
#######################################################
#                                                     #
#                        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       4.37     4.37
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   114      39_B - 152_B       1.97     6.52
  LONGEST_CONTINUOUS_SEGMENT:   114      40_B - 153_B       1.99     6.75
  LCS_AVERAGE:     32.85

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    83      66_B - 148_B       0.99     8.19
  LCS_AVERAGE:     19.92

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      7   34   63  103  125  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     H     7_B     H     7_B     14   16  281     27   56   81   98  115  128  144  163  193  219  231  244  250  257  261  266  270  273  275  276 
LCS_GDT     T     8_B     T     8_B     14   16  281     27   56   81   98  115  129  151  181  207  224  239  246  250  257  261  267  271  273  275  276 
LCS_GDT     K     9_B     K     9_B     14   16  281      3   57   81   98  115  128  144  174  204  219  238  246  250  257  261  267  271  273  275  276 
LCS_GDT     I    10_B     I    10_B     14   16  281     10   57   81   98  115  129  156  181  213  224  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     T    11_B     T    11_B     14   16  281     10   53   81   98  115  134  171  200  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     N    12_B     N    12_B     14   16  281     10   17   74   98  115  134  171  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     S    13_B     S    13_B     14   16  281     10   17   75   98  121  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     I    14_B     I    14_B     14   32  281     18   56   78   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     V    15_B     V    15_B     14   33  281     10   54   73   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     N    16_B     N    16_B     14   33  281     27   56   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     L    17_B     L    17_B     14   52  281     18   56   81  103  130  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     I    18_B     I    18_B     29   52  281      6   61  109  126  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     G    19_B     G    19_B     29   52  281      5   50  109  128  134  139  168  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     N    20_B     N    20_B     29   52  281     10   96  116  128  134  140  170  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     T    21_B     T    21_B     29   52  281     68  101  116  128  134  144  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     P    22_B     P    22_B     29   52  281     72  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     I    23_B     I    23_B     29   52  281     68  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     V    24_B     V    24_B     29   52  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     K    25_B     K    25_B     29   52  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     L    26_B     L    26_B     29   52  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     N    27_B     N    27_B     29   52  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     R    28_B     R    28_B     29   52  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     V    29_B     V    29_B     29   52  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     V    30_B     V    30_B     29   52  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     P    31_B     P    31_B     29   52  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     E    32_B     E    32_B     29   52  281     68  101  116  128  134  151  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     D    33_B     D    33_B     29   52  281     77  101  116  128  134  143  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     A    34_B     A    34_B     29   52  281     77  101  116  128  134  151  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     A    35_B     A    35_B     29   52  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     D    36_B     D    36_B     29   52  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     V    37_B     V    37_B     29   52  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     Y    38_B     Y    38_B     29  113  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     V    39_B     V    39_B     29  114  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     K    40_B     K    40_B     29  114  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     L    41_B     L    41_B     29  114  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     E    42_B     E    42_B     29  114  281     75  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     F    43_B     F    43_B     29  114  281     51  101  116  128  134  140  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     F    44_B     F    44_B     29  114  281      4   94  113  128  134  138  163  195  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     N    45_B     N    45_B     29  114  281     54   97  114  127  134  138  163  187  219  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     P    46_B     P    46_B     29  114  281      4   18   53  121  133  138  147  161  192  219  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     G    47_B     G    47_B     30  114  281      4   41   73   96  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     G    48_B     G    48_B     30  114  281      4    6   17   29   77  138  174  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     S    49_B     S    49_B     30  114  281      4   17   38   59  100  149  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     I    50_B     I    50_B     30  114  281      4   17   36   56   95  149  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     K    51_B     K    51_B     30  114  281      8   20   46   68  101  149  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     D    52_B     D    52_B     30  114  281     12   52   77   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     R    53_B     R    53_B     30  114  281     15   39   66   97  125  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     I    54_B     I    54_B     30  114  281      9   25   56   88  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     A    55_B     A    55_B     30  114  281      9   40   66   96  