
#######################################################
#                                                     #
#                        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       3.85     3.85
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   143       9_B - 151_B       1.99     4.16
  LCS_AVERAGE:     41.12

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   101      50_B - 150_B       1.00     4.85
  LONGEST_CONTINUOUS_SEGMENT:   101      51_B - 151_B       0.99     4.83
  LCS_AVERAGE:     23.54

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    3  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     H     7_B     H     7_B     14   17  281     10   71   93  112  130  155  179  210  237  247  256  258  259  264  266  271  273  276  276  277 
LCS_GDT     T     8_B     T     8_B     14  142  281     20   74   99  118  141  168  203  232  244  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     K     9_B     K     9_B     14  143  281     21   71   98  118  141  168  203  232  244  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     I    10_B     I    10_B     14  143  281     22   74   99  118  141  177  204  233  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     T    11_B     T    11_B     14  143  281     10   75   99  121  151  183  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     N    12_B     N    12_B     14  143  281     10   14   99  121  151  183  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     S    13_B     S    13_B     14  143  281     10   14   99  124  163  198  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     I    14_B     I    14_B     14  143  281     10   78  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     V    15_B     V    15_B     14  143  281     10   77  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     N    16_B     N    16_B     14  143  281     53   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     L    17_B     L    17_B     27  143  281      8   78  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     I    18_B     I    18_B     29  143  281     11   86  113  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G    19_B     G    19_B     29  143  281      5   46  116  128  134  150  211  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     N    20_B     N    20_B     29  143  281     16  101  117  128  134  159  214  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     T    21_B     T    21_B     29  143  281     77  101  117  128  145  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     P    22_B     P    22_B     29  143  281     70  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     I    23_B     I    23_B     29  143  281     70  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     V    24_B     V    24_B     29  143  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     K    25_B     K    25_B     29  143  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     L    26_B     L    26_B     29  143  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     N    27_B     N    27_B     29  143  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     R    28_B     R    28_B     29  143  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     V    29_B     V    29_B     29  143  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     V    30_B     V    30_B     29  143  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     P    31_B     P    31_B     29  143  281     77  101  117  128  163  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     E    32_B     E    32_B     29  143  281     68  101  117  128  154  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     D    33_B     D    33_B     29  143  281     77  101  117  128  137  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     A    34_B     A    34_B     29  143  281     77  101  117  128  163  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     A    35_B     A    35_B     29  143  281     77  101  117  128  163  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     D    36_B     D    36_B     29  143  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     V    37_B     V    37_B     29  143  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     Y    38_B     Y    38_B     29  143  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     V    39_B     V    39_B     29  143  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     K    40_B     K    40_B     29  143  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     L    41_B     L    41_B     29  143  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     E    42_B     E    42_B     29  143  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     F    43_B     F    43_B     29  143  281     45  101  117  128  150  198  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     F    44_B     F    44_B     29  143  281      4   93  114  127  137  161  206  234  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     N    45_B     N    45_B     29  143  281     51   95  113  127  134  145  203  230  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     P    46_B     P    46_B     29  143  281      4   14   56  125  133  139  153  197  242  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G    47_B     G    47_B     33  143  281     20   70   95  112  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G    48_B     G    48_B     33  143  281      4    9   32   66  102  168  205  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     S    49_B     S    49_B    100  143  281     14   26   77  100  129  190  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     I    50_B     I    50_B    101  143  281      3   26   68   98  122  190  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     K    51_B     K    51_B    101  143  281      7   25   79  100  119  183  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     D    52_B     D    52_B    101  143  281     35   78   98  117  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     R    53_B     R    53_B    101  143  281     18   78  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     I    54_B     I    54_B    101  143  281      8   42   92  119  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     A    55_B     A    55_B    101  143  281      8   60   92  114  163  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     L    56_B     L    56_B    101  143  281     51   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     A    57_B     A    57_B    101  143  281     23   78  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     M    58_B     M    58_B    101  143  281     19   78   99  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     I    59_B     I    59_B    101  143  281     50   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     E    60_B     E    60_B    101  143  281     50   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     E    61_B     E    61_B    101  143  281     48   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     A    62_B     A    62_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     E    63_B     E    63_B    101  143  281     50   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     K    64_B     K    64_B    101  143  281     48   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     A    65_B     A    