   115_B      G   115_B     0.562     0    0.017   0.017     0.617   95.238   95.238
LGA    Y   116_B      Y   116_B     0.522     0    0.065   0.097     1.539   92.857   87.540
LGA    G   117_B      G   117_B     0.700     0    0.060   0.060     1.229   88.214   88.214
LGA    A   118_B      A   118_B     0.784     0    0.072   0.085     1.208   88.214   88.667
LGA    E   119_B      E   119_B     1.285     0    0.058   0.633     2.675   79.286   74.921
LGA    L   120_B      L   120_B     1.301     0    0.063   0.326     1.968   77.143   79.345
LGA    I   121_B      I   121_B     1.576     1    0.015   0.058     1.794   75.000   64.821
LGA    L   122_B      L   122_B     1.834     0    0.024   0.067     2.199   68.810   71.905
LGA    T   123_B      T   123_B     2.453     0    0.041   0.059     2.628   62.857   60.408
LGA    P   124_B      P   124_B     3.004     0    0.020   0.118     3.394   51.786   51.020
LGA    G   125_B      G   125_B     3.167     0    0.044   0.044     3.509   46.667   46.667
LGA    A   126_B      A   126_B     4.160     0    0.022   0.045     4.507   40.238   38.476
LGA    D   127_B      D   127_B     3.035     0    0.046   0.425     4.357   53.571   51.964
LGA    G   128_B      G   128_B     2.685     0    0.048   0.048     2.846   60.952   60.952
LGA    M   129_B      M   129_B     2.205     0    0.076   0.534     3.142   62.857   61.012
LGA    K   130_B      K   130_B     2.467     4    0.021   0.080     2.470   64.762   35.979
LGA    G   131_B      G   131_B     2.398     0    0.035   0.035     2.469   64.762   64.762
LGA    A   132_B      A   132_B     1.837     0    0.009   0.028     2.072   70.833   71.238
LGA    I   133_B      I   133_B     1.697     0    0.033   0.094     1.849   72.857   72.857
LGA    A   134_B      A   134_B     2.192     0    0.035   0.047     2.461   64.762   64.762
LGA    K   135_B      K   135_B     2.027     0    0.033   0.657     2.121   68.810   70.212
LGA    A   136_B      A   136_B     1.621     0    0.018   0.026     1.793   72.857   74.571
LGA    E   137_B      E   137_B     1.727     2    0.044   0.082     1.945   72.857   56.667
LGA    E   138_B      E   138_B     1.979     0    0.059   0.711     4.120   72.857   61.270
LGA    L   139_B      L   139_B     1.659     0    0.020   0.110     1.774   72.857   72.857
LGA    V   140_B      V   140_B     1.779     0    0.106   0.145     2.127   72.857   71.701
LGA    K   141_B      K   141_B     2.058     4    0.049   0.073     2.316   66.786   36.878
LGA    E   142_B      E   142_B     1.880     4    0.023   0.085     1.969   72.857   40.476
LGA    K   143_B      K   143_B     1.788     4    0.039   0.056     1.848   72.857   40.476
LGA    G   144_B      G   144_B     1.893     0    0.026   0.026     1.893   72.857   72.857
LGA    Y   145_B      Y   145_B     1.640     0    0.055   0.098     1.823   75.000   75.714
LGA    F   146_B      F   146_B     1.160     0    0.032   0.101     1.244   81.429   83.074
LGA    M   147_B      M   147_B     1.065     0    0.015   0.117     1.327   81.429   81.429
LGA    P   148_B      P   148_B     1.102     0    0.640   0.715     2.590   75.357   79.252
LGA    M   149_B      M   149_B     2.923     3    0.356   0.375     3.310   62.976   37.738
LGA    Q   150_B      Q   150_B     3.061     4    0.704   0.639     4.899   50.357   25.873
LGA    F   151_B      F   151_B     2.759     0    0.103   1.273    11.464   66.905   28.788
LGA    D   152_B      D   152_B     4.272     3    0.158   0.165     6.215   34.405   19.345
LGA    N   153_B      N   153_B     7.313     3    0.111   0.136     8.283   14.881    8.036
LGA    P   154_B      P   154_B     8.290     0    0.222   0.229    10.561    2.857    1.905
LGA    A   155_B      A   155_B    12.853     0    0.587   0.582    14.671    0.000    0.000
LGA    H   160_B      H   160_B    12.426     5    0.638   0.627    13.233    0.000    0.000
LGA    E   161_B      E   161_B     8.612     0    0.161   0.787     9.811    4.405    5.450
LGA    E   162_B      E   162_B     7.162     0    0.163   0.988     7.925   10.119   10.106
LGA    T   163_B      T   163_B     8.847     0    0.156   1.193    10.518    2.976    2.789
LGA    T   164_B      T   164_B     9.710     0    0.057   0.162    10.581    1.548    0.884