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     L    56_B     L    56_B     30  114  281     23   57   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     A    57_B     A    57_B     30  114  281     15   42   73   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     M    58_B     M    58_B     30  114  281     15   42   74   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     I    59_B     I    59_B     30  114  281     21   61   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     E    60_B     E    60_B     30  114  281     21   56   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     E    61_B     E    61_B     30  114  281     19   54   78   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     A    62_B     A    62_B     30  114  281     24   65   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     E    63_B     E    63_B     30  114  281     21   56   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     K    64_B     K    64_B     30  114  281     20   56   79   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     A    65_B     A    65_B     30  114  281     24   65   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     G    66_B     G    66_B     83  114  281     22   60   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     K    67_B     K    67_B     83  114  281     29   66   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     L    68_B     L    68_B     83  114  281     29   66   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     Q    69_B     Q    69_B     83  114  281     36   66   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     A    70_B     A    70_B     83  114  281     31   66   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     G    71_B     G    71_B     83  114  281     31   65   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     G    72_B     G    72_B     83  114  281     36   66   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     T    73_B     T    73_B     83  114  281     47   66   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     I    74_B     I    74_B     83  114  281     48   66   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     V    75_B     V    75_B     83  114  281     48   66   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     E    76_B     E    76_B     83  114  281     48   66   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     P    77_B     P    77_B     83  114  281     48   66   81   98  116  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     T    78_B     T    78_B     83  114  281     18   66   81   98  115  153  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     S    79_B     S    79_B     83  114  281      3    4   30   96  115  141  180  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     G    80_B     G    80_B     83  114  281      8   36   93  118  130  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     N    81_B     N    81_B     83  114  281      7   44  109  126  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     T    82_B     T    82_B     83  114  281     18   60  109  126  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     G    83_B     G    83_B     83  114  281     18   38   76  112  128  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     V    84_B     V    84_B     83  114  281     18   62   90  118  130  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     G    85_B     G    85_B     83  114  281     18   62   95  121  131  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     L    86_B     L    86_B     83  114  281     18   63   79  103  126  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     A    87_B     A    87_B     83  114  281     48   66   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     M    88_B     M    88_B     83  114  281     48   66   81  103  125  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     V    89_B     V    89_B     83  114  281     48   66   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     A    90_B     A    90_B     83  114  281     48   66   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     A    91_B     A    91_B     83  114  281     48   66   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     A    92_B     A    92_B     83  114  281     48   66   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     K    93_B     K    93_B     83  114  281     45   66   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     G    94_B     G    94_B     83  114  281     48   66   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     Y    95_B     Y    95_B     83  114  281     45   66   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     H    96_B     H    96_B     83  114  281     45   66   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     L    97_B     L    97_B     83  114  281     48   66   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     V    98_B     V    98_B     83  114  281     48   66   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     I    99_B     I    99_B     83  114  281     48   66   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     T   100_B     T   100_B     83  114  281     48   66   81   98  115  147  182  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     M   101_B     M   101_B     83  114  281     48   66   81   98  115  141  173  200  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     P   102_B     P   102_B     83  114  281     48   66   81   98  115  129  152  184  209  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     E   103_B     E   103_B     83  114  281     48   66   81   98  115  129  150  177  205  226  238  246  250  257  262  267  271  273  275  276 
LCS_GDT     T   104_B     T   104_B     83  114  281     48   66   81   98  115  128  141  168  194  219  236  246  250  257  262  267  271  273  275  276 