65_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G    66_B     G    66_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     K    67_B     K    67_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     L    68_B     L    68_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     Q    69_B     Q    69_B    101  143  281     53   79  100  126  164  199  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     A    70_B     A    70_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G    71_B     G    71_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G    72_B     G    72_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     T    73_B     T    73_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     I    74_B     I    74_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     V    75_B     V    75_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     E    76_B     E    76_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     P    77_B     P    77_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     T    78_B     T    78_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     S    79_B     S    79_B    101  143  281     39   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G    80_B     G    80_B    101  143  281     12   42  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     N    81_B     N    81_B    101  143  281     12   70  109  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     T    82_B     T    82_B    101  143  281     12   51  104  125  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G    83_B     G    83_B    101  143  281     22   76  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     V    84_B     V    84_B    101  143  281     22   78  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G    85_B     G    85_B    101  143  281     22   69  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     L    86_B     L    86_B    101  143  281     22   76  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     A    87_B     A    87_B    101  143  281     47   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     M    88_B     M    88_B    101  143  281     45   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     V    89_B     V    89_B    101  143  281     18   76   99  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     A    90_B     A    90_B    101  143  281     28   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     A    91_B     A    91_B    101  143  281     51   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     A    92_B     A    92_B    101  143  281     28   79   99  125  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     K    93_B     K    93_B    101  143  281     18   76   99  124  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G    94_B     G    94_B    101  143  281     37   79   99  125  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     Y    95_B     Y    95_B    101  143  281     54   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     H    96_B     H    96_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     L    97_B     L    97_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     V    98_B     V    98_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     I    99_B     I    99_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     T   100_B     T   100_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     M   101_B     M   101_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     P   102_B     P   102_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     E   103_B     E   103_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     T   104_B     T   104_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     M   105_B     M   105_B    101  143  281     13   79   99  125  163  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     S   106_B     S   106_B    101  143  281      3    3   62  116  154  191  224  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     V   107_B     V   107_B    101  143  281      3   43   97  118  163  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     E   108_B     E   108_B    101  143  281     18   57   99  123  159  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     R   109_B     R   109_B    101  143  281     20   78  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     R   110_B     R   110_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     K   111_B     K   111_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     L   112_B     L   112_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     M   113_B     M   113_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     Q   114_B     Q   114_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G   115_B     G   115_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     Y   116_B     Y   116_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G   117_B     G   117_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     A   118_B     A   118_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     E   119_B     E   119_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     L   120_B     L   120_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     I   121_B     I   121_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     L   122_B     L   122_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     T   123_B     T   123_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     P   124_B     P   124_B    101  143  281     55   79  100  126  163  199  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G   125_B     G   125_B    101  143  281     53   79  100  125  160  199  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     A   126_B     A   126_B    101  143  281     43   79   99  122  148  182  215  234  244  249  254  259  263  265  270  272  274  276  276  277 
LCS_GDT     D   127_B     D   127_B    101  143  281     55   79  100  125  161  197  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G   128_B     G   128_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     M   129_B     M   129_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     K   130_B     K   130_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G   131_B     G   131_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     A   132_B     A   132_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     I   133_B     I   133_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     A   134_B     A   134_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     K   135_B     K   135_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     A   136_B     A   136_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     E   137_B     E   137_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     E   138_B     E   138_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     L   139_B     L   139_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     V   140_B     V   140_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     K   141_B     K   141_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     E   142_B     E   142_B    101  143  281     37   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     K   143_B     K   143_B    101  143  281     30   79   99  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G   144_B     G   144_B    101  143  281     35   79   99  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     Y   145_B     Y   145_B    101  143  281     53   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     F   146_B     F   146_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     M   147_B     M   147_B    101  143  281     55   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     P   148_B     P   148_B    101  143  281     46   79  100  126  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     M   149_B     M   149_B    101  143  281      5   26   78  107  154  191  224  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     Q   150_B     Q   150_B    101  143  281      8   51   87  103  154  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     F   151_B     F   151_B    101  143  281      3    8   49  115  162  197  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     D   152_B     D   152_B      6  142  281     12   30   61   78   94  170  220  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     N   153_B     N   153_B      6  125  281      4    6   34   50   71   98  137  154  199  233  251  259  263  265  270  272  274  276  276  277 
