
#######################################################
#                                                     #
#                        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       3.92     3.92
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   142      10_B - 151_B       1.99     4.18
  LONGEST_CONTINUOUS_SEGMENT:   142      11_B - 152_B       2.00     4.16
  LCS_AVERAGE:     40.41

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   100      50_B - 149_B       1.00     4.80
  LONGEST_CONTINUOUS_SEGMENT:   100      51_B - 150_B       0.96     4.84
  LONGEST_CONTINUOUS_SEGMENT:   100      52_B - 151_B       0.97     4.79
  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   14  281      3    3   46  103  159  193  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     H     7_B     H     7_B     11   16  281      4   21   43   58  108  130  158  175  196  217  237  253  255  259  262  265  271  273  276  276 
LCS_GDT     T     8_B     T     8_B     11   16  281      4    5    6   70  117  139  165  194  242  246  252  256  257  260  263  269  271  273  276  276 
LCS_GDT     K     9_B     K     9_B     12   16  281      4   12   17   48   86  134  158  175  213  245  251  255  257  260  263  269  271  273  276  276 
LCS_GDT     I    10_B     I    10_B     12  142  281      7   36   85  115  135  168  215  234  242  247  253  256  259  262  266  269  271  273  276  276 
LCS_GDT     T    11_B     T    11_B     12  142  281     13   44   94  119  145  180  215  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     N    12_B     N    12_B     12  142  281      7   12   91  118  145  180  218  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     S    13_B     S    13_B     12  142  281      7   63   99  125  162  197  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     I    14_B     I    14_B     12  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     V    15_B     V    15_B     12  142  281      7   78  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     N    16_B     N    16_B     12  142  281     44   79  101  126  164  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     L    17_B     L    17_B     12  142  281      8   72  100  126  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     I    18_B     I    18_B     29  142  281     14   78  110  126  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G    19_B     G    19_B     29  142  281      5   40  115  128  134  158  214  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     N    20_B     N    20_B     29  142  281     11   97  116  128  134  158  217  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     T    21_B     T    21_B     29  142  281     63  101  116  128  152  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     P    22_B     P    22_B     29  142  281     60  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     I    23_B     I    23_B     29  142  281     60  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     V    24_B     V    24_B     29  142  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     K    25_B     K    25_B     29  142  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     L    26_B     L    26_B     29  142  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     N    27_B     N    27_B     29  142  281     66  101  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     R    28_B     R    28_B     29  142  281     75  101  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     V    29_B     V    29_B     29  142  281     75  101  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     V    30_B     V    30_B     29  142  281     75  101  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     P    31_B     P    31_B     29  142  281     73  101  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     E    32_B     E    32_B     29  142  281     47  101  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     D    33_B     D    33_B     29  142  281     73  101  116  128  136  197  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     A    34_B     A    34_B     29  142  281     75  101  116  128  161  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     A    35_B     A    35_B     29  142  281     75  101  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     D    36_B     D    36_B     29  142  281     75  101  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     V    37_B     V    37_B     29  142  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     Y    38_B     Y    38_B     29  142  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     V    39_B     V    39_B     29  142  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     K    40_B     K    40_B     29  142  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     L    41_B     L    41_B     29  142  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     E    42_B     E    42_B     29  142  281     75  101  116  128  164  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     F    43_B     F    43_B     29  142  281     61  101  116  128  151  197  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     F    44_B     F    44_B     29  142  281      6   93  114  128  139  180  215  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     N    45_B     N    45_B     29  142  281     50   93  114  128  134  151  215  234  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     P    46_B     P    46_B     29  142  281     12   20   67  125  134  139  151  194  240  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G    47_B     G    47_B     33  142  281     27   72   95  115  164  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G    48_B     G    48_B     33  142  281      4   16   27   72  104  173  215  232  241  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     S    49_B     S    49_B     33  142  281      3   27   77   98  136  192  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     I    50_B     I    50_B    100  142  281      3   27   64   95  136  192  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     K    51_B     K    51_B    100  142  281      8   25   75   98  121  192  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     D    52_B     D    52_B    100  142  281     33   75   97  117  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     R    53_B     R    53_B    100  142  281     16   77  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     I    54_B     I    54_B    100  142  281      8   39   86  122  164  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     A    55_B     A    55_B    100  142  281      8   66   91  116  159  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     L    56_B     L    56_B    100  142  281     50   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     A    57_B     A    57_B    100  142  281     16   78  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     M    58_B     M    58_B    100  142  281     17   74   99  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     I    59_B     I    59_B    100  142  281     49   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     E    60_B     E    60_B    100  142  281     50   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     E    61_B     E    61_B    100  142  281     48   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     A    62_B     A    62_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     E    63_B     E    63_B    100  142  281     48   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     