LCS_GDT     M   105_B     M   105_B     83  114  281      4   66   81   98  115  129  150  181  206  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     S   106_B     S   106_B     83  114  281      3   12   72   98  115  129  154  185  210  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     V   107_B     V   107_B     83  114  281      3   19   70   97  115  129  158  195  218  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     E   108_B     E   108_B     83  114  281      3   45   69   90  111  126  141  168  203  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     R   109_B     R   109_B     83  114  281      3   45   78   98  115  146  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     R   110_B     R   110_B     83  114  281     42   66   81   98  116  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     K   111_B     K   111_B     83  114  281     48   66   81   98  116  153  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     L   112_B     L   112_B     83  114  281     48   66   81  100  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     M   113_B     M   113_B     83  114  281     48   66   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     Q   114_B     Q   114_B     83  114  281     48   66   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     G   115_B     G   115_B     83  114  281     48   66   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     Y   116_B     Y   116_B     83  114  281     48   66   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     G   117_B     G   117_B     83  114  281     48   66   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     A   118_B     A   118_B     83  114  281     48   66   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     E   119_B     E   119_B     83  114  281     48   66   81   98  116  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     L   120_B     L   120_B     83  114  281     48   66   81   98  116  153  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     I   121_B     I   121_B     83  114  281     48   66   81   98  115  141  173  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     L   122_B     L   122_B     83  114  281     48   66   81   98  115  137  162  191  214  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     T   123_B     T   123_B     83  114  281     47   66   81   98  115  129  152  179  205  227  238  246  250  257  262  267  271  273  275  276 
LCS_GDT     P   124_B     P   124_B     83  114  281     28   63   78   98  113  126  139  160  185  208  231  242  250  257  261  267  271  273  275  276 
LCS_GDT     G   125_B     G   125_B     83  114  281     20   63   77   96  111  125  137  151  176  201  224  241  250  257  260  267  271  273  275  276 
LCS_GDT     A   126_B     A   126_B     83  114  281      7   52   72   87  106  119  129  143  158  176  202  224  243  254  260  264  270  273  275  276 
LCS_GDT     D   127_B     D   127_B     83  114  281     48   66   81   98  113  126  139  163  188  210  231  245  250  257  261  267  271  273  275  276 
LCS_GDT     G   128_B     G   128_B     83  114  281     28   66   79   98  113  126  139  163  190  216  238  246  250  257  262  267  271  273  275  276 
LCS_GDT     M   129_B     M   129_B     83  114  281     48   66   81   98  115  129  151  185  214  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     K   130_B     K   130_B     83  114  281     48   66   81   98  115  129  152  184  210  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     G   131_B     G   131_B     83  114  281     48   66   81   98  115  129  152  182  205  229  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     A   132_B     A   132_B     83  114  281     48   66   81   98  115  141  173  198  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     I   133_B     I   133_B     83  114  281     48   66   81   98  115  141  181  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     A   134_B     A   134_B     83  114  281     48   66   81   98  115  141  173  197  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     K   135_B     K   135_B     83  114  281     48   66   81   98  115  141  173  197  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     A   136_B     A   136_B     83  114  281     48   66   81   98  116  151  182  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     E   137_B     E   137_B     83  114  281     48   66   81   98  116  153  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     E   138_B     E   138_B     83  114  281     48   66   81   98  115  142  174  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     L   139_B     L   139_B     83  114  281     48   66   81   98  116  148  181  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     V   140_B     V   140_B     83  114  281     48   66   81   98  116  153  182  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     K   141_B     K   141_B     83  114  281     48   66   81   98  116  148  180  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     E   142_B     E   142_B     83  114  281     43   66   81   98  115  142  174  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     K   143_B     K   143_B     83  114  281     45   66   81   98  115  145  178  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     G   144_B     G   144_B     83  114  281     45   66   81   98  116  149  181  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     Y   145_B     Y   145_B     83  114  281     48   66   81   98  116  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     F   146_B     F   146_B     83  114  281     48   66   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     M   147_B     M   147_B     83  114  281     48   66   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     P   148_B     P   148_B     83  114  281     45   66   81   98  122  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     M   149_B     M   149_B     79  114  281      3   25   60   88  116  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     Q   150_B     Q   150_B     71  114  281      3   36   68   96  115  148  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     F   151_B     F   151_B      6  114  281      3    8   35   74  117  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     D   152_B     D   152_B      6  114  281      8   27   33   67  122  140  181  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     N   153_B     N   153_B      6  114  281      3    6   35   51   77  101  138  146  174  189  217  242  250  257  262  267  271  273  275  276 
LCS_GDT     P   154_B     P   154_B      6  113  281      3   16   35   48   55   87  120  141  171  187  209  240  249  257  262  267  271  273  275  276 
LCS_GDT     A   155_B     A   155_B      6  105  281      3    6    6    7    8   12   23   27   70   83  101  120  155  180  208  229  253  269  272  276 
LCS_GDT     H   160_B     H   160_B      4   18  281      3    4    4    6   15   21   25   27   33   44   54   65   94  131  211  244  258  266  270  272 