LCS_GDT     P   154_B     P   154_B      6  121  281      4   13   37   48   58   95  111  138  186  216  238  253  263  265  270  272  274  276  276  277 
LCS_GDT     A   155_B     A   155_B      6  110  281      4    6    8    9   10   12   50   56   70   82   96  120  152  182  210  249  262  271  276  277 
LCS_GDT     H   160_B     H   160_B      4   18  281      3    4    4    7   17   20   25   27   32   43   52   85  108  165  239  261  266  271  276  277 
LCS_GDT     E   161_B     E   161_B      4   18  281      3    4    5   15   21   31   71  120  171  207  227  247  255  264  270  272  274  276  276  277 
LCS_GDT     E   162_B     E   162_B     12   18  281      3    6   24   48   69   95  112  144  198  233  245  256  263  265  270  272  274  276  276  277 
LCS_GDT     T   163_B     T   163_B     12   18  281      8   11   13   18   28   55   81  120  157  197  224  242  255  264  270  272  274  276  276  277 
LCS_GDT     T   164_B     T   164_B     12   18  281      9   11   13   18   22   26   47   74  108  163  207  232  250  259  266  272  274  276  276  277 
LCS_GDT     G   165_B     G   165_B     12   18  281      9   11   13   18   34   56  100  156  199  225  242  253  263  265  270  272  274  276  276  277 
LCS_GDT     K   166_B     K   166_B     12   18  281      9   11   13   31   51   85  135  187  217  242  251  259  263  265  270  272  274  276  276  277 
LCS_GDT     E   167_B     E   167_B     12   18  281      9   11   28   46   54   74   98  141  149  173  213  241  258  265  270  272  274  276  276  277 
LCS_GDT     I   168_B     I   168_B     12   18  281      9   11   14   22   48   74   97  131  146  155  183  232  253  264  270  272  274  276  276  277 
LCS_GDT     L   169_B     L   169_B     12   44  281      9   15   42   95  126  137  142  147  168  211  243  255  263  265  270  272  274  276  276  277 
LCS_GDT     E   170_B     E   170_B     12   44  281      9   15   49   95  121  137  141  145  153  165  190  240  255  265  270  272  274  276  276  277 
LCS_GDT     A   171_B     A   171_B     12   44  281      9   11   13   33   62   98  121  138  145  151  156  168  202  249  257  269  274  276  276  277 
LCS_GDT     F   172_B     F   172_B     12   44  281      9   11   13   22   62   98  122  140  146  151  159  177  231  252  266  272  274  276  276  277 
LCS_GDT     G   173_B     G   173_B     12   44  281      6   11   16   34   47   84  122  136  145  151  156  164  197  249  257  269  274  276  276  277 
LCS_GDT     D   174_B     D   174_B      4   44  281      4    6   14   30   47   79  108  136  145  151  156  164  177  218  257  264  271  276  276  277 
LCS_GDT     D   175_B     D   175_B      4   44  281      4    7   14   34   59  100  131  142  146  152  174  211  248  263  270  272  274  276  276  277 
LCS_GDT     I   176_B     I   176_B     37   44  281     13   93  110  127  134  139  169  221  241  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     P   177_B     P   177_B     37   44  281     76  101  117  128  151  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     D   178_B     D   178_B     37   44  281     77  101  117  128  163  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     A   179_B     A   179_B     37   44  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     F   180_B     F   180_B     37   44  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     V   181_B     V   181_B     37   44  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     A   182_B     A   182_B     37   44  281     76  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G   183_B     G   183_B     37   44  281     20   92  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     V   184_B     V   184_B     37   44  281     20   92  116  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G   185_B     G   185_B     37   44  281     28   69   99  125  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     T   186_B     T   186_B     37   44  281      3   23   56  105  130  139  186  225  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G   187_B     G   187_B     37   44  281      5   51  112  128  151  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G   188_B     G   188_B     37   44  281     10   35   71  116  131  152  215  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     T   189_B     T   189_B     37  101  281      6   34   57  110  139  192  222  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     L   190_B     L   190_B     37  101  281     18   53  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     T   191_B     T   191_B     37  101  281     18   72  116  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G   192_B     G   192_B     37  101  281     18   53  108  128  154  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     V   193_B     V   193_B     37  101  281     18   71  117  128  157  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G   194_B     G   194_B     37  101  281     18   96  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     H   195_B     H   195_B     37  101  281     18   91  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     A   196_B     A   196_B     37  101  281     19   98  117  128  154  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     L   197_B     L   197_B     37  101  281     70  101  117  128  158  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     K   198_B     K   198_B     37  101  281     34  100  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     K   199_B     K   199_B     37  101  281     26   98  117  128  163  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     A   200_B     A   200_B     37  101  281     38  100  117  128  158  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     N   201_B     N   201_B     37  101  281     38  100  117  128  163  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     P   202_B     P   202_B     37  101  281     16   98  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     N   203_B     N   203_B     37  101  281     42  100  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     V   204_B     V   204_B     37  101  281     75  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     Q   205_B     Q   205_B     37  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     I   206_B     I   206_B     37  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     Y   207_B     Y   207_B     37  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     A   208_B     A   208_B     37  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     L   209_B     L   209_B     37  101  281     51  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     E   210_B     E   210_B     37  101  281     67  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     P   211_B     P   211_B     37  101  281     40  100  117  128  154  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     A   212_B     A   212_B     37  101  281     24   85  117  128  154  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     P   236_B     P   236_B      3  101  281      0    3    3    6    8   22   31   49   80  133  148  151  158  171  180  189  200  241  255  272 