K    64_B     K    64_B    100  142  281     47   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     A    65_B     A    65_B    100  142  281     50   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G    66_B     G    66_B    100  142  281     50   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     K    67_B     K    67_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     L    68_B     L    68_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     Q    69_B     Q    69_B    100  142  281     55   79  101  129  164  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     A    70_B     A    70_B    100  142  281     55   79  101  129  164  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G    71_B     G    71_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G    72_B     G    72_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     T    73_B     T    73_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     I    74_B     I    74_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     V    75_B     V    75_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     E    76_B     E    76_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     P    77_B     P    77_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     T    78_B     T    78_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     S    79_B     S    79_B    100  142  281     40   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G    80_B     G    80_B    100  142  281      7   40  100  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     N    81_B     N    81_B    100  142  281     14   69  109  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     T    82_B     T    82_B    100  142  281     17   53  107  126  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G    83_B     G    83_B    100  142  281     17   75  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     V    84_B     V    84_B    100  142  281     29   74  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G    85_B     G    85_B    100  142  281     18   69  100  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     L    86_B     L    86_B    100  142  281     18   71  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     A    87_B     A    87_B    100  142  281     44   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     M    88_B     M    88_B    100  142  281     39   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     V    89_B     V    89_B    100  142  281     18   73   99  126  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     A    90_B     A    90_B    100  142  281     18   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     A    91_B     A    91_B    100  142  281     50   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     A    92_B     A    92_B    100  142  281     18   78   99  125  164  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     K    93_B     K    93_B    100  142  281     15   74   99  125  164  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G    94_B     G    94_B    100  142  281     25   79  100  125  164  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     Y    95_B     Y    95_B    100  142  281     53   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     H    96_B     H    96_B    100  142  281     53   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     L    97_B     L    97_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     V    98_B     V    98_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     I    99_B     I    99_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     T   100_B     T   100_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     M   101_B     M   101_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     P   102_B     P   102_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     E   103_B     E   103_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     T   104_B     T   104_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     M   105_B     M   105_B    100  142  281     22   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     S   106_B     S   106_B    100  142  281      3   11   90  122  157  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     V   107_B     V   107_B    100  142  281      6   41   97  125  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     E   108_B     E   108_B    100  142  281     15   40  100  125  158  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     R   109_B     R   109_B    100  142  281     13   75  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     R   110_B     R   110_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     K   111_B     K   111_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     L   112_B     L   112_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     M   113_B     M   113_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     Q   114_B     Q   114_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G   115_B     G   115_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     Y   116_B     Y   116_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G   117_B     G   117_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     A   118_B     A   118_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     E   119_B     E   119_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     L   120_B     L   120_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     I   121_B     I   121_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     L   122_B     L   122_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     T   123_B     T   123_B    100  142  281     55   79  101  129  160  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     P   124_B     P   124_B    100  142  281     55   79  101  125  160  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G   125_B     G   125_B    100  142  281     55   79  101  125  160  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     A   126_B     A   126_B    100  142  281     37   79  100  125  154  185  215  235  242  247  252  256  260  262  267  269  271  273  276  276 
LCS_GDT     D   127_B     D   127_B    100  142  281     55   79  101  125  160  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G   128_B     G   128_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     M   129_B     M   129_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     K   130_B     K   130_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G   131_B     G   131_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     A   132_B     A   132_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     I   133_B     I   133_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     A   134_B     A   134_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     K   135_B     K   135_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     A   136_B     A   136_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     E   137_B     E   137_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     E   138_B     E   138_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     L   139_B     L   139_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     V   140_B     V   140_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     K   141_B     K   141_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     E   142_B     E   142_B    100  142  281     40   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     K   143_B     K   143_B    100  142  