LCS_GDT     E   161_B     E   161_B      5   18  281      3    4    5   14   21   28   48   80  117  156  184  215  248  255  262  267  271  273  275  276 
LCS_GDT     E   162_B     E   162_B     12   18  281      3    6   14   26   35   51   79  112  161  210  234  243  250  257  262  267  271  273  275  276 
LCS_GDT     T   163_B     T   163_B     12   18  281      9   11   14   19   33   51   65   80   99  149  185  227  248  255  262  267  271  273  275  276 
LCS_GDT     T   164_B     T   164_B     12   18  281      9   11   14   18   21   27   42   66   84  121  170  195  223  250  259  267  271  273  275  276 
LCS_GDT     G   165_B     G   165_B     12   18  281      9   11   14   18   35   51   65   90  135  176  227  242  250  257  262  267  271  273  275  276 
LCS_GDT     K   166_B     K   166_B     12   18  281      9   11   14   31   52   68  121  146  180  219  235  243  250  257  262  267  271  273  275  276 
LCS_GDT     E   167_B     E   167_B     12   18  281      9   11   30   46   54   77  103  140  149  164  191  227  248  255  262  267  271  273  275  276 
LCS_GDT     I   168_B     I   168_B     12   18  281      9   11   14   22   48   65  117  133  146  155  179  209  245  254  262  267  271  273  275  276 
LCS_GDT     L   169_B     L   169_B     12   44  281      9   20   57   98  128  137  141  146  161  184  227  242  250  257  262  267  271  273  275  276 
LCS_GDT     E   170_B     E   170_B     12   44  281      9   15   48   94  120  137  140  144  152  161  178  209  238  251  262  267  271  273  275  276 
LCS_GDT     A   171_B     A   171_B     12   44  281      9   11   16   29   63   98  120  137  145  151  155  167  183  225  237  257  266  273  275  276 
LCS_GDT     F   172_B     F   172_B     12   44  281      9   11   14   23   62  100  124  140  146  151  159  174  202  242  256  264  271  273  275  276 
LCS_GDT     G   173_B     G   173_B     12   44  281      5   11   15   35   51   92  120  136  144  151  157  165  183  225  237  259  265  273  275  276 
LCS_GDT     D   174_B     D   174_B      5   44  281      3    7   13   30   51   92  107  136  144  151  155  165  174  194  237  249  265  270  275  276 
LCS_GDT     D   175_B     D   175_B      5   44  281      3    7   13   35   61  102  129  141  146  152  168  186  238  249  259  267  271  273  275  276 
LCS_GDT     I   176_B     I   176_B     37   44  281      9   89  108  128  133  138  146  185  215  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     P   177_B     P   177_B     37   44  281     75  101  116  128  134  149  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     D   178_B     D   178_B     37   44  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     A   179_B     A   179_B     37   44  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     F   180_B     F   180_B     37   44  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     V   181_B     V   181_B     37   44  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     A   182_B     A   182_B     37   44  281     65  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     G   183_B     G   183_B     37   44  281     20   85  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     V   184_B     V   184_B     37   44  281     12   85  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     G   185_B     G   185_B     37   44  281     17   46  103  126  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     T   186_B     T   186_B     37   44  281      7   24   66  111  130  138  154  181  214  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     G   187_B     G   187_B     37   44  281      7   50  113  128  134  146  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     G   188_B     G   188_B     37   44  281     11   50   78  100  130  138  168  196  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     T   189_B     T   189_B     37   44  281      7   28   68   92  130  141  181  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     L   190_B     L   190_B     37  100  281     16   46  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     T   191_B     T   191_B     37  100  281     21   64  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     G   192_B     G   192_B     37  100  281     17   46  108  126  134  151  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     V   193_B     V   193_B     37  100  281     17   55  116  128  134  153  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     G   194_B     G   194_B     37  100  281     17   78  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     H   195_B     H   195_B     37  100  281     17   78  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     A   196_B     A   196_B     37  100  281     14   93  116  128  134  149  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     L   197_B     L   197_B     37  100  281     26  101  116  128  134  153  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     K   198_B     K   198_B     37  100  281     18   99  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     K   199_B     K   199_B     37  100  281     15   95  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     A   200_B     A   200_B     37  100  281     32   99  116  128  134  151  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     N   201_B     N   201_B     37  100  281     25   98  116  128  134  153  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     P   202_B     P   202_B     37  100  281     18   96  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     N   203_B     N   203_B     37  100  281     43  100  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     V   204_B     V   204_B     37  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     Q   205_B     Q   205_B     37  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     I   206_B     I   206_B     37  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     Y   207_B     Y   207_B     37  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     A   208_B     A   208_B     37  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     L   209_B     L   209_B     37  100  281     65  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     E   210_B     E   210_B     37  100  281     65  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     P   211_B     P   211_B     37  100  281     26   97  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     A   212_B     A   212_B     37  100  281     26   85  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     P   236_B     P   236_B      3  100  281      0    3    3    7    9   27   34   49   89  133  148  151  155  163  177  185  202  235  244  252 