LCS_GDT     K   237_B     K   237_B      3  101  281      0    3    4    4    4    9   32   84   96  112  125  146  158  171  180  190  225  241  257  274 
LCS_GDT     V   238_B     V   238_B      5  101  281      3    5    6   10   15   29   70   80   91  110  119  137  158  171  180  189  199  203  250  272 
LCS_GDT     L   239_B     L   239_B     70  101  281      5    8   13   33   59  117  139  142  156  175  202  215  257  264  270  272  274  276  276  277 
LCS_GDT     D   240_B     D   240_B     74  101  281      5   10   73  101  127  137  143  184  199  244  250  259  263  265  270  272  274  276  276  277 
LCS_GDT     T   241_B     T   241_B     74  101  281      6   51  113  128  151  192  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     D   242_B     D   242_B     74  101  281     70  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     V   243_B     V   243_B     74  101  281     19   99  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     Y   244_B     Y   244_B     74  101  281     69  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     N   245_B     N   245_B     74  101  281     42  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G   246_B     G   246_B     74  101  281     26  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     I   247_B     I   247_B     74  101  281     73  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     L   248_B     L   248_B     74  101  281     76  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     E   249_B     E   249_B     74  101  281     58  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     I   250_B     I   250_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     K   251_B     K   251_B     74  101  281     77  101  117  128  145  192  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     S   252_B     S   252_B     74  101  281     77  101  117  128  134  177  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     D   253_B     D   253_B     74  101  281     77  101  117  128  134  177  223  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     D   254_B     D   254_B     74  101  281     77  101  117  128  153  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     A   255_B     A   255_B     74  101  281     77  101  117  128  155  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     I   256_B     I   256_B     74  101  281     77  101  117  128  134  177  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     T   257_B     T   257_B     74  101  281     77  101  117  128  134  189  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     M   258_B     M   258_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     A   259_B     A   259_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     R   260_B     R   260_B     74  101  281     77  101  117  128  145  198  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     E   261_B     E   261_B     74  101  281     77  101  117  128  163  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     V   262_B     V   262_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G   263_B     G   263_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     H   264_B     H   264_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     Q   265_B     Q   265_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     E   266_B     E   266_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G   267_B     G   267_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     I   268_B     I   268_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     L   269_B     L   269_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     V   270_B     V   270_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G   271_B     G   271_B     74  101  281     65  101  117  128  134  179  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     I   272_B     I   272_B     74  101  281     77  101  117  128  134  183  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     S   273_B     S   273_B     74  101  281     77  101  117  128  158  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     A   274_B     A   274_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G   275_B     G   275_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     A   276_B     A   276_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     N   277_B     N   277_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     I   278_B     I   278_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     K   279_B     K   279_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G   280_B     G   280_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     A   281_B     A   281_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     I   282_B     I   282_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     E   283_B     E   283_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     V   284_B     V   284_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     A   285_B     A   285_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     K   286_B     K   286_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     K   287_B     K   287_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     L   288_B     L   288_B     74  101  281     77  101  117  128  163  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G   289_B     G   289_B     74  101  281     77  101  117  128  147  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     K   290_B     K   290_B     74  101  281     77  101  117  128  134  200  223  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G   291_B     G   291_B     74  101  281     77  101  117  128  134  198  223  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     K   292_B     K   292_B     74  101  281     77  101  117  128  149  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     Q   293_B     Q   293_B     74  101  281     77  101  117  128  163  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     V   294_B     V   294_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     I   295_B     I   295_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     T   296_B     T   296_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     V   297_B     V   297_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     A   298_B     A   298_B     74  101  281     77  101  117  128  164  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     P   299_B     P   299_B     74  101  281     77  101  117  128  158  200  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     