281     41   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G   144_B     G   144_B    100  142  281     47   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     Y   145_B     Y   145_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     F   146_B     F   146_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     M   147_B     M   147_B    100  142  281     55   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     P   148_B     P   148_B    100  142  281     50   79  101  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     M   149_B     M   149_B    100  142  281      3   27   86  117  156  197  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     Q   150_B     Q   150_B    100  142  281      7   49   86  105  153  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     F   151_B     F   151_B    100  142  281      4    9   54  120  159  197  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     D   152_B     D   152_B      6  142  281      8   35   58   75   99  161  217  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     N   153_B     N   153_B      6  124  281      4   17   42   52   75  102  139  154  205  231  248  256  260  262  267  269  271  273  276  276 
LCS_GDT     P   154_B     P   154_B      6  121  281      4   15   36   49   60   94  109  140  177  217  240  253  260  262  267  269  271  273  276  276 
LCS_GDT     A   155_B     A   155_B      6  110  281      4    6    7    8   10   12   23   30   70   82   97  117  152  180  210  246  257  270  272  275 
LCS_GDT     H   160_B     H   160_B      4   18  281      3    4    6    7   17   20   25   27   31   43   53   87  103  153  230  256  263  269  273  276 
LCS_GDT     E   161_B     E   161_B      4   18  281      3    4    5   16   22   31   55  113  161  208  227  245  254  262  267  269  271  273  276  276 
LCS_GDT     E   162_B     E   162_B     12   18  281      3    6   23   47   66   92  111  149  202  231  243  256  260  262  267  269  271  273  276  276 
LCS_GDT     T   163_B     T   163_B     12   18  281      9   11   13   18   32   53   80  117  161  199  224  241  255  262  267  269  271  273  276  276 
LCS_GDT     T   164_B     T   164_B     12   18  281      9   11   13   18   22   27   39   63  104  152  207  233  247  257  265  269  270  273  276  276 
LCS_GDT     G   165_B     G   165_B     12   18  281      9   11   13   18   35   57   93  155  201  223  240  253  260  262  267  269  271  273  276  276 
LCS_GDT     K   166_B     K   166_B     12   18  281      9   11   15   31   51   87  135  186  216  239  247  256  260  262  267  269  271  273  276  276 
LCS_GDT     E   167_B     E   167_B     12   18  281      9   11   28   46   55   75   99  140  148  169  205  237  255  262  267  269  271  273  276  276 
LCS_GDT     I   168_B     I   168_B     12   18  281      9   11   13   24   48   67   98  131  145  153  177  227  249  262  267  269  271  273  276  276 
LCS_GDT     L   169_B     L   169_B     12   44  281      9   16   43   94  126  137  142  147  164  209  241  254  260  262  267  269  271  273  276  276 
LCS_GDT     E   170_B     E   170_B     12   44  281      9   16   43   90  121  136  140  144  150  165  185  231  250  262  267  269  271  273  276  276 
LCS_GDT     A   171_B     A   171_B     12   44  281      9   11   13   28   51   91  117  134  144  150  155  164  182  218  254  268  270  273  276  276 
LCS_GDT     F   172_B     F   172_B     12   44  281      9   11   13   22   51   98  120  138  145  150  158  175  230  252  262  269  271  273  276  276 
LCS_GDT     G   173_B     G   173_B     12   44  281      6   11   16   35   45   82  110  136  143  150  155  164  187  241  257  266  270  273  276  276 
LCS_GDT     D   174_B     D   174_B      4   44  281      4    6   14   30   45   78  104  135  143  150  155  164  172  207  254  264  270  273  276  276 
LCS_GDT     D   175_B     D   175_B      4   44  281      4    7   14   35   58   98  127  141  145  151  171  230  249  256  267  269  271  273  276  276 
LCS_GDT     I   176_B     I   176_B     37   44  281      9   84  108  128  134  138  167  218  239  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     P   177_B     P   177_B     37   44  281     66  100  116  128  150  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     D   178_B     D   178_B     37   44  281     75  101  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     A   179_B     A   179_B     37   44  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     F   180_B     F   180_B     37   44  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     V   181_B     V   181_B     37   44  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     A   182_B     A   182_B     37   44  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G   183_B     G   183_B     37   44  281     27   90  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     V   184_B     V   184_B     37   44  281     27   90  115  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G   185_B     G   185_B     37   44  281     18   70  100  125  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     T   186_B     T   186_B     37   44  281      4   18   43   81  126  137  143  187  239  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G   187_B     G   187_B     37   44  281      4   33  109  126  142  196  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G   188_B     G   188_B     37   44  281      5   35   69  114  132  143  203  233  240  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     T   189_B     T   189_B     37   44  281     12   35   55   98  131  190  221  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     L   190_B     L   190_B     37  100  281     18   52  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     T   191_B     T   191_B     37  100  281     18   79  115  126  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G   192_B     G   192_B     37  100  281     18   52  110  126  156  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     V   193_B     V   193_B     37  100  281     18   69  116  128  158  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G   194_B     G   194_B     37  100  281     18   91  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     H   195_B     H   195_B     37  100  281     18   83  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     A   196_B     A   196_B     37  100  281     20   96  116  128  153  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     L   197_B     L   197_B     37  100  281     51  101  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     K   198_B     K   198_B     37  100  281     32  101  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     K   199_B     K   199_B     37  100  281     15  100  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     A   200_B     A   200_B     37  100  281     42  101  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     N   201_B     N   201_B     37  100  281     36  101  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     P   202_B     P   202_B     37  100  281     20  100  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     N   203_B     N   203_B     37  100  281     24  101  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     V   204_B     V   204_B     37  100  281     69  101  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     Q   205_B     Q   205_B     37  100  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     I   206_B     I   206_B     37  100  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     Y   207_B     Y   207_B     37  100  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     A   208_B     A   208_B     37  100  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     L   209_B     L   209_B     37  100  281     73  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     E   210_B     E   210_B     37  100  281     73  101  116  128  164  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     P   211_B     P   211_B     37  100  281     44  100  116  128  156  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     A   212_B     A   212_B     37  100  281     28   88  115  128  156  197  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     P   236_B     P   236_B      3  100  281      0    3    3    7    8   19   37   50   67  121  147  150  154  161  173  185  194  213  256  271 