LCS_GDT     K   237_B     K   237_B      3  100  281      0    3    3    3    7    9   59   72   88  100  113  146  153  160  173  192  220  233  245  252 
LCS_GDT     V   238_B     V   238_B      5  100  281      4    5    6   11   15   23   61   76   86  106  116  131  149  160  172  184  193  198  242  252 
LCS_GDT     L   239_B     L   239_B     70  100  281      4    7   13   33   61  116  136  142  150  163  184  197  220  242  259  267  271  273  275  276 
LCS_GDT     D   240_B     D   240_B     74  100  281      4   12   75  102  127  137  142  155  183  212  233  246  250  257  262  267  271  273  275  276 
LCS_GDT     T   241_B     T   241_B     74  100  281      4   63  112  128  134  151  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     D   242_B     D   242_B     74  100  281     66  100  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     V   243_B     V   243_B     74  100  281     19   99  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     Y   244_B     Y   244_B     74  100  281     65  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     N   245_B     N   245_B     74  100  281     41  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     G   246_B     G   246_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     I   247_B     I   247_B     74  100  281     65  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     L   248_B     L   248_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     E   249_B     E   249_B     74  100  281     54  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     I   250_B     I   250_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     K   251_B     K   251_B     74  100  281     77  101  116  128  134  151  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     S   252_B     S   252_B     74  100  281     77  101  116  128  134  143  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     D   253_B     D   253_B     74  100  281     77  101  116  128  134  140  171  196  216  228  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     D   254_B     D   254_B     74  100  281     77  101  116  128  134  151  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     A   255_B     A   255_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     I   256_B     I   256_B     74  100  281     77  101  116  128  134  143  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     T   257_B     T   257_B     74  100  281     77  101  116  128  134  144  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     M   258_B     M   258_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     A   259_B     A   259_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     R   260_B     R   260_B     74  100  281     77  101  116  128  134  151  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     E   261_B     E   261_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     V   262_B     V   262_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     G   263_B     G   263_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     H   264_B     H   264_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     Q   265_B     Q   265_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     E   266_B     E   266_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     G   267_B     G   267_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     I   268_B     I   268_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     L   269_B     L   269_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     V   270_B     V   270_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     G   271_B     G   271_B     74  100  281     77  101  116  128  134  144  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     I   272_B     I   272_B     74  100  281     77  101  116  128  134  144  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     S   273_B     S   273_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     A   274_B     A   274_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     G   275_B     G   275_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     A   276_B     A   276_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     N   277_B     N   277_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     I   278_B     I   278_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     K   279_B     K   279_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     G   280_B     G   280_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     A   281_B     A   281_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     I   282_B     I   282_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     E   283_B     E   283_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     V   284_B     V   284_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     A   285_B     A   285_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     K   286_B     K   286_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     K   287_B     K   287_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     L   288_B     L   288_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     G   289_B     G   289_B     74  100  281     77  101  116  128  134  143  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     K   290_B     K   290_B     74  100  281     77  101  116  128  134  140  171  200  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     G   291_B     G   291_B     74  100  281     75  101  116  128  134  140  162  197  219  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     K   292_B     K   292_B     74  100  281     77  101  116  128  134  145  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     Q   293_B     Q   293_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     V   294_B     V   294_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     I   295_B     I   295_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     T   296_B     T   296_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     V   297_B     V   297_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     A   298_B     A   298_B     74  100  281     77  101  116  128  134  154  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     P   299_B     P   299_B     74  100  281     