D   300_B     D   300_B     74  101  281     16   77  116  128  134  150  199  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G   301_B     G   301_B     74  101  281     49  101  117  128  141  183  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     G   302_B     G   302_B     74  101  281     75  101  117  128  134  172  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     D   303_B     D   303_B     74  101  281     72  101  117  128  134  172  225  235  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     R   304_B     R   304_B     74  101  281     65  101  117  128  134  141  194  230  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     Y   305_B     Y   305_B     74  101  281     65  101  117  128  134  141  189  228  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     L   306_B     L   306_B     74  101  281     77  101  117  128  134  141  189  230  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     S   307_B     S   307_B     74  101  281     63  101  116  128  134  140  150  184  242  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     T   308_B     T   308_B     74  101  281     32   95  116  128  134  140  150  165  237  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     E   309_B     E   309_B     74  101  281      9   87  110  127  134  140  148  166  214  248  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     L   310_B     L   310_B     74  101  281     16   92  114  128  134  141  164  223  242  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     F   311_B     F   311_B     74  101  281     28  101  117  128  134  141  189  223  245  250  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     N   312_B     N   312_B     74  101  281      5   52  110  127  134  140  151  173  214  247  256  259  263  265  270  272  274  276  276  277 
LCS_GDT     Y   313_B     Y   313_B     74  101  281      5   15   32   48  131  140  152  175  210  245  256  259  263  265  270  272  274  276  276  277 
LCS_AVERAGE  LCS_A:  54.89  (  23.54   41.12  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     77    101    117    128    164    200    225    235    245    250    256    259    263    265    270    272    274    276    276    277 
GDT PERCENT_AT  27.40  35.94  41.64  45.55  58.36  71.17  80.07  83.63  87.19  88.97  91.10  92.17  93.59  94.31  96.09  96.80  97.51  98.22  98.22  98.58
GDT RMS_LOCAL    0.26   0.43   0.67   0.86   1.65   1.98   2.18   2.28   2.42   2.52   2.67   2.75   2.88   2.97   3.17   3.27   3.38   3.45   3.45   3.52
GDT RMS_ALL_AT   6.30   6.31   5.95   5.97   4.02   3.94   3.94   3.93   3.92   3.93   3.92   3.90   3.88   3.87   3.86   3.86   3.85   3.86   3.86   3.85

# Checking swapping
#   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     2.106     0    0.179   1.057    10.515   68.810   34.143
LGA    H     7_B      H     7_B     6.163     0    0.630   1.301    10.987   23.214    9.619
LGA    T     8_B      T     8_B     4.870     0    0.011   0.102     5.112   28.810   30.748
LGA    K     9_B      K     9_B     4.814     4    0.022   0.074     4.814   32.857   18.095
LGA    I    10_B      I    10_B     4.456     0    0.059   0.586     6.992   35.714   30.655
LGA    T    11_B      T    11_B     3.625     0    0.031   0.062     3.853   43.333   46.190
LGA    N    12_B      N    12_B     3.659     0    0.034   1.115     6.155   46.667   38.690
LGA    S    13_B      S    13_B     2.631     0    0.080   0.125     3.021   59.167   58.492
LGA    I    14_B      I    14_B     1.290     0    0.057   0.088     1.833   81.548   82.619
LGA    V    15_B      V    15_B     0.833     0    0.041   0.294     1.957   85.952   81.565
LGA    N    16_B      N    16_B     2.168     0    0.014   0.137     3.270   64.881   60.119
LGA    L    17_B      L    17_B     2.259     0    0.101   0.129     2.817   64.762   63.810
LGA    I    18_B      I    18_B     2.242     0    0.049   0.087     3.003   61.190   68.155
LGA    G    19_B      G    19_B     4.222     0    0.674   0.674     4.671   37.262   37.262
LGA    N    20_B      N    20_B     4.075     0    0.051   0.327     5.289   41.905   38.929
LGA    T    21_B      T    21_B     3.156     0    0.046   0.158     3.892   51.905   49.184
LGA    P    22_B      P    22_B     1.987     0    0.018   0.073     2.312   70.833   70.544
LGA    I    23_B      I    23_B     1.600     0    0.088   0.085     3.003   77.143   69.107
LGA    V    24_B      V    24_B     1.219     0    0.050   0.146     1.678   83.690   80.272
LGA    K    25_B      K    25_B     1.364     0    0.037   0.146     2.687   81.429   73.122
LGA    L    26_B      L    26_B     1.201     0    0.021   0.072     1.639   77.143   82.679
LGA    N    27_B      N    27_B     2.134     0    0.030   0.190     2.826   64.881   64.821
LGA    R    28_B      R    28_B     2.468     0    0.058   0.276     3.178   59.167   62.771
LGA    V    29_B      V    29_B     2.424     0    0.038   0.053     2.521   62.857   64.830
LGA    V    30_B      V    30_B     2.281     0    0.029   1.367     3.711   60.952   58.571
LGA    P    31_B      P    31_B     2.931     0    0.019   0.049     3.109   57.143   57.211
LGA    E    32_B      E    32_B     3.196     4    0.041   0.065     3.486   50.000   27.778
LGA    D    33_B      D    33_B     3.468     0    0.033   0.705     3.828   50.000   52.083
LGA    A    34_B      A    34_B     2.926     0    0.008   0.017     3.152   55.357   55.714
LGA    A    35_B      A    35_B     2.601     0    0.023   0.049     2.733   60.952   61.714
LGA    D    36_B      D    36_B     2.042     0    0.062   0.132     2.853   68.810   63.929
LGA    V    37_B      V    37_B     1.292     0    0.059   0.106     1.649   79.286   81.497
LGA    Y    38_B      Y    38_B     1.280     0    0.026   0.232     3.331   81.429   66.627
LGA    V    39_B      V    39_B     1.015     0    0.050   0.061     1.294   81.429   84.014
LGA    K    40_B      K    40_B     1.867     0    0.042   0.174     3.984   72.857   61.111
LGA    L    41_B      L    41_B     1.959     0    0.060   0.097     2.768   66.905   72.024
LGA    E    42_B      E    42_B     2.556     0    0.111   0.959     5.967   59.048   48.942
LGA    F    43_B      F    43_B     3.290     0    0.026   0.282     4.193   46.905   48.528
LGA    F    44_B      F    44_B     4.345     0    0.223   0.683     6.345   30.952   39.524
LGA    N    45_B      N    45_B     4.515     0    0.100   1.036     5.569   40.476   35.417
LGA    P    46_B      P    46_B     5.757     0    0.024   0.242     7.734   26.548   19.524
LGA    G    47_B      G    47_B     2.441     0    0.185   0.185     5.476   49.762   49.762
LGA    G    48_B      G    48_B     4.064     0    0.103   0.103     5.651   36.429   36.429
LGA    S    49_B      S    49_B     3.323     0    0.070   0.070     3.376   50.000   50.000
LGA    I    50_B      I    50_B     3.330     0    0.182   1.114     5.694   51.786   48.274
LGA    K    51_B      K    51_B     3.376     2    0.154   0.774     3.785   51.905   40.635
LGA    D    52_B      D    52_B     2.482     0    0.032   0.316     3.937   66.905   57.679
LGA    R    53_B      R    53_B     0.701     0    0.101   0.934     7.082   83.690   54.632
LGA    I    54_B      I    54_B     2.196     0    0.090   1.363     5.431   66.786   55.179
LGA    A    55_B      A    55_B     2.512     0    0.053   0.069     2.872   62.857   61.714