LGA    G   165_B      G   165_B     7.619     0    0.046   0.046     8.268    7.976    7.976
LGA    K   166_B      K   166_B     6.852     4    0.022   0.079     7.594    9.405    6.085
LGA    E   167_B      E   167_B     9.251     0    0.075   0.899     9.990    2.024    1.799
LGA    I   168_B      I   168_B     9.419     0    0.026   0.049    10.153    1.786    1.250
LGA    L   169_B      L   169_B     7.730     0    0.024   1.164     8.594    4.881   11.964
LGA    E   170_B      E   170_B     9.203     0    0.041   0.827    10.403    1.071    1.587
LGA    A   171_B      A   171_B    11.162     0    0.080   0.085    11.934    0.000    0.000
LGA    F   172_B      F   172_B    10.141     0    0.125   0.178    10.280    0.000    0.649
LGA    G   173_B      G   173_B    10.711     0    0.656   0.656    10.711    0.119    0.119
LGA    D   174_B      D   174_B    11.468     0    0.140   0.278    14.753    0.000    0.000
LGA    D   175_B      D   175_B     9.270     0    0.276   0.417    10.098    2.738    1.964
LGA    I   176_B      I   176_B     5.313     0    0.086   0.616     6.756   25.595   27.083
LGA    P   177_B      P   177_B     3.316     0    0.136   0.434     4.302   50.357   47.551
LGA    D   178_B      D   178_B     2.726     0    0.033   0.280     4.846   60.952   52.381
LGA    A   179_B      A   179_B     1.836     0    0.056   0.053     2.203   70.833   71.238
LGA    F   180_B      F   180_B     1.595     0    0.009   0.222     2.241   77.143   72.944
LGA    V   181_B      V   181_B     1.106     0    0.019   0.069     1.342   81.429   85.306
LGA    A   182_B      A   182_B     1.670     0    0.100   0.118     1.947   75.000   74.571
LGA    G   183_B      G   183_B     1.582     0    0.122   0.122     1.639   79.405   79.405
LGA    V   184_B      V   184_B     1.879     0    0.169   1.121     3.747   68.810   64.082
LGA    G   185_B      G   185_B     2.599     0    0.081   0.081     3.916   53.810   53.810
LGA    T   186_B      T   186_B     5.110     0    0.075   0.121     6.682   29.048   24.014
LGA    G   187_B      G   187_B     3.500     0    0.155   0.155     3.839   46.667   46.667
LGA    G   188_B      G   188_B     4.708     0    0.117   0.117     4.708   34.286   34.286
LGA    T   189_B      T   189_B     3.975     0    0.038   0.150     4.573   43.452   39.932
LGA    L   190_B      L   190_B     2.370     0    0.035   0.253     2.770   62.857   65.893
LGA    T   191_B      T   191_B     2.784     0    0.064   0.087     3.520   55.357   53.129
LGA    G   192_B      G   192_B     3.552     0    0.008   0.008     3.552   48.333   48.333
LGA    V   193_B      V   193_B     3.242     0    0.047   0.085     3.445   51.786   51.020
LGA    G   194_B      G   194_B     2.419     0    0.050   0.050     2.648   62.857   62.857
LGA    H   195_B      H   195_B     2.835     0    0.024   0.346     3.296   53.571   55.095
LGA    A   196_B      A   196_B     3.568     0    0.042   0.046     3.857   46.667   46.000
LGA    L   197_B      L   197_B     3.097     0    0.021   0.074     3.697   51.786   51.845
LGA    K   198_B      K   198_B     2.658     0    0.081   0.380     2.696   57.143   65.026
LGA    K   199_B      K   199_B     2.942     2    0.084   0.521     4.096   57.143   40.688
LGA    A   200_B      A   200_B     3.130     0    0.023   0.043     3.231   50.000   50.000
LGA    N   201_B      N   201_B     2.931     0    0.029   0.145     3.903   57.143   52.738
LGA    P   202_B      P   202_B     2.267     0    0.112   0.422     3.721   62.857   59.524
LGA    N   203_B      N   203_B     2.280     0    0.037   1.108     3.183   64.762   61.071
LGA    V   204_B      V   204_B     2.255     0    0.045   1.011     4.001   68.810   60.068
LGA    Q   205_B      Q   205_B     1.756     0    0.031   0.940     3.512   72.857   69.577
LGA    I   206_B      I   206_B     1.651     0    0.015   0.054     2.109   75.000   72.917
LGA    Y   207_B      Y   207_B     1.308     0    0.044   0.059     1.469   81.429   83.690
LGA    A   208_B      A   208_B     1.875     0    0.027   0.029     2.127   72.857   71.238
LGA    L   209_B      L   209_B     1.922     0    0.024   0.255     2.599   68.810   69.940
LGA    E   210_B      E   210_B     2.497     0    0.030   0.372     2.609   62.857   66.614