LCS_GDT     K   237_B     K   237_B      3  100  281      0    3    4    4    5    8   39   86   99  115  126  145  155  163  173  196  235  246  256  274 
LCS_GDT     V   238_B     V   238_B      5  100  281      3    5    6   10   15   29   39   82   92  104  124  136  154  163  173  183  192  219  253  271 
LCS_GDT     L   239_B     L   239_B      5  100  281      4    6   12   30   51  114  138  142  150  188  204  216  255  262  267  269  271  273  276  276 
LCS_GDT     D   240_B     D   240_B     74  100  281      4   10   70  101  129  137  142  178  205  243  248  256  260  262  267  269  271  273  276  276 
LCS_GDT     T   241_B     T   241_B     74  100  281      6   60  111  126  150  196  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     D   242_B     D   242_B     74  100  281     61  100  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     V   243_B     V   243_B     74  100  281     55   95  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     Y   244_B     Y   244_B     74  100  281     56  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     N   245_B     N   245_B     74  100  281     22  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G   246_B     G   246_B     74  100  281     47  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     I   247_B     I   247_B     74  100  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     L   248_B     L   248_B     74  100  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     E   249_B     E   249_B     74  100  281     73  101  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     I   250_B     I   250_B     74  100  281     75  101  116  128  164  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     K   251_B     K   251_B     74  100  281     75  101  116  128  142  196  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     S   252_B     S   252_B     74  100  281     75  101  116  128  134  183  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     D   253_B     D   253_B     74  100  281     75  101  116  128  134  165  218  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     D   254_B     D   254_B     74  100  281     75  101  116  128  153  197  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     A   255_B     A   255_B     74  100  281     75  101  116  128  163  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     I   256_B     I   256_B     74  100  281     75  101  116  128  134  193  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     T   257_B     T   257_B     74  100  281     75  101  116  128  134  193  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     M   258_B     M   258_B     74  100  281     75  101  116  128  164  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     A   259_B     A   259_B     74  100  281     75  101  116  128  164  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     R   260_B     R   260_B     74  100  281     75  101  116  128  142  197  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     E   261_B     E   261_B     74  100  281     75  101  116  128  163  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     V   262_B     V   262_B     74  100  281     75  101  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G   263_B     G   263_B     74  100  281     75  101  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     H   264_B     H   264_B     74  100  281     75  101  116  128  163  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     Q   265_B     Q   265_B     74  100  281     75  101  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     E   266_B     E   266_B     74  100  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G   267_B     G   267_B     74  100  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     I   268_B     I   268_B     74  100  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     L   269_B     L   269_B     74  100  281     75  101  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     V   270_B     V   270_B     74  100  281     58  101  116  128  164  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G   271_B     G   271_B     74  100  281     74  101  116  128  134  193  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     I   272_B     I   272_B     74  100  281     75  101  116  128  134  197  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     S   273_B     S   273_B     74  100  281     75  101  116  128  164  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     A   274_B     A   274_B     74  100  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G   275_B     G   275_B     74  100  281     75  101  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     A   276_B     A   276_B     74  100  281     75  101  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     N   277_B     N   277_B     74  100  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     I   278_B     I   278_B     74  100  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     K   279_B     K   279_B     74  100  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G   280_B     G   280_B     74  100  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     A   281_B     A   281_B     74  100  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     I   282_B     I   282_B     74  100  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     E   283_B     E   283_B     74  100  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     V   284_B     V   284_B     74  100  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     A   285_B     A   285_B     74  100  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     K   286_B     K   286_B     74  100  281     75  101  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     K   287_B     K   287_B     74  100  281     75  101  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     L   288_B     L   288_B     74  100  281     75  101  116  128  164  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G   289_B     G   289_B     74  100  281     75  101  116  128  134  197  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     K   290_B     K   290_B     74  100  281     75  101  116  128  134  193  222  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G   291_B     G   291_B     74  100  281     75  101  116  128  134  192  222  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     K   292_B     K   292_B     74  100  281     75  101  116  128  150  197  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     Q   293_B     Q   293_B     74  100  281     75  101  116  128  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     V   294_B     V   294_B     74  100  