77  101  116  128  134  153  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     D   300_B     D   300_B     74  100  281     23   89  114  128  134  138  163  188  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     G   301_B     G   301_B     74  100  281     75  101  116  128  134  140  183  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     G   302_B     G   302_B     74  100  281     77  101  116  128  134  140  171  201  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     D   303_B     D   303_B     74  100  281     75  101  116  128  134  140  171  196  220  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     R   304_B     R   304_B     74  100  281     67  101  116  128  134  138  163  186  205  230  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     Y   305_B     Y   305_B     74  100  281     75  101  116  128  134  138  163  186  205  227  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     L   306_B     L   306_B     74  100  281     75  101  116  128  134  138  163  186  205  227  239  246  250  257  262  267  271  273  275  276 
LCS_GDT     S   307_B     S   307_B     74  100  281     51  101  115  128  134  138  148  169  200  213  226  240  249  257  262  267  271  273  275  276 
LCS_GDT     T   308_B     T   308_B     74  100  281     10   94  111  128  134  138  147  160  189  212  223  238  248  257  262  267  271  273  275  276 
LCS_GDT     E   309_B     E   309_B     74  100  281     10   47  110  126  133  138  147  160  180  208  223  232  248  256  262  267  271  273  275  276 
LCS_GDT     L   310_B     L   310_B     74  100  281     10   94  114  128  134  138  156  185  205  216  232  242  250  257  262  267  271  273  275  276 
LCS_GDT     F   311_B     F   311_B     74  100  281     29  101  116  128  134  138  160  187  205  224  238  246  250  257  262  267  271  273  275  276 
LCS_GDT     N   312_B     N   312_B     74  100  281      7   47  110  123  134  138  147  165  189  211  223  235  248  257  262  267  271  273  275  276 
LCS_GDT     Y   313_B     Y   313_B     74   94  281      4    6   29   49   89  138  146  160  180  201  220  235  248  257  262  267  271  273  275  276 
LCS_AVERAGE  LCS_A:  50.92  (  19.92   32.85  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    116    128    134    154    183    201    220    230    239    246    250    257    262    267    271    273    275    276 
GDT PERCENT_AT  27.40  35.94  41.28  45.55  47.69  54.80  65.12  71.53  78.29  81.85  85.05  87.54  88.97  91.46  93.24  95.02  96.44  97.15  97.86  98.22
GDT RMS_LOCAL    0.28   3.18   0.67   0.86   1.01   2.05   2.31   2.48   2.70   2.86   3.00   3.14   3.24   3.41   3.60   3.70   3.84   3.89   3.98   4.02
GDT RMS_ALL_AT   7.01   7.03   6.66   6.81   6.60   4.51   4.48   4.47   4.46   4.44   4.44   4.43   4.44   4.41   4.39   4.39   4.38   4.38   4.38   4.38

# Checking swapping
#   possible swapping detected:  D    33_B      D    33_B
#   possible swapping detected:  F    43_B      F    43_B
#   possible swapping detected:  E    61_B      E    61_B
#   possible swapping detected:  E    76_B      E    76_B
#   possible swapping detected:  Y    95_B      Y    95_B
#   possible swapping detected:  E   103_B      E   103_B
#   possible swapping detected:  E   108_B      E   108_B
#   possible swapping detected:  E   119_B      E   119_B
#   possible swapping detected:  F   151_B      F   151_B
#   possible swapping detected:  E   161_B      E   161_B
#   possible swapping detected:  E   170_B      E   170_B
#   possible swapping detected:  F   172_B      F   172_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   266_B      E   266_B
#   possible swapping detected:  D   300_B      D   300_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     1.059     0    0.031   1.123     7.854   53.929   41.048
LGA    H     7_B      H     7_B     7.546     0    0.587   1.266    11.933   12.619    5.143
LGA    T     8_B      T     8_B     6.340     0    0.023   0.084     6.679   16.190   19.116
LGA    K     9_B      K     9_B     6.699     4    0.134   0.138     7.246   16.310    8.360
LGA    I    10_B      I    10_B     5.515     0    0.048   0.594     8.044   21.548   18.869
LGA    T    11_B      T    11_B     4.346     0    0.039   0.087     4.633   35.714   38.095
LGA    N    12_B      N    12_B     4.130     0    0.027   1.117     6.797   41.905   33.095
LGA    S    13_B      S    13_B     2.843     0    0.055   0.077     3.358   57.262   58.492
LGA    I    14_B      I    14_B     1.603     0    0.036   0.095     2.045   72.976   77.262
LGA    V    15_B      V    15_B     0.948     0    0.099   0.335     1.962   79.405   79.116
LGA    N    16_B      N    16_B     2.684     0    0.031   0.094     3.767   57.262   52.798
LGA    L    17_B      L    17_B     3.004     0    0.108   1.210     4.895   53.571   50.357
LGA    I    18_B      I    18_B     2.801     0    0.070   0.117     3.379   53.571   61.310
LGA    G    19_B      G    19_B     4.515     0    0.688   0.688     4.874   35.833   35.833
LGA    N    20_B      N    20_B     4.372     0    0.103   0.227     5.183   40.476   37.500
LGA    T    21_B      T    21_B     3.754     0    0.030   0.107     4.359   43.452   41.633
LGA    P    22_B      P    22_B     2.477     0    0.033   0.059     2.908   62.857   62.585
LGA    I    23_B      I    23_B     1.800     0    0.080   0.110     3.291   70.833   65.000
LGA    V    24_B      V    24_B     1.275     0    0.065   1.329     3.775   81.429   75.986
LGA    K    25_B      K    25_B     1.342     0    0.022   0.606     3.893   81.429   70.688
LGA    L    26_B      L    26_B     1.171     0    0.018   1.272     3.402   79.286   76.488
LGA    N    27_B      N    27_B     2.052     0    0.042   0.188     2.842   64.881   65.833
LGA    R    28_B      R    28_B     2.427     0    0.152   1.313     7.142   59.167   50.260
LGA    V    29_B      V    29_B     2.490     0    0.020   0.044     2.748   60.952   63.741
LGA    V    30_B      V    30_B     2.527     0    0.034   0.280     2.852   59.048   59.320
LGA    P    31_B      P    31_B     3.205     0    0.021   0.073     3.327   51.786   52.041
LGA    E    32_B      E    32_B     3.546     4    0.048   0.068     3.845   45.000   24.815
LGA    D    33_B      D    33_B     4.275     0    0.057   0.552     5.658   37.143   33.750
LGA    A    34_B      A    34_B     3.447     0    0.030   0.035     3.664   46.667   47.333
LGA    A    35_B      A    35_B     3.053     0    0.037   0.051     3.249   55.476   55.810