LGA    L    56_B      L    56_B     1.295     0    0.058   0.157     1.703   79.286   84.881
LGA    A    57_B      A    57_B     1.338     0    0.079   0.075     1.434   81.429   81.429
LGA    M    58_B      M    58_B     1.662     0    0.089   0.245     2.538   72.857   68.869
LGA    I    59_B      I    59_B     1.344     0    0.047   0.075     1.752   81.429   80.357
LGA    E    60_B      E    60_B     1.302     0    0.008   0.134     1.381   81.429   81.429
LGA    E    61_B      E    61_B     1.290     0    0.026   1.335     4.420   81.429   65.397
LGA    A    62_B      A    62_B     1.321     0    0.027   0.032     1.488   81.429   81.429
LGA    E    63_B      E    63_B     1.493     0    0.019   0.205     1.631   81.429   80.476
LGA    K    64_B      K    64_B     1.474     4    0.034   0.050     1.495   81.429   45.238
LGA    A    65_B      A    65_B     1.310     0    0.073   0.085     1.530   81.429   79.714
LGA    G    66_B      G    66_B     1.497     0    0.145   0.145     1.789   79.286   79.286
LGA    K    67_B      K    67_B     1.425     4    0.061   0.091     1.559   81.429   44.286
LGA    L    68_B      L    68_B     1.382     0    0.070   0.136     1.650   77.143   80.417
LGA    Q    69_B      Q    69_B     2.133     4    0.071   0.127     2.831   72.976   38.783
LGA    A    70_B      A    70_B     1.470     0    0.059   0.073     1.669   79.286   78.000
LGA    G    71_B      G    71_B     1.184     0    0.070   0.070     1.491   81.429   81.429
LGA    G    72_B      G    72_B     1.332     0    0.022   0.022     1.349   81.429   81.429
LGA    T    73_B      T    73_B     1.356     0    0.040   0.048     1.651   81.429   80.204
LGA    I    74_B      I    74_B     1.054     0    0.017   0.072     1.252   81.429   84.821
LGA    V    75_B      V    75_B     1.154     0    0.031   0.095     1.550   81.429   80.204
LGA    E    76_B      E    76_B     1.025     0    0.025   0.196     1.304   81.429   82.434
LGA    P    77_B      P    77_B     1.276     0    0.056   0.099     1.510   81.429   80.204
LGA    T    78_B      T    78_B     1.333     0    0.160   0.311     1.955   79.286   77.755
LGA    S    79_B      S    79_B     1.211     0    0.695   0.641     3.367   73.571   74.762
LGA    G    80_B      G    80_B     1.706     0    0.019   0.019     1.706   75.000   75.000
LGA    N    81_B      N    81_B     1.978     3    0.073   0.100     2.609   72.857   43.571
LGA    T    82_B      T    82_B     2.118     0    0.049   0.204     2.722   68.810   65.986
LGA    G    83_B      G    83_B     1.027     0    0.030   0.030     1.285   85.952   85.952
LGA    V    84_B      V    84_B     1.243     0    0.014   0.085     1.734   81.429   77.755
LGA    G    85_B      G    85_B     1.805     0    0.021   0.021     1.807   72.857   72.857
LGA    L    86_B      L    86_B     1.502     0    0.020   1.334     2.708   77.143   75.298
LGA    A    87_B      A    87_B     0.959     0    0.009   0.029     1.140   83.690   85.048
LGA    M    88_B      M    88_B     1.536     0    0.073   0.956     2.134   75.000   72.976
LGA    V    89_B      V    89_B     2.087     0    0.036   0.061     2.377   68.810   67.075
LGA    A    90_B      A    90_B     1.675     0    0.022   0.047     2.001   70.833   72.952
LGA    A    91_B      A    91_B     1.467     0    0.037   0.051     2.011   72.976   74.667
LGA    A    92_B      A    92_B     2.319     0    0.138   0.130     2.377   66.786   66.381
LGA    K    93_B      K    93_B     2.442     0    0.052   0.629     2.635   62.857   65.767
LGA    G    94_B      G    94_B     2.279     0    0.112   0.112     2.279   66.786   66.786
LGA    Y    95_B      Y    95_B     1.422     0    0.031   0.146     1.648   77.143   78.571
LGA    H    96_B      H    96_B     1.281     0    0.046   1.033     6.686   81.429   55.238
LGA    L    97_B      L    97_B     0.777     0    0.021   0.118     0.857   90.476   91.667
LGA    V    98_B      V    98_B     1.112     0    0.032   0.058     1.248   83.690   82.721
LGA    I    99_B      I    99_B     1.055     0    0.031   0.644     1.919   81.429   83.750
LGA    T   100_B      T   100_B     1.310     0    0.042   0.045     1.456   81.429   81.429
LGA    M   101_B      M   101_B     1.527     0    0.023   0.364     1.680   75.000   77.143
LGA    P   102_B      P   102_B     1.857     0    0.017   0.255     2.013   72.857   72.925
LGA    E   103_B      E   103_B     1.977     0    0.037   0.223     2.924   68.810   65.767
LGA    T   104_B      T   104_B     2.248     0    0.022   0.043     2.566   64.762   62.585
LGA    M   105_B      M   105_B     2.546     0    0.092   1.120     3.749   53.810   58.690
LGA    S   106_B      S   106_B     3.147     0    0.371   0.792     6.399   59.286   47.619
LGA    V   107_B      V   107_B     2.896     0    0.639   0.648     4.079   50.357   45.578
LGA    E   108_B      E   108_B     2.930     0    0.051   1.471     5.724   60.952   49.630
LGA    R   109_B      R   109_B     1.008     4    0.061   0.641     1.714   83.810   53.550
LGA    R   110_B      R   110_B     1.019     0    0.142   1.124     3.027   83.690   74.113
LGA    K   111_B      K   111_B     1.186     0    0.037   0.500     3.163   83.690   73.333
LGA    L   112_B      L   112_B     0.830     0    0.044   1.380     3.656   90.476   76.310
LGA    M   113_B      M   113_B     0.688     0    0.007   0.263     1.492   90.476   89.345
LGA    Q   114_B      Q   114_B     0.565     0    0.036   0.061     1.013   90.476   89.471
LGA    G   115_B      G   115_B     0.536     0    0.015   0.015     0.575   95.238   95.238
LGA    Y   116_B      Y   116_B     0.434     0    0.046   0.075     1.260   97.619   92.143
LGA    G   117_B      G   117_B     0.461     0    0.048   0.048     0.888   95.238   95.238
LGA    A   118_B      A   118_B     0.640     0    0.077   0.092     1.053   88.214   88.667
LGA    E   119_B      E   119_B     1.063     0    0.051   0.541     2.475   83.690   77.725
LGA    L   120_B      L   120_B     1.114     0    0.066   0.329     1.694   79.286   81.488
LGA    I   121_B      I   121_B     1.303     1    0.014   0.059     1.497   81.429   71.250
LGA    L   122_B      L   122_B     1.506     0    0.022   0.054     1.791   75.000   78.214
LGA    T   123_B      T   123_B     2.147     0    0.040   0.057     2.369   66.786   65.918
LGA    P   124_B      P   124_B     2.614     0    0.021   0.119     2.962   59.048   58.231
LGA    G   125_B      G   125_B     2.836     0    0.041   0.041     3.231   53.571   53.571
LGA    A   126_B      A   126_B     3.863     0    0.024   0.049     4.201   45.000   43.429
LGA    D   127_B      D   127_B     2.792     0    0.051   0.455     4.201   57.262   54.762
LGA    G   128_B      G   128_B     2.492     0    0.055   0.055     2.632   62.857   62.857
LGA    M   129_B      M   129_B     2.148     0    0.081   0.563     3.370   64.762   61.012
LGA    K   130_B      K   130_B     2.424     4    0.021   0.079     2.438   64.762   35.979
LGA    G   131_B      G   131_B     2.246     0    0.028   0.028     2.348   64.762   64.762
LGA    A   132_B      A   132_B     1.752     0    0.010   0.028     1.963   72.857   72.857
LGA    I   133_B      I   133_B     1.682     0    0.033   0.087     1.816   72.857   72.857
LGA    A   134_B      A   134_B     2.114     0    0.033   0.047     2.370   64.762   64.762
LGA    K   135_B      K   135_B     1.928     0    0.034   0.664     2.000   70.833   73.862
LGA    A   136_B      A   136_B     1.532     0    0.015   0.024     1.700   72.857   74.571