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     I   295_B     I   295_B     74  100  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     T   296_B     T   296_B     74  100  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     V   297_B     V   297_B     74  100  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     A   298_B     A   298_B     74  100  281     75  101  116  129  165  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     P   299_B     P   299_B     74  100  281     75  101  116  128  158  198  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     D   300_B     D   300_B     74  100  281      4   81  115  128  134  159  215  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G   301_B     G   301_B     74  100  281     47  101  116  128  145  181  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     G   302_B     G   302_B     74  100  281     74  101  116  128  134  180  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     D   303_B     D   303_B     74  100  281     65  101  116  128  140  186  223  235  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     R   304_B     R   304_B     74  100  281     45  101  116  128  134  140  215  234  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     Y   305_B     Y   305_B     74  100  281     50   98  116  128  134  139  176  234  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     L   306_B     L   306_B     74  100  281     75  101  116  128  134  139  215  234  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     S   307_B     S   307_B     74  100  281     50   98  116  128  134  139  149  186  240  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     T   308_B     T   308_B     74  100  281     13   93  114  128  134  139  147  162  218  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     E   309_B     E   309_B     74  100  281     13   63  102  128  134  139  147  161  193  244  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     L   310_B     L   310_B     74  100  281     13   75  113  128  134  139  152  212  240  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     F   311_B     F   311_B     74  100  281     28   98  116  128  134  139  177  230  242  247  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     N   312_B     N   312_B     74  100  281     12   22  102  128  134  139  151  170  218  246  253  256  260  262  267  269  271  273  276  276 
LCS_GDT     Y   313_B     Y   313_B     74   98  281      4   12   33   70  122  138  151  170  209  244  253  256  260  262  267  269  271  273  276  276 
LCS_AVERAGE  LCS_A:  54.54  (  23.20   40.41  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     75    101    116    129    165    198    223    235    242    247    253    256    260    262    267    269    271    273    276    276 
GDT PERCENT_AT  26.69  35.94  41.28  45.91  58.72  70.46  79.36  83.63  86.12  87.90  90.04  91.10  92.53  93.24  95.02  95.73  96.44  97.15  98.22  98.22
GDT RMS_LOCAL    3.66   0.50   0.68   1.27   1.71   1.92   2.14   2.28   2.41   2.49   2.64   2.73   2.87   2.92   3.17   3.19   3.26   3.36   3.52   3.52
GDT RMS_ALL_AT   6.34   6.13   6.06   4.15   4.04   4.03   4.01   4.01   4.01   4.00   3.98   3.97   3.95   3.95   3.93   3.94   3.94   3.93   3.93   3.93

# 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   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     3.317     0    0.090   1.085     9.478   57.976   29.952
LGA    H     7_B      H     7_B     8.036     0    0.617   1.267    12.876    7.976    3.190
LGA    T     8_B      T     8_B     6.746     0    0.055   0.691     6.801   16.310   16.667
LGA    K     9_B      K     9_B     7.193     4    0.024   0.092     8.228   13.571    6.561
LGA    I    10_B      I    10_B     5.025     0    0.031   0.592     6.972   26.310   25.298
LGA    T    11_B      T    11_B     3.989     0    0.022   0.089     4.167   41.786   43.401
LGA    N    12_B      N    12_B     3.775     0    0.074   1.116     6.371   46.667   38.690
LGA    S    13_B      S    13_B     2.594     0    0.070   0.116     3.048   59.167   58.492
LGA    I    14_B      I    14_B     1.230     0    0.052   0.079     1.739   79.286   83.750
LGA    V    15_B      V    15_B     0.850     0    0.041   0.294     1.964   85.952   81.565
LGA    N    16_B      N    16_B     2.249     0    0.020   0.125     3.564   64.881   57.500
LGA    L    17_B      L    17_B     2.430     0    0.106   0.136     3.076   62.857   60.060
LGA    I    18_B      I    18_B     2.224     0    0.053   0.080     2.931   62.976   69.048
LGA    G    19_B      G    19_B     4.218     0    0.677   0.677     4.744   37.262   37.262
LGA    N    20_B      N    20_B     4.031     0    0.055   0.241     5.044   41.905   38.929
LGA    T    21_B      T    21_B     3.138     0    0.015   0.169     3.812   50.119   48.163
LGA    P    22_B      P    22_B     2.002     0    0.018   0.087     2.274   68.810   70.544
LGA    I    23_B      I    23_B     1.701     0    0.104   0.096     3.145   75.000   67.083
LGA    V    24_B      V    24_B     1.349     0    0.096   1.063     3.826   81.429   73.605
LGA    K    25_B      K    25_B     1.457     0    0.025   0.136     2.944   81.429   71.376
LGA    L    26_B      L    26_B     1.286     0    0.051   0.083     2.008   75.119   80.536
LGA    N    27_B      N    27_B     2.106     0    0.025   0.142     2.787   64.881   64.821
LGA    R    28_B      R    28_B     2.326     0    0.074   1.361     7.124   59.167   50.260
LGA    V    29_B      V    29_B     2.338     0    0.051   0.063     2.462   64.762   65.918
LGA    V    30_B      V    30_B     2.269     0    0.018   1.364     3.737   62.857   59.660
LGA    P    31_B      P    31_B     2.758     0    0.017   0.048     2.924   59.048   59.320
LGA    E    32_B      E    32_B     2.911     4    0.089   0.105     3.161   53.571   29.365
LGA    D    33_B      D    33_B     3.564     0    0.022   0.563     4.740   46.667   42.738
LGA    A    34_B      A    34_B     3.025     0    0.011   0.018     3.246   51.786   52.857
LGA    A    35_B      A    35_B     2.719     0    0.024   0.051     2.850   60.952   60.190
LGA    D    36_B      D    36_B     2.158     0    0.054   0.130     3.171   68.810   63.036
LGA    V    37_B      V    37_B     1.312     0    0.056   0.103     1.690   79.286   81.497
LGA    Y    38_B      Y    38_B     1.324     0    0.023   0.210     3.468   81.429   66.032
LGA    V    39_B      V    39_B     1.106     0    0.042   0.055     1.459   81.429   84.014
LGA    K    40_B      K    40_B     1.948     0    0.033   0.503     4.213   70.833   58.095
LGA    L    41_B      L    41_B     2.036     0    0.036   0.058     2.718   64.881   68.929
LGA    E    42_B      E    42_B     2.686     0    0.116   0.964     6.066   59.048   47.249
LGA    F    43_B      F    43_B     3.277     0    0.015   0.278     4.174   48.452   48.398
LGA    F    44_B      F    44_B     4.180     0    0.235   0.758     6.156   32.262   41.212
LGA    N    45_B      N    45_B     4.377     0    0.102   1.024     5.404   41.905   37.440
LGA    P    46_B      P    46_B     5.770     0    0.020   0.244     7.713   26.548   20.068
LGA    G    47_B      G    47_B     2.515     0    0.167   0.167     5.383   47.857   47.857
LGA    G    48_B      G    48_B     4.122     0    0.104   0.104     5.739   36.429   36.429
LGA    S    49_B      S    49_B     3.424     0    0.068   0.069     3.462   50.000   50.000
LGA    I    50_B      I    50_B     3.431     0    0.184   1.105     5.775   51.786   49.226
LGA    K    51_B      K    51_B     3.381     2    0.171   0.779     3.688   48.333   39.947