LGA    D    36_B      D    36_B     2.369     0    0.035   0.136     3.674   66.905   58.512
LGA    V    37_B      V    37_B     1.250     0    0.055   1.367     3.138   79.286   73.333
LGA    Y    38_B      Y    38_B     1.258     0    0.024   0.259     3.756   83.690   66.230
LGA    V    39_B      V    39_B     1.102     0    0.039   1.330     2.657   81.429   75.782
LGA    K    40_B      K    40_B     2.040     0    0.013   0.103     4.226   66.786   57.037
LGA    L    41_B      L    41_B     2.236     0    0.085   1.259     3.328   59.167   60.179
LGA    E    42_B      E    42_B     2.962     0    0.119   1.215     6.833   53.571   45.608
LGA    F    43_B      F    43_B     3.843     0    0.067   0.422     4.748   40.476   42.641
LGA    F    44_B      F    44_B     4.808     0    0.226   0.673     6.820   25.833   32.554
LGA    N    45_B      N    45_B     4.919     0    0.096   1.017     5.743   34.405   32.381
LGA    P    46_B      P    46_B     6.547     0    0.034   0.265     8.411   19.524   13.946
LGA    G    47_B      G    47_B     2.542     0    0.198   0.198     5.063   47.619   47.619
LGA    G    48_B      G    48_B     3.716     0    0.022   0.022     5.176   42.500   42.500
LGA    S    49_B      S    49_B     3.201     0    0.054   0.055     3.294   50.000   50.000
LGA    I    50_B      I    50_B     3.197     0    0.174   1.158     5.177   55.476   53.452
LGA    K    51_B      K    51_B     3.238     2    0.197   0.805     3.634   51.786   40.582
LGA    D    52_B      D    52_B     2.660     0    0.053   0.295     4.475   65.000   54.345
LGA    R    53_B      R    53_B     0.595     0    0.111   0.915     7.079   83.690   56.147
LGA    I    54_B      I    54_B     1.979     0    0.119   1.295     5.147   68.810   57.798
LGA    A    55_B      A    55_B     2.488     0    0.041   0.052     2.970   64.762   63.238
LGA    L    56_B      L    56_B     1.425     0    0.020   0.138     1.713   81.548   81.488
LGA    A    57_B      A    57_B     1.203     0    0.072   0.074     1.305   81.429   81.429
LGA    M    58_B      M    58_B     1.589     0    0.070   0.256     2.380   72.857   69.821
LGA    I    59_B      I    59_B     1.358     0    0.014   0.145     2.068   81.429   78.274
LGA    E    60_B      E    60_B     1.389     0    0.043   0.212     1.390   81.429   81.429
LGA    E    61_B      E    61_B     1.384     0    0.034   1.311     4.246   81.429   65.132
LGA    A    62_B      A    62_B     1.364     0    0.030   0.036     1.422   81.429   81.429
LGA    E    63_B      E    63_B     1.458     0    0.077   0.314     1.905   81.429   76.667
LGA    K    64_B      K    64_B     1.596     4    0.074   0.083     1.596   75.000   41.429
LGA    A    65_B      A    65_B     1.573     0    0.084   0.093     1.771   75.000   74.571
LGA    G    66_B      G    66_B     1.652     0    0.184   0.184     1.673   75.000   75.000
LGA    K    67_B      K    67_B     1.465     4    0.050   0.085     1.552   79.286   43.333
LGA    L    68_B      L    68_B     1.521     0    0.061   0.151     2.133   72.976   77.202
LGA    Q    69_B      Q    69_B     2.554     4    0.045   0.071     3.180   62.857   33.492
LGA    A    70_B      A    70_B     2.498     0    0.042   0.057     2.884   59.048   58.667
LGA    G    71_B      G    71_B     2.325     0    0.075   0.075     2.525   62.857   62.857
LGA    G    72_B      G    72_B     2.011     0    0.035   0.035     2.090   68.810   68.810
LGA    T    73_B      T    73_B     1.821     0    0.039   0.075     2.235   72.857   71.701
LGA    I    74_B      I    74_B     1.267     0    0.045   0.135     1.602   77.143   81.548
LGA    V    75_B      V    75_B     1.609     0    0.017   0.104     2.370   79.286   75.374
LGA    E    76_B      E    76_B     1.546     0    0.051   0.202     2.210   68.810   75.820
LGA    P    77_B      P    77_B     2.777     0    0.160   0.165     3.105   59.048   57.279
LGA    T    78_B      T    78_B     2.975     0    0.149   0.381     3.457   53.571   56.190
LGA    S    79_B      S    79_B     3.765     0    0.649   0.576     5.899   52.024   42.619
LGA    G    80_B      G    80_B     2.190     0    0.448   0.448     2.527   62.857   62.857
LGA    N    81_B      N    81_B     2.511     3    0.144   0.156     3.197   62.857   37.679
LGA    T    82_B      T    82_B     2.733     0    0.104   0.157     3.504   60.952   55.306
LGA    G    83_B      G    83_B     1.591     0    0.035   0.035     1.895   75.000   75.000
LGA    V    84_B      V    84_B     1.896     0    0.042   1.327     4.789   72.857   67.007
LGA    G    85_B      G    85_B     2.361     0    0.038   0.038     2.361   64.762   64.762
LGA    L    86_B      L    86_B     1.857     0    0.040   0.557     1.940   72.857   78.333
LGA    A    87_B      A    87_B     1.227     0    0.046   0.046     1.459   81.429   81.429
LGA    M    88_B      M    88_B     1.923     0    0.064   0.969     2.800   68.810   66.845
LGA    V    89_B      V    89_B     2.570     0    0.058   1.329     5.139   60.952   57.143
LGA    A    90_B      A    90_B     1.831     0    0.052   0.052     2.274   70.833   72.952
LGA    A    91_B      A    91_B     1.620     0    0.009   0.022     2.331   68.810   71.333
LGA    A    92_B      A    92_B     2.832     0    0.103   0.100     3.044   57.262   55.810
LGA    K    93_B      K    93_B     3.003     0    0.049   0.675     3.265   53.571   59.101
LGA    G    94_B      G    94_B     2.656     0    0.089   0.089     2.656   60.952   60.952
LGA    Y    95_B      Y    95_B     1.646     0    0.098   0.166     1.895   72.857   73.571
LGA    H    96_B      H    96_B     1.449     0    0.053   1.015     2.843   79.286   70.667
LGA    L    97_B      L    97_B     1.140     0    0.039   0.119     1.393   81.429   85.952
LGA    V    98_B      V    98_B     1.876     0    0.023   1.332     4.596   72.857   67.007
LGA    I    99_B      I    99_B     1.975     0    0.031   0.683     2.777   65.000   67.976
LGA    T   100_B      T   100_B     3.279     0    0.036   0.086     3.488   51.786   51.020
LGA    M   101_B      M   101_B     4.210     0    0.031   0.653     5.019   34.524   36.607
LGA    P   102_B      P   102_B     5.678     0    0.016   0.269     5.993   23.810   24.150
LGA    E   103_B      E   103_B     6.216     0    0.029   0.214     7.946   16.190   12.804
LGA    T   104_B      T   104_B     6.851     0    0.025   0.035     7.871   13.333   11.497
LGA    M   105_B      M   105_B     5.961     0    0.105   1.182     6.135   19.286   29.702