LGA    E   137_B      E   137_B     1.655     2    0.046   0.084     1.866   72.857   56.667
LGA    E   138_B      E   138_B     1.891     0    0.062   0.738     4.120   72.857   62.169
LGA    L   139_B      L   139_B     1.529     0    0.021   0.111     1.660   72.857   75.000
LGA    V   140_B      V   140_B     1.714     0    0.114   0.152     2.126   72.857   71.701
LGA    K   141_B      K   141_B     1.974     4    0.050   0.073     2.221   70.833   38.677
LGA    E   142_B      E   142_B     1.723     4    0.028   0.091     1.851   72.857   40.476
LGA    K   143_B      K   143_B     1.619     4    0.026   0.050     1.752   72.857   40.476
LGA    G   144_B      G   144_B     1.900     0    0.022   0.022     1.900   72.857   72.857
LGA    Y   145_B      Y   145_B     1.500     0    0.057   0.085     1.722   77.143   79.286
LGA    F   146_B      F   146_B     1.134     0    0.046   0.160     1.440   81.429   81.429
LGA    M   147_B      M   147_B     1.158     0    0.017   0.120     1.357   81.429   82.560
LGA    P   148_B      P   148_B     1.305     0    0.628   0.722     2.563   73.214   76.735
LGA    M   149_B      M   149_B     3.263     3    0.356   0.374     3.642   59.405   35.119
LGA    Q   150_B      Q   150_B     3.274     4    0.704   0.640     5.098   48.571   24.497
LGA    F   151_B      F   151_B     2.851     0    0.094   1.267    11.488   66.905   28.788
LGA    D   152_B      D   152_B     3.977     3    0.188   0.194     6.042   39.167   22.262
LGA    N   153_B      N   153_B     7.098     3    0.109   0.133     8.095   15.833    8.512
LGA    P   154_B      P   154_B     8.088     0    0.216   0.222    10.290    3.690    2.721
LGA    A   155_B      A   155_B    12.695     0    0.585   0.582    14.500    0.000    0.000
LGA    H   160_B      H   160_B    12.412     5    0.633   0.623    13.253    0.000    0.000
LGA    E   161_B      E   161_B     8.598     0    0.166   0.771     9.817    4.405    5.979
LGA    E   162_B      E   162_B     7.126     0    0.163   0.993     7.924   10.119   10.106
LGA    T   163_B      T   163_B     8.840     0    0.146   1.185    10.516    2.976    2.789
LGA    T   164_B      T   164_B     9.714     0    0.059   0.128    10.708    1.548    0.884
LGA    G   165_B      G   165_B     7.595     0    0.043   0.043     8.252    7.976    7.976
LGA    K   166_B      K   166_B     6.805     4    0.024   0.081     7.543   10.238    6.455
LGA    E   167_B      E   167_B     9.206     0    0.070   0.913     9.949    2.024    1.799
LGA    I   168_B      I   168_B     9.392     0    0.026   0.045    10.140    1.786    1.250
LGA    L   169_B      L   169_B     7.714     0    0.025   1.168     8.576    4.881   11.964
LGA    E   170_B      E   170_B     9.180     0    0.041   0.842    10.376    1.190    1.640
LGA    A   171_B      A   171_B    11.083     0    0.076   0.083    11.840    0.000    0.000
LGA    F   172_B      F   172_B    10.045     0    0.122   0.150    10.203    0.000    0.649
LGA    G   173_B      G   173_B    10.651     0    0.660   0.660    10.651    0.357    0.357
LGA    D   174_B      D   174_B    11.384     0    0.145   0.280    14.560    0.000    0.000
LGA    D   175_B      D   175_B     9.309     0    0.243   0.426    10.122    2.738    1.964
LGA    I   176_B      I   176_B     5.321     0    0.088   0.622     6.994   25.595   26.310
LGA    P   177_B      P   177_B     3.255     0    0.127   0.433     4.215   51.905   49.320
LGA    D   178_B      D   178_B     2.758     0    0.036   0.276     4.862   60.952   52.381
LGA    A   179_B      A   179_B     1.882     0    0.058   0.054     2.251   70.833   71.238
LGA    F   180_B      F   180_B     1.628     0    0.008   0.133     2.143   77.143   73.680
LGA    V   181_B      V   181_B     1.152     0    0.019   0.069     1.378   81.429   84.014
LGA    A   182_B      A   182_B     1.651     0    0.098   0.118     1.928   75.000   74.571
LGA    G   183_B      G   183_B     1.541     0    0.133   0.133     1.610   79.405   79.405
LGA    V   184_B      V   184_B     1.840     0    0.181   1.119     3.701   70.833   65.238
LGA    G   185_B      G   185_B     2.357     0    0.104   0.104     3.720   57.738   57.738
LGA    T   186_B      T   186_B     4.973     0    0.082   0.110     6.608   31.905   26.259
LGA    G   187_B      G   187_B     3.317     0    0.196   0.196     3.637   48.333   48.333
LGA    G   188_B      G   188_B     4.549     0    0.129   0.129     4.549   37.262   37.262
LGA    T   189_B      T   189_B     3.886     0    0.039   0.143     4.498   45.000   42.517
LGA    L   190_B      L   190_B     2.341     0    0.036   0.234     2.713   62.857   65.893
LGA    T   191_B      T   191_B     2.711     0    0.060   0.083     3.395   57.143   55.102
LGA    G   192_B      G   192_B     3.488     0    0.008   0.008     3.488   50.000   50.000
LGA    V   193_B      V   193_B     3.207     0    0.043   0.083     3.422   51.786   51.020
LGA    G   194_B      G   194_B     2.382     0    0.051   0.051     2.614   62.857   62.857
LGA    H   195_B      H   195_B     2.765     0    0.024   0.343     3.187   55.357   56.524
LGA    A   196_B      A   196_B     3.509     0    0.043   0.047     3.810   46.667   46.000
LGA    L   197_B      L   197_B     3.079     0    0.016   0.062     3.678   53.571   52.738
LGA    K   198_B      K   198_B     2.576     0    0.082   0.396     2.629   57.143   65.926
LGA    K   199_B      K   199_B     2.918     2    0.091   0.526     4.151   57.143   40.688
LGA    A   200_B      A   200_B     3.193     0    0.025   0.044     3.291   50.000   50.000
LGA    N   201_B      N   201_B     2.935     0    0.033   0.130     3.713   55.357   52.738
LGA    P   202_B      P   202_B     2.236     0    0.091   0.108     2.507   62.857   63.673
LGA    N   203_B      N   203_B     2.260     0    0.028   1.109     3.190   64.762   61.071
LGA    V   204_B      V   204_B     2.338     0    0.025   0.046     2.518   66.786   64.830
LGA    Q   205_B      Q   205_B     1.883     0    0.047   0.932     3.386   70.833   69.418
LGA    I   206_B      I   206_B     1.742     0    0.015   0.047     2.174   72.857   70.833
LGA    Y   207_B      Y   207_B     1.362     0    0.047   0.060     1.518   79.286   81.468
LGA    A   208_B      A   208_B     1.890     0    0.016   0.016     2.152   72.857   71.238
LGA    L   209_B      L   209_B     1.900     0    0.025   0.257     2.509   68.810   69.940
LGA    E   210_B      E   210_B     2.376     0    0.035   0.391     2.474   64.762   67.460
LGA    P   211_B      P   211_B     2.855     0    0.094   0.280     3.196   57.143   56.122
LGA    A   212_B      A   212_B     3.098     0    0.574   0.516     3.222   53.571   52.857
LGA    P   236_B      P   236_B    14.307     0    0.495   0.752    15.510    0.000    0.000
LGA    K   237_B      K   237_B    14.680     0    0.514   1.008    17.005    0.000    0.000
LGA    V   238_B      V   238_B    14.576     0    0.585   0.927    16.999    0.000    0.000
LGA    L   239_B      L   239_B     8.729     0    0.187   1.430    10.822    3.095    8.571
LGA    D   240_B      D   240_B     7.199     0    0.051   0.115     8.788   18.690   13.333
LGA    T   241_B      T   241_B     3.613     0    0.142   0.199     5.620   51.190   40.544
LGA    D   242_B      D   242_B     2.729     0    0.155   0.154     4.281   60.952   53.036
LGA    V   243_B      V   243_B     2.037     0    0.149   0.166     2.323   68.810   71.769