LGA    D    52_B      D    52_B     2.511     0    0.032   0.315     3.891   65.000   56.726
LGA    R    53_B      R    53_B     0.823     0    0.097   0.937     6.991   83.690   54.935
LGA    I    54_B      I    54_B     2.276     0    0.079   1.357     5.645   64.881   52.679
LGA    A    55_B      A    55_B     2.586     0    0.046   0.062     2.951   62.857   61.714
LGA    L    56_B      L    56_B     1.348     0    0.060   0.161     1.768   79.286   84.881
LGA    A    57_B      A    57_B     1.384     0    0.075   0.070     1.503   81.429   79.714
LGA    M    58_B      M    58_B     1.693     0    0.092   0.226     2.553   72.857   68.869
LGA    I    59_B      I    59_B     1.362     0    0.048   0.075     1.824   81.429   79.286
LGA    E    60_B      E    60_B     1.265     0    0.011   0.138     1.319   81.429   81.429
LGA    E    61_B      E    61_B     1.237     0    0.027   1.329     4.372   81.429   66.243
LGA    A    62_B      A    62_B     1.202     0    0.022   0.032     1.329   81.429   81.429
LGA    E    63_B      E    63_B     1.427     0    0.018   0.170     1.826   81.429   78.571
LGA    K    64_B      K    64_B     1.440     4    0.038   0.051     1.476   81.429   45.238
LGA    A    65_B      A    65_B     1.198     0    0.071   0.083     1.435   83.690   83.238
LGA    G    66_B      G    66_B     1.302     0    0.143   0.143     1.369   81.429   81.429
LGA    K    67_B      K    67_B     1.167     4    0.063   0.091     1.303   81.429   45.238
LGA    L    68_B      L    68_B     1.231     0    0.033   0.138     1.519   79.286   81.488
LGA    Q    69_B      Q    69_B     1.984     4    0.063   0.112     2.684   75.000   39.683
LGA    A    70_B      A    70_B     1.478     0    0.064   0.077     1.651   77.143   76.286
LGA    G    71_B      G    71_B     1.318     0    0.067   0.067     1.642   79.286   79.286
LGA    G    72_B      G    72_B     1.349     0    0.022   0.022     1.349   81.429   81.429
LGA    T    73_B      T    73_B     1.329     0    0.040   0.060     1.650   81.429   80.204
LGA    I    74_B      I    74_B     0.978     0    0.018   0.076     1.185   85.952   88.214
LGA    V    75_B      V    75_B     1.115     0    0.034   0.090     1.541   85.952   82.789
LGA    E    76_B      E    76_B     1.018     0    0.029   0.308     1.225   81.429   83.439
LGA    P    77_B      P    77_B     1.247     0    0.075   0.119     1.488   81.429   81.429
LGA    T    78_B      T    78_B     1.296     0    0.173   0.331     1.985   79.286   77.755
LGA    S    79_B      S    79_B     1.097     0    0.705   0.632     3.177   73.571   74.762
LGA    G    80_B      G    80_B     1.880     0    0.029   0.029     1.880   72.857   72.857
LGA    N    81_B      N    81_B     1.945     3    0.070   0.096     2.547   72.857   43.571
LGA    T    82_B      T    82_B     2.160     0    0.046   0.185     2.788   68.810   63.810
LGA    G    83_B      G    83_B     1.035     0    0.030   0.030     1.314   85.952   85.952
LGA    V    84_B      V    84_B     1.249     0    0.016   0.086     1.688   81.429   77.755
LGA    G    85_B      G    85_B     1.821     0    0.022   0.022     1.821   72.857   72.857
LGA    L    86_B      L    86_B     1.532     0    0.020   1.336     2.717   75.000   74.345
LGA    A    87_B      A    87_B     0.966     0    0.010   0.030     1.137   83.690   85.048
LGA    M    88_B      M    88_B     1.481     0    0.073   0.955     2.391   77.143   74.048
LGA    V    89_B      V    89_B     2.153     0    0.033   0.072     2.510   66.786   64.830
LGA    A    90_B      A    90_B     1.748     0    0.024   0.045     2.123   70.833   72.952
LGA    A    91_B      A    91_B     1.491     0    0.032   0.044     2.069   72.976   74.667
LGA    A    92_B      A    92_B     2.385     0    0.122   0.114     2.467   64.762   64.762
LGA    K    93_B      K    93_B     2.572     0    0.029   0.831     2.787   59.048   65.026
LGA    G    94_B      G    94_B     2.375     0    0.109   0.109     2.375   64.762   64.762
LGA    Y    95_B      Y    95_B     1.480     0    0.036   0.162     1.734   77.143   80.000
LGA    H    96_B      H    96_B     1.334     0    0.027   1.467     6.990   81.429   52.143
LGA    L    97_B      L    97_B     0.853     0    0.019   0.113     0.932   90.476   91.667
LGA    V    98_B      V    98_B     1.149     0    0.036   0.059     1.288   81.429   81.429
LGA    I    99_B      I    99_B     1.067     0    0.021   0.655     2.130   81.429   81.607
LGA    T   100_B      T   100_B     1.359     0    0.040   0.056     1.495   81.429   81.429
LGA    M   101_B      M   101_B     1.498     0    0.045   0.389     1.636   77.143   79.345
LGA    P   102_B      P   102_B     1.708     0    0.018   0.254     1.865   72.857   74.082
LGA    E   103_B      E   103_B     1.904     0    0.050   0.234     2.995   70.833   64.921
LGA    T   104_B      T   104_B     2.090     0    0.020   0.042     2.467   68.810   67.075
LGA    M   105_B      M   105_B     2.160     0    0.107   1.137     3.535   59.524   64.643
LGA    S   106_B      S   106_B     2.807     0    0.409   0.752     5.233   64.881   53.810
LGA    V   107_B      V   107_B     2.566     0    0.643   0.644     3.633   55.595   51.293
LGA    E   108_B      E   108_B     3.018     0    0.050   1.403     6.434   59.167   44.127
LGA    R   109_B      R   109_B     1.276     4    0.051   0.654     1.825   83.810   52.727
LGA    R   110_B      R   110_B     0.902     0    0.143   1.177     3.498   88.214   74.935
LGA    K   111_B      K   111_B     1.183     0    0.039   0.485     3.277   83.690   75.185
LGA    L   112_B      L   112_B     0.824     0    0.042   1.364     3.691   90.476   75.357
LGA    M   113_B      M   113_B     0.648     0    0.007   0.245     1.557   90.476   88.274
LGA    Q   114_B      Q   114_B     0.611     0    0.036   0.082     1.142   90.476   87.460
LGA    G   115_B      G   115_B     0.537     0    0.017   0.017     0.603   95.238   95.238
LGA    Y   116_B      Y   116_B     0.446     0    0.048   0.060     1.184   95.238   90.556
LGA    G   117_B      G   117_B     0.604     0    0.061   0.061     1.130   90.595   90.595
LGA    A   118_B      A   118_B     0.760     0    0.073   0.085     1.190   88.214   88.667
LGA    E   119_B      E   119_B     1.227     0    0.055   0.624     2.499   81.429   76.720
LGA    L   120_B      L   120_B     1.231     0    0.067   0.318     1.889   79.286   81.488
LGA    I   121_B      I   121_B     1.406     1    0.020   0.053     1.549   81.429   70.179
LGA    L   122_B      L   122_B     1.601     0    0.023   0.074     1.887   72.857   75.000
LGA    T   123_B      T   123_B     2.110     0    0.037   0.103     2.315   66.786   65.918
LGA    P   124_B      P   124_B     2.520     0    0.024   0.127     2.868   59.048   58.231
LGA    G   125_B      G   125_B     2.650     0    0.049   0.049     2.982   57.143   57.143
LGA    A   126_B      A   126_B     3.564     0    0.020   0.043     3.889   48.333   47.333
LGA    D   127_B      D   127_B     2.486     0    0.042   0.447     3.881   62.857   60.179
LGA    G   128_B      G   128_B     2.218     0    0.059   0.059     2.340   66.786   66.786
LGA    M   129_B      M   129_B     1.890     0    0.079   0.538     3.048   70.833   66.012
LGA    K   130_B      K   130_B     2.133     4    0.020   0.079     2.133   64.762   35.979
LGA    G   131_B      G   131_B     2.036     0    0.037   0.037     2.108   68.810   68.810
LGA    A   132_B      A   132_B     1.591     0    0.012   0.026     1.782   75.000   74.571