LGA    P   211_B      P   211_B     3.056     0    0.102   0.284     3.418   51.786   51.020
LGA    A   212_B      A   212_B     3.311     0    0.573   0.515     3.407   51.786   51.429
LGA    P   236_B      P   236_B    14.469     0    0.495   0.759    15.670    0.000    0.000
LGA    K   237_B      K   237_B    14.861     0    0.518   0.996    17.347    0.000    0.000
LGA    V   238_B      V   238_B    14.749     0    0.590   0.923    17.183    0.000    0.000
LGA    L   239_B      L   239_B     8.896     0    0.189   1.438    10.995    2.619    8.333
LGA    D   240_B      D   240_B     7.317     0    0.045   0.123     8.779   16.905   12.440
LGA    T   241_B      T   241_B     3.763     0    0.146   0.202     5.736   49.881   39.796
LGA    D   242_B      D   242_B     2.745     0    0.158   0.160     4.385   59.167   52.143
LGA    V   243_B      V   243_B     2.067     0    0.156   0.176     2.344   68.810   71.769
LGA    Y   244_B      Y   244_B     1.504     0    0.078   0.987     5.259   79.405   63.214
LGA    N   245_B      N   245_B     1.275     0    0.026   0.198     1.690   81.429   80.357
LGA    G   246_B      G   246_B     1.374     0    0.068   0.068     1.374   81.429   81.429
LGA    I   247_B      I   247_B     1.192     0    0.042   0.080     1.508   81.429   80.357
LGA    L   248_B      L   248_B     1.084     0    0.022   0.080     1.637   79.286   84.881
LGA    E   249_B      E   249_B     1.986     0    0.147   0.408     3.455   68.810   66.720
LGA    I   250_B      I   250_B     2.629     0    0.034   0.097     3.098   55.357   62.083
LGA    K   251_B      K   251_B     3.612     2    0.030   0.110     4.257   45.000   33.069
LGA    S   252_B      S   252_B     4.003     0    0.012   0.581     5.217   40.238   37.381
LGA    D   253_B      D   253_B     4.297     0    0.028   0.960     7.518   40.238   28.333
LGA    D   254_B      D   254_B     3.394     0    0.029   0.488     4.173   48.333   45.119
LGA    A   255_B      A   255_B     2.951     0    0.054   0.062     3.192   51.786   51.429
LGA    I   256_B      I   256_B     3.847     0    0.012   0.105     4.733   43.333   38.810
LGA    T   257_B      T   257_B     3.776     0    0.025   0.106     4.349   46.667   43.469
LGA    M   258_B      M   258_B     2.711     0    0.014   0.801     3.383   55.357   58.214
LGA    A   259_B      A   259_B     2.821     0    0.052   0.055     3.051   57.143   55.714
LGA    R   260_B      R   260_B     3.409     0    0.023   1.350     9.444   50.000   30.087
LGA    E   261_B      E   261_B     2.968     0    0.020   0.176     3.600   55.357   50.952
LGA    V   262_B      V   262_B     1.937     0    0.014   0.055     2.239   68.810   70.544
LGA    G   263_B      G   263_B     2.377     0    0.054   0.054     2.470   64.762   64.762
LGA    H   264_B      H   264_B     2.894     0    0.113   0.194     4.094   57.143   49.619
LGA    Q   265_B      Q   265_B     2.438     0    0.069   1.054     4.557   62.857   58.730
LGA    E   266_B      E   266_B     1.429     0    0.040   0.173     1.706   79.286   80.476
LGA    G   267_B      G   267_B     1.419     0    0.062   0.062     1.448   81.429   81.429
LGA    I   268_B      I   268_B     1.264     0    0.064   0.128     1.973   77.143   82.679
LGA    L   269_B      L   269_B     2.297     0    0.051   0.110     3.309   64.881   59.286
LGA    V   270_B      V   270_B     2.615     0    0.048   0.059     3.313   55.476   57.279
LGA    G   271_B      G   271_B     3.633     0    0.053   0.053     3.633   48.333   48.333
LGA    I   272_B      I   272_B     3.428     0    0.041   0.246     4.956   50.119   44.583
LGA    S   273_B      S   273_B     2.873     0    0.084   0.539     3.253   55.357   53.571
LGA    A   274_B      A   274_B     2.019     0    0.022   0.050     2.290   70.952   69.714
LGA    G   275_B      G   275_B     2.149     0    0.023   0.023     2.149   66.786   66.786
LGA    A   276_B      A   276_B     2.236     0    0.020   0.035     2.538   68.810   66.476
LGA    N   277_B      N   277_B     1.613     0    0.036   0.092     2.110   77.143   72.976
LGA    I   278_B      I   278_B     1.246     0    0.042   0.102     1.435   81.429   81.429