LGA    Y   244_B      Y   244_B     1.527     0    0.073   0.994     5.251   79.405   63.214
LGA    N   245_B      N   245_B     1.262     0    0.032   0.196     1.602   81.429   80.357
LGA    G   246_B      G   246_B     1.408     0    0.073   0.073     1.408   81.429   81.429
LGA    I   247_B      I   247_B     1.137     0    0.035   0.092     1.362   83.690   82.560
LGA    L   248_B      L   248_B     0.973     0    0.045   0.088     1.419   83.690   88.274
LGA    E   249_B      E   249_B     1.844     0    0.132   0.464     3.588   72.976   67.831
LGA    I   250_B      I   250_B     2.461     0    0.033   0.104     2.888   60.952   64.881
LGA    K   251_B      K   251_B     3.315     2    0.028   0.113     3.802   51.786   38.201
LGA    S   252_B      S   252_B     3.783     0    0.011   0.581     5.066   43.333   39.444
LGA    D   253_B      D   253_B     4.061     0    0.026   0.956     7.113   41.786   30.595
LGA    D   254_B      D   254_B     3.168     0    0.032   0.607     4.234   51.905   47.679
LGA    A   255_B      A   255_B     2.808     0    0.053   0.062     3.040   53.571   54.286
LGA    I   256_B      I   256_B     3.682     0    0.008   0.097     4.604   45.000   40.357
LGA    T   257_B      T   257_B     3.588     0    0.026   0.107     4.188   46.667   44.354
LGA    M   258_B      M   258_B     2.491     0    0.012   0.803     3.210   60.952   62.024
LGA    A   259_B      A   259_B     2.631     0    0.053   0.055     2.868   57.143   57.143
LGA    R   260_B      R   260_B     3.203     0    0.026   1.359     9.137   51.786   32.078
LGA    E   261_B      E   261_B     2.761     0    0.021   0.151     3.389   60.952   55.661
LGA    V   262_B      V   262_B     1.763     0    0.011   0.051     2.052   70.833   71.701
LGA    G   263_B      G   263_B     2.190     0    0.052   0.052     2.287   64.762   64.762
LGA    H   264_B      H   264_B     2.706     0    0.107   0.300     4.011   59.048   52.381
LGA    Q   265_B      Q   265_B     2.267     0    0.082   1.056     4.313   66.786   61.958
LGA    E   266_B      E   266_B     1.315     0    0.031   0.155     1.584   79.286   80.476
LGA    G   267_B      G   267_B     1.337     0    0.048   0.048     1.368   81.429   81.429
LGA    I   268_B      I   268_B     1.198     0    0.051   0.134     1.828   77.143   82.679
LGA    L   269_B      L   269_B     2.223     0    0.034   0.120     3.303   64.881   59.286
LGA    V   270_B      V   270_B     2.418     0    0.054   0.073     3.172   59.167   62.721
LGA    G   271_B      G   271_B     3.578     0    0.044   0.044     3.578   48.333   48.333
LGA    I   272_B      I   272_B     3.479     0    0.029   0.236     5.049   50.119   43.929
LGA    S   273_B      S   273_B     2.843     0    0.095   0.573     3.177   59.167   56.111
LGA    A   274_B      A   274_B     2.053     0    0.020   0.052     2.317   68.810   68.000
LGA    G   275_B      G   275_B     2.108     0    0.025   0.025     2.108   66.786   66.786
LGA    A   276_B      A   276_B     2.148     0    0.020   0.034     2.437   68.810   68.000
LGA    N   277_B      N   277_B     1.586     0    0.041   0.096     2.103   77.143   74.048
LGA    I   278_B      I   278_B     1.208     0    0.034   0.104     1.402   81.429   81.429
LGA    K   279_B      K   279_B     1.655     0    0.011   0.217     2.715   77.143   68.571
LGA    G   280_B      G   280_B     1.135     0    0.021   0.021     1.330   85.952   85.952
LGA    A   281_B      A   281_B     0.752     0    0.023   0.039     1.114   88.214   88.667
LGA    I   282_B      I   282_B     1.401     0    0.019   0.069     2.030   77.143   73.988
LGA    E   283_B      E   283_B     1.693     0    0.129   0.984     3.310   70.833   68.519
LGA    V   284_B      V   284_B     1.348     0    0.025   0.038     1.916   77.143   80.272
LGA    A   285_B      A   285_B     1.736     0    0.024   0.053     2.362   68.810   69.619
LGA    K   286_B      K   286_B     2.443     0    0.036   0.431     4.425   60.952   58.307
LGA    K   287_B      K   287_B     2.521     2    0.114   0.194     2.912   59.048   48.730
LGA    L   288_B      L   288_B     2.784     0    0.020   0.156     3.480   53.571   56.310
LGA    G   289_B      G   289_B     3.330     0    0.015   0.015     3.406   50.000   50.000
LGA    K   290_B      K   290_B     3.598     2    0.030   0.492     4.044   43.333   33.862
LGA    G   291_B      G   291_B     3.750     0    0.042   0.042     3.767   43.333   43.333
LGA    K   292_B      K   292_B     3.262     0    0.023   0.667     4.223   51.786   48.836
LGA    Q   293_B      Q   293_B     2.583     0    0.045   0.729     6.092   59.048   44.392
LGA    V   294_B      V   294_B     1.619     0    0.016   0.042     1.853   75.000   77.755
LGA    I   295_B      I   295_B     1.542     0    0.043   1.328     4.250   77.143   70.774
LGA    T   296_B      T   296_B     1.184     0    0.039   0.101     1.365   81.429   84.014
LGA    V   297_B      V   297_B     1.807     0    0.030   0.084     1.992   72.857   72.857
LGA    A   298_B      A   298_B     1.984     0    0.050   0.049     2.632   66.905   68.095
LGA    P   299_B      P   299_B     2.967     0    0.016   0.212     4.089   50.595   54.490
LGA    D   300_B      D   300_B     4.360     0    0.094   0.173     6.360   43.452   35.060
LGA    G   301_B      G   301_B     3.613     0    0.048   0.048     4.091   41.786   41.786
LGA    G   302_B      G   302_B     3.825     0    0.046   0.046     4.246   41.786   41.786
LGA    D   303_B      D   303_B     3.766     0    0.164   0.584     5.113   36.071   39.762
LGA    R   304_B      R   304_B     4.932     6    0.021   0.046     5.550   27.619   12.900
LGA    Y   305_B      Y   305_B     5.210     0    0.043   0.111     5.510   25.000   28.413
LGA    L   306_B      L   306_B     5.202     0    0.035   0.136     5.793   23.810   26.310
LGA    S   307_B      S   307_B     6.627     0    0.188   0.642     8.010   11.310   10.873
LGA    T   308_B      T   308_B     6.716     0    0.014   0.134     6.716   15.238   14.966
LGA    E   309_B      E   309_B     7.008     3    0.126   0.700     8.243   12.500    6.878
LGA    L   310_B      L   310_B     5.634     0    0.053   0.115     6.224   22.738   27.143
LGA    F   311_B      F   311_B     5.271     0    0.393   0.496     5.443   27.500   32.165
LGA    N   312_B      N   312_B     7.158     0    0.502   1.067    12.194   12.500    6.607
LGA    Y   313_B      Y   313_B     6.798     0    0.629   0.490     8.379   11.190   18.492

# 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):     3.846          3.823                  4.096           59.177   55.757

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  313  281    4.0    235    2.28    65.480    63.270     9.864

LGA_LOCAL      RMSD:   2.282  Number of atoms:  235  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   3.928  Number of assigned atoms:  281 
Std_ASGN_ATOMS RMSD:   3.846  Standard rmsd on all 281 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.847296 * X  +   0.380752 * Y  +  -0.370293 * Z  +   9.295992
  Y_new =  -0.456030 * X  +  -0.164145 * Y  +   0.874696 * Z  +   8.291929
  Z_new =   0.272260 * X  +   0.909991 * Y  +   0.312714 * Z  +  23.473600 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -2.647840 -0.275741  1.239794   [DEG: -151.7101  -15.7988   71.0350 ]
ZXZ: -2.741129  1.252748  0.290713   [DEG: -157.0551   71.7771   16.6567 ]
 
# END of job