LGA    I   133_B      I   133_B     1.476     0    0.033   0.089     1.603   75.000   75.000
LGA    A   134_B      A   134_B     1.877     0    0.033   0.046     2.106   72.857   71.238
LGA    K   135_B      K   135_B     1.748     0    0.033   0.658     1.845   72.857   74.762
LGA    A   136_B      A   136_B     1.405     0    0.017   0.024     1.562   79.286   79.714
LGA    E   137_B      E   137_B     1.452     2    0.044   0.082     1.643   77.143   60.476
LGA    E   138_B      E   138_B     1.680     0    0.059   0.725     3.893   72.857   63.757
LGA    L   139_B      L   139_B     1.389     0    0.021   0.112     1.519   81.429   80.357
LGA    V   140_B      V   140_B     1.526     0    0.109   0.143     1.875   72.857   74.082
LGA    K   141_B      K   141_B     1.765     4    0.051   0.074     2.010   72.857   39.577
LGA    E   142_B      E   142_B     1.555     4    0.019   0.083     1.653   75.000   42.381
LGA    K   143_B      K   143_B     1.518     4    0.032   0.051     1.612   72.857   40.476
LGA    G   144_B      G   144_B     1.686     0    0.022   0.022     1.686   72.857   72.857
LGA    Y   145_B      Y   145_B     1.428     0    0.057   0.096     1.604   77.143   78.571
LGA    F   146_B      F   146_B     1.010     0    0.032   0.139     1.167   83.690   83.896
LGA    M   147_B      M   147_B     0.998     0    0.015   0.118     1.198   85.952   83.690
LGA    P   148_B      P   148_B     1.138     0    0.642   0.709     2.658   75.357   79.252
LGA    M   149_B      M   149_B     2.918     3    0.344   0.365     3.250   62.976   37.738
LGA    Q   150_B      Q   150_B     3.140     4    0.698   0.636     4.924   48.571   25.079
LGA    F   151_B      F   151_B     2.696     0    0.161   1.352    11.370   66.905   29.567
LGA    D   152_B      D   152_B     4.346     3    0.288   0.288     6.724   33.452   19.405
LGA    N   153_B      N   153_B     7.419     3    0.105   0.129     8.397   13.690    7.440
LGA    P   154_B      P   154_B     8.375     0    0.210   0.213    10.668    2.857    1.905
LGA    A   155_B      A   155_B    12.945     0    0.594   0.588    14.786    0.000    0.000
LGA    H   160_B      H   160_B    12.574     5    0.640   0.626    13.388    0.000    0.000
LGA    E   161_B      E   161_B     8.733     0    0.167   0.781     9.956    3.810    5.185
LGA    E   162_B      E   162_B     7.264     0    0.184   0.984     7.821   10.119   10.476
LGA    T   163_B      T   163_B     8.948     0    0.161   1.194    10.619    2.143    2.313
LGA    T   164_B      T   164_B     9.882     0    0.060   0.136    10.896    0.952    0.544
LGA    G   165_B      G   165_B     7.704     0    0.040   0.040     8.385    7.976    7.976
LGA    K   166_B      K   166_B     6.923     4    0.023   0.083     7.681    9.405    6.085
LGA    E   167_B      E   167_B     9.366     0    0.077   0.897    10.116    1.786    1.429
LGA    I   168_B      I   168_B     9.502     0    0.025   0.048    10.246    1.548    1.131
LGA    L   169_B      L   169_B     7.779     0    0.025   1.171     8.671    4.881   11.964
LGA    E   170_B      E   170_B     9.340     0    0.041   0.856    10.558    1.071    1.429
LGA    A   171_B      A   171_B    11.285     0    0.070   0.076    12.019    0.000    0.000
LGA    F   172_B      F   172_B    10.204     0    0.124   0.158    10.354    0.000    0.563
LGA    G   173_B      G   173_B    10.790     0    0.658   0.658    10.790    0.119    0.119
LGA    D   174_B      D   174_B    11.495     0    0.141   0.282    14.738    0.000    0.000
LGA    D   175_B      D   175_B     9.404     0    0.248   0.431    10.217    2.262    1.726
LGA    I   176_B      I   176_B     5.367     0    0.088   0.626     6.999   25.595   27.083
LGA    P   177_B      P   177_B     3.323     0    0.124   0.435     4.286   48.571   47.415
LGA    D   178_B      D   178_B     2.763     0    0.031   0.273     4.865   60.952   52.381
LGA    A   179_B      A   179_B     1.849     0    0.059   0.055     2.238   70.833   71.238
LGA    F   180_B      F   180_B     1.573     0    0.007   0.213     2.163   77.143   73.680
LGA    V   181_B      V   181_B     1.078     0    0.019   0.077     1.284   81.429   85.306
LGA    A   182_B      A   182_B     1.555     0    0.087   0.104     1.803   75.000   74.571
LGA    G   183_B      G   183_B     1.574     0    0.114   0.114     1.574   79.405   79.405
LGA    V   184_B      V   184_B     1.848     0    0.179   1.124     3.660   70.833   65.238
LGA    G   185_B      G   185_B     2.839     0    0.071   0.071     4.214   50.595   50.595
LGA    T   186_B      T   186_B     5.595     0    0.100   0.116     7.254   23.095   18.980
LGA    G   187_B      G   187_B     3.655     0    0.153   0.153     4.052   43.452   43.452
LGA    G   188_B      G   188_B     4.860     0    0.122   0.122     4.860   34.286   34.286
LGA    T   189_B      T   189_B     4.011     0    0.032   0.130     4.662   41.905   39.048
LGA    L   190_B      L   190_B     2.262     0    0.031   0.207     2.710   62.857   66.845
LGA    T   191_B      T   191_B     2.727     0    0.064   0.121     3.495   57.143   54.082
LGA    G   192_B      G   192_B     3.549     0    0.009   0.009     3.549   48.333   48.333
LGA    V   193_B      V   193_B     3.218     0    0.048   0.088     3.440   51.786   51.020
LGA    G   194_B      G   194_B     2.336     0    0.043   0.043     2.587   62.857   62.857
LGA    H   195_B      H   195_B     2.782     0    0.020   0.346     3.275   53.571   55.095
LGA    A   196_B      A   196_B     3.530     0    0.043   0.046     3.835   46.667   46.000
LGA    L   197_B      L   197_B     3.062     0    0.014   0.061     3.632   53.571   52.738
LGA    K   198_B      K   198_B     2.531     0    0.076   0.387     2.617   57.143   67.884
LGA    K   199_B      K   199_B     2.945     2    0.089   0.525     4.249   57.143   40.000
LGA    A   200_B      A   200_B     3.230     0    0.030   0.045     3.322   50.000   50.000
LGA    N   201_B      N   201_B     2.909     0    0.037   0.126     3.524   55.357   52.738
LGA    P   202_B      P   202_B     2.216     0    0.090   0.104     2.494   64.762   64.762
LGA    N   203_B      N   203_B     2.199     0    0.024   1.108     3.287   64.762   61.964
LGA    V   204_B      V   204_B     2.299     0    0.022   0.043     2.508   68.810   65.986
LGA    Q   205_B      Q   205_B     1.751     0    0.035   0.943     3.546   72.857   69.577
LGA    I   206_B      I   206_B     1.594     0    0.016   0.053     2.077   77.143   73.988
LGA    Y   207_B      Y   207_B     1.229     0    0.045   0.068     1.400   81.429   84.444
LGA    A   208_B      A   208_B     1.783     0    0.018   0.017     2.050   72.857   71.238
LGA    L   209_B      L   209_B     1.856     0    0.026   0.251     2.543   68.810   69.940
LGA    E   210_B      E   210_B     2.407     0    0.030   0.362     2.520   62.857   66.614
LGA    P   211_B      P   211_B     2.933     0    0.099   0.291     3.277   57.143   56.122
LGA    A   212_B      A   212_B     3.215     0    0.573   0.515     3.309   51.786   51.429
LGA    P   236_B      P   236_B    14.581     0    0.504   0.755    15.641    0.000    0.000
LGA    K   237_B      K   237_B    14.724     0    0.517   1.000    17.477    0.000    0.000
LGA    V   238_B      V   238_B    14.783     0    0.577   0.929    17.243    0.000    0.000
LGA    L   239_B      L   239_B     8.925     0    0.156   1.431    11.029    2.143    8.095
LGA    D   240_B      D   240_B     7.236     0    0.050   1.093     8.276   18.095   12.798
LGA    T   241_B      T   241_B     3.715     0    0.143   0.202     5.819   51.190   39.864