LGA    K   279_B      K   279_B     1.760     0    0.010   0.174     3.524   72.857   64.286
LGA    G   280_B      G   280_B     1.203     0    0.015   0.015     1.413   83.690   83.690
LGA    A   281_B      A   281_B     0.716     0    0.024   0.040     1.113   88.214   88.667
LGA    I   282_B      I   282_B     1.454     0    0.036   0.089     2.071   75.119   72.976
LGA    E   283_B      E   283_B     1.745     0    0.098   0.168     2.177   70.833   71.958
LGA    V   284_B      V   284_B     1.325     0    0.022   0.036     1.898   77.143   81.565
LGA    A   285_B      A   285_B     1.769     0    0.023   0.053     2.427   68.810   69.619
LGA    K   286_B      K   286_B     2.537     0    0.032   0.350     4.004   57.262   55.820
LGA    K   287_B      K   287_B     2.616     2    0.108   0.187     3.024   57.262   47.937
LGA    L   288_B      L   288_B     2.841     0    0.019   0.158     3.571   51.905   55.476
LGA    G   289_B      G   289_B     3.428     0    0.017   0.017     3.501   48.333   48.333
LGA    K   290_B      K   290_B     3.739     2    0.030   0.490     4.219   41.786   33.175
LGA    G   291_B      G   291_B     3.887     0    0.051   0.051     3.887   43.333   43.333
LGA    K   292_B      K   292_B     3.341     0    0.023   0.666     4.216   50.119   48.095
LGA    Q   293_B      Q   293_B     2.664     0    0.056   0.819     6.441   59.048   45.026
LGA    V   294_B      V   294_B     1.587     0    0.015   0.040     1.855   77.143   78.980
LGA    I   295_B      I   295_B     1.524     0    0.043   1.282     4.127   77.143   70.774
LGA    T   296_B      T   296_B     1.171     0    0.043   0.106     1.349   81.429   84.014
LGA    V   297_B      V   297_B     1.807     0    0.038   0.081     1.971   72.857   72.857
LGA    A   298_B      A   298_B     2.004     0    0.047   0.047     2.658   64.881   66.476
LGA    P   299_B      P   299_B     2.974     0    0.017   0.196     4.109   50.595   54.490
LGA    D   300_B      D   300_B     4.426     0    0.083   0.138     6.547   43.452   34.583
LGA    G   301_B      G   301_B     3.843     0    0.055   0.055     4.357   38.690   38.690
LGA    G   302_B      G   302_B     4.037     0    0.070   0.070     4.391   38.690   38.690
LGA    D   303_B      D   303_B     4.020     0    0.169   0.625     5.341   32.976   35.893
LGA    R   304_B      R   304_B     5.149     6    0.037   0.061     5.778   26.310   11.948
LGA    Y   305_B      Y   305_B     5.477     0    0.062   0.204     5.793   23.810   26.270
LGA    L   306_B      L   306_B     5.327     0    0.044   0.148     5.880   23.810   25.655
LGA    S   307_B      S   307_B     6.745     0    0.152   0.623     8.075   11.310   10.873
LGA    T   308_B      T   308_B     7.224     0    0.018   0.137     7.224   11.667   11.429
LGA    E   309_B      E   309_B     7.575     3    0.113   0.693     9.033    8.571    4.497
LGA    L   310_B      L   310_B     5.987     0    0.059   0.106     6.644   19.405   23.512
LGA    F   311_B      F   311_B     5.448     0    0.400   0.504     5.644   25.119   30.216
LGA    N   312_B      N   312_B     7.327     0    0.505   1.056    12.413   10.833    5.774
LGA    Y   313_B      Y   313_B     7.048     0    0.626   0.473     8.565    8.214   17.540

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      281    1124   1124  100.00    1997   1997  100.00               281
SUMMARY(RMSD_GDC):     3.970          3.943                  4.230           57.570   54.214

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  313  281    4.0    234    2.37    64.947    61.732     9.479

LGA_LOCAL      RMSD:   2.369  Number of atoms:  234  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   4.046  Number of assigned atoms:  281 
Std_ASGN_ATOMS RMSD:   3.970  Standard rmsd on all 281 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.419264 * X  +  -0.893775 * Y  +   0.159323 * Z  +  10.039702
  Y_new =   0.708404 * X  +   0.212319 * Y  +  -0.673115 * Z  +   7.681609
  Z_new =   0.567787 * X  +   0.395078 * Y  +   0.722172 * Z  +  23.016973 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  1.036396 -0.603815  0.500590   [DEG:   59.3811  -34.5960   28.6817 ]
ZXZ:  0.232417  0.763860  0.962881   [DEG:   13.3165   43.7659   55.1690 ]
 
# END of job