LGA    D   242_B      D   242_B     2.629     0    0.168   0.160     4.252   60.952   54.762
LGA    V   243_B      V   243_B     1.904     0    0.161   0.177     2.170   70.833   75.442
LGA    Y   244_B      Y   244_B     1.386     0    0.074   0.995     5.078   83.810   66.508
LGA    N   245_B      N   245_B     1.217     0    0.026   0.232     1.822   81.429   80.357
LGA    G   246_B      G   246_B     1.310     0    0.063   0.063     1.310   81.429   81.429
LGA    I   247_B      I   247_B     1.126     0    0.042   0.088     1.452   83.690   82.560
LGA    L   248_B      L   248_B     1.069     0    0.022   0.082     1.603   79.286   84.881
LGA    E   249_B      E   249_B     1.957     0    0.147   0.428     3.381   68.810   67.619
LGA    I   250_B      I   250_B     2.562     0    0.033   0.101     2.987   59.048   63.929
LGA    K   251_B      K   251_B     3.466     2    0.023   0.109     4.069   48.333   35.238
LGA    S   252_B      S   252_B     3.880     0    0.016   0.576     5.116   43.333   39.444
LGA    D   253_B      D   253_B     4.181     0    0.027   0.976     7.491   40.238   29.405
LGA    D   254_B      D   254_B     3.237     0    0.032   0.558     4.281   51.905   47.679
LGA    A   255_B      A   255_B     2.782     0    0.054   0.062     3.033   55.357   55.714
LGA    I   256_B      I   256_B     3.679     0    0.009   0.096     4.479   45.000   41.071
LGA    T   257_B      T   257_B     3.616     0    0.025   0.107     4.217   46.667   44.354
LGA    M   258_B      M   258_B     2.574     0    0.013   0.811     3.396   57.143   59.107
LGA    A   259_B      A   259_B     2.691     0    0.051   0.054     2.905   57.143   57.143
LGA    R   260_B      R   260_B     3.254     0    0.023   1.365     9.260   51.786   31.602
LGA    E   261_B      E   261_B     2.826     0    0.022   0.176     3.435   60.952   55.661
LGA    V   262_B      V   262_B     1.845     0    0.010   0.051     2.131   70.833   71.701
LGA    G   263_B      G   263_B     2.239     0    0.050   0.050     2.326   64.762   64.762
LGA    H   264_B      H   264_B     2.732     0    0.112   0.243     3.964   59.048   53.000
LGA    Q   265_B      Q   265_B     2.316     0    0.084   1.045     4.415   66.786   61.958
LGA    E   266_B      E   266_B     1.379     0    0.037   0.159     1.651   79.286   80.476
LGA    G   267_B      G   267_B     1.339     0    0.049   0.049     1.382   81.429   81.429
LGA    I   268_B      I   268_B     1.174     0    0.068   0.127     1.861   77.143   82.679
LGA    L   269_B      L   269_B     2.096     0    0.061   0.117     3.215   66.786   61.131
LGA    V   270_B      V   270_B     2.465     0    0.045   0.060     3.084   59.167   60.476
LGA    G   271_B      G   271_B     3.384     0    0.049   0.049     3.384   50.000   50.000
LGA    I   272_B      I   272_B     3.209     0    0.046   0.240     4.340   53.571   47.738
LGA    S   273_B      S   273_B     2.769     0    0.082   0.578     3.123   60.952   57.302
LGA    A   274_B      A   274_B     1.934     0    0.018   0.050     2.203   72.976   72.952
LGA    G   275_B      G   275_B     2.051     0    0.023   0.023     2.051   68.810   68.810
LGA    A   276_B      A   276_B     2.153     0    0.020   0.035     2.442   68.810   68.000
LGA    N   277_B      N   277_B     1.580     0    0.039   0.090     2.076   77.143   74.048
LGA    I   278_B      I   278_B     1.203     0    0.043   0.107     1.393   81.429   81.429
LGA    K   279_B      K   279_B     1.715     0    0.010   0.158     3.339   72.857   65.026
LGA    G   280_B      G   280_B     1.159     0    0.014   0.014     1.365   83.690   83.690
LGA    A   281_B      A   281_B     0.712     0    0.026   0.042     1.137   88.214   88.667
LGA    I   282_B      I   282_B     1.452     0    0.034   0.091     2.093   75.119   72.976
LGA    E   283_B      E   283_B     1.771     0    0.099   0.170     2.234   70.833   71.958
LGA    V   284_B      V   284_B     1.396     0    0.022   0.043     1.974   77.143   80.272
LGA    A   285_B      A   285_B     1.824     0    0.023   0.051     2.489   68.810   69.619
LGA    K   286_B      K   286_B     2.584     0    0.033   0.334     3.919   57.262   56.508
LGA    K   287_B      K   287_B     2.691     2    0.106   0.185     3.123   55.357   47.090
LGA    L   288_B      L   288_B     2.915     0    0.020   0.184     3.659   51.905   54.583
LGA    G   289_B      G   289_B     3.522     0    0.014   0.014     3.593   46.667   46.667
LGA    K   290_B      K   290_B     3.793     2    0.031   0.495     4.248   41.786   33.175
LGA    G   291_B      G   291_B     3.975     0    0.020   0.020     4.037   41.786   41.786
LGA    K   292_B      K   292_B     3.393     0    0.015   0.651     4.307   48.333   46.561
LGA    Q   293_B      Q   293_B     2.669     0    0.052   0.724     6.218   57.262   43.598
LGA    V   294_B      V   294_B     1.618     0    0.016   0.039     1.867   75.000   77.755
LGA    I   295_B      I   295_B     1.534     0    0.045   1.310     4.167   77.143   70.774
LGA    T   296_B      T   296_B     1.136     0    0.031   0.088     1.310   81.429   84.014
LGA    V   297_B      V   297_B     1.702     0    0.036   0.082     1.867   72.857   72.857
LGA    A   298_B      A   298_B     1.921     0    0.052   0.052     2.628   66.905   68.095
LGA    P   299_B      P   299_B     2.897     0    0.012   0.198     4.019   50.595   54.490
LGA    D   300_B      D   300_B     4.301     0    0.073   0.301     6.412   43.452   35.060
LGA    G   301_B      G   301_B     3.601     0    0.061   0.061     4.194   41.786   41.786
LGA    G   302_B      G   302_B     3.824     0    0.046   0.046     4.258   41.786   41.786
LGA    D   303_B      D   303_B     3.599     0    0.182   0.550     5.095   37.500   41.310
LGA    R   304_B      R   304_B     5.015     6    0.027   0.058     5.785   27.738   12.944
LGA    Y   305_B      Y   305_B     5.463     0    0.022   0.092     5.730   23.810   25.476
LGA    L   306_B      L   306_B     5.256     0    0.045   0.136     5.819   23.810   26.964
LGA    S   307_B      S   307_B     6.632     0    0.161   0.614     7.975   11.905   11.825
LGA    T   308_B      T   308_B     6.948     0    0.019   0.155     6.948   13.333   13.333
LGA    E   309_B      E   309_B     7.237     3    0.101   0.685     8.681   11.667    6.296
LGA    L   310_B      L   310_B     5.776     0    0.054   0.101     6.389   21.548   25.833
LGA    F   311_B      F   311_B     5.295     0    0.398   0.488     5.467   28.929   31.602
LGA    N   312_B      N   312_B     7.057     0    0.516   1.052    11.986   12.500    6.607
LGA    Y   313_B      Y   313_B     6.699     0    0.627   0.495     8.188   11.190   18.095

# 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):     3.921          3.897                  4.178           58.955   55.526

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  313  281    4.0    235    2.28    65.302    62.726     9.892

LGA_LOCAL      RMSD:   2.276  Number of atoms:  235  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   4.008  Number of assigned atoms:  281 
Std_ASGN_ATOMS RMSD:   3.921  Standard rmsd on all 281 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.420233 * X  +   0.225078 * Y  +   0.879059 * Z  +   8.220948
  Y_new =  -0.736151 * X  +  -0.481851 * Y  +   0.475291 * Z  +   8.361679
  Z_new =   0.530552 * X  +  -0.846853 * Y  +  -0.036798 * Z  +  24.344318 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -1.052085 -0.559252 -1.614222   [DEG:  -60.2801  -32.0428  -92.4881 ]
ZXZ:  2.066457  1.607603  2.581916   [DEG:  118.3993   92.1088  147.9329 ]
 
# END of job