LGA    S   106_B      S   106_B     5.646     0    0.410   0.687     7.069   25.119   20.635
LGA    V   107_B      V   107_B     5.217     0    0.650   1.324     7.274   27.619   24.762
LGA    E   108_B      E   108_B     5.985     0    0.040   1.350     8.638   25.357   15.503
LGA    R   109_B      R   109_B     3.595     4    0.060   0.633     4.431   50.595   32.684
LGA    R   110_B      R   110_B     2.648     0    0.099   1.154     6.365   59.048   44.545
LGA    K   111_B      K   111_B     2.990     0    0.071   0.744     3.725   59.048   54.127
LGA    L   112_B      L   112_B     2.391     0    0.087   1.228     4.273   66.905   56.131
LGA    M   113_B      M   113_B     1.526     0    0.019   0.193     2.167   77.143   73.988
LGA    Q   114_B      Q   114_B     1.520     0    0.051   0.177     3.187   77.143   67.037
LGA    G   115_B      G   115_B     1.223     0    0.047   0.047     1.431   85.952   85.952
LGA    Y   116_B      Y   116_B     0.645     0    0.074   0.152     2.353   90.476   80.278
LGA    G   117_B      G   117_B     0.782     0    0.065   0.065     1.484   85.952   85.952
LGA    A   118_B      A   118_B     1.076     0    0.027   0.025     1.857   79.405   81.619
LGA    E   119_B      E   119_B     2.448     0    0.053   0.615     4.391   62.976   54.392
LGA    L   120_B      L   120_B     2.862     0    0.038   1.214     3.728   51.905   51.131
LGA    I   121_B      I   121_B     4.006     1    0.019   0.083     4.390   40.238   34.048
LGA    L   122_B      L   122_B     5.020     0    0.039   1.266     6.425   26.310   27.143
LGA    T   123_B      T   123_B     5.964     0    0.040   0.075     6.457   19.286   20.204
LGA    P   124_B      P   124_B     7.559     0    0.031   0.095     8.147    8.571    8.027
LGA    G   125_B      G   125_B     8.068     0    0.063   0.063     8.516    4.881    4.881
LGA    A   126_B      A   126_B     9.542     0    0.039   0.043    10.140    1.905    1.524
LGA    D   127_B      D   127_B     7.475     0    0.052   0.402     8.454    9.524    8.750
LGA    G   128_B      G   128_B     7.007     0    0.050   0.050     7.233   13.571   13.571
LGA    M   129_B      M   129_B     5.620     0    0.060   0.520     6.271   22.738   24.643
LGA    K   130_B      K   130_B     5.744     4    0.065   0.106     6.018   22.619   11.958
LGA    G   131_B      G   131_B     5.920     0    0.031   0.031     5.990   23.810   23.810
LGA    A   132_B      A   132_B     4.450     0    0.040   0.048     5.076   35.952   36.190
LGA    I   133_B      I   133_B     3.694     0    0.100   0.179     4.199   43.452   43.452
LGA    A   134_B      A   134_B     4.488     0    0.045   0.050     5.031   37.143   34.952
LGA    K   135_B      K   135_B     4.404     0    0.027   0.669     5.119   38.690   36.138
LGA    A   136_B      A   136_B     3.136     0    0.051   0.058     3.626   50.119   51.524
LGA    E   137_B      E   137_B     3.036     2    0.094   0.142     3.387   50.000   40.476
LGA    E   138_B      E   138_B     4.033     0    0.024   0.761     7.100   40.238   30.000
LGA    L   139_B      L   139_B     3.442     0    0.051   1.234     5.682   48.333   45.655
LGA    V   140_B      V   140_B     2.934     0    0.144   1.338     4.794   51.786   53.878
LGA    K   141_B      K   141_B     3.630     4    0.032   0.074     4.026   43.452   24.127
LGA    E   142_B      E   142_B     4.039     4    0.031   0.082     4.215   41.786   22.698
LGA    K   143_B      K   143_B     3.612     4    0.048   0.067     3.774   46.667   26.296
LGA    G   144_B      G   144_B     3.305     0    0.022   0.022     3.414   51.786   51.786
LGA    Y   145_B      Y   145_B     2.439     0    0.021   0.076     2.854   62.857   60.952
LGA    F   146_B      F   146_B     1.553     0    0.036   0.108     1.792   77.143   81.558
LGA    M   147_B      M   147_B     1.232     0    0.027   0.143     2.032   81.429   77.202
LGA    P   148_B      P   148_B     0.898     0    0.633   0.713     2.875   79.881   83.129
LGA    M   149_B      M   149_B     2.700     3    0.305   0.339     2.948   67.143   40.714
LGA    Q   150_B      Q   150_B     3.318     4    0.672   0.621     5.200   48.571   24.497
LGA    F   151_B      F   151_B     2.717     0    0.128   1.227    11.394   66.905   29.394
LGA    D   152_B      D   152_B     4.166     3    0.104   0.128     6.015   35.476   19.881
LGA    N   153_B      N   153_B     7.321     3    0.094   0.120     8.442   14.643    7.917
LGA    P   154_B      P   154_B     8.053     0    0.247   0.262    10.452    3.452    2.585
LGA    A   155_B      A   155_B    12.629     0    0.583   0.578    14.477    0.000    0.000
LGA    H   160_B      H   160_B    12.308     5    0.642   0.619    13.159    0.000    0.000
LGA    E   161_B      E   161_B     8.578     0    0.085   0.782     9.740    5.119    6.614
LGA    E   162_B      E   162_B     7.073     0    0.234   0.281     7.631   11.071   13.228
LGA    T   163_B      T   163_B     8.726     0    0.138   1.182    10.355    2.976    2.925
LGA    T   164_B      T   164_B     9.653     0    0.047   0.151    10.553    1.548    0.884
LGA    G   165_B      G   165_B     7.500     0    0.074   0.074     8.129    7.976    7.976
LGA    K   166_B      K   166_B     6.983     4    0.083   0.090     7.634    9.405    5.661
LGA    E   167_B      E   167_B     9.233     0    0.070   0.885     9.979    1.786    1.693
LGA    I   168_B      I   168_B     9.412     0    0.041   0.101    10.101    1.548    1.131
LGA    L   169_B      L   169_B     7.769     0    0.050   0.416     8.795    4.881   12.381
LGA    E   170_B      E   170_B     9.487     0    0.025   0.956    13.129    1.071    0.688
LGA    A   171_B      A   171_B    11.302     0    0.095   0.100    12.124    0.000    0.000
LGA    F   172_B      F   172_B    10.204     0    0.081   0.153    10.408    0.000    0.736
LGA    G   173_B      G   173_B    11.013     0    0.661   0.661    11.013    0.119    0.119
LGA    D   174_B      D   174_B    11.607     0    0.142   0.240    14.756    0.000    0.000
LGA    D   175_B      D   175_B     9.623     0    0.242   0.430    10.428    2.024    1.548
LGA    I   176_B      I   176_B     5.581     0    0.121   0.599     7.294   23.095   23.393
LGA    P   177_B      P   177_B     3.360     0    0.081   0.422     4.200   46.786   46.395
LGA    D   178_B      D   178_B     2.891     0    0.019   0.164     4.548   59.167   50.595
LGA    A   179_B      A   179_B     1.910     0    0.034   0.034     2.230   70.833   71.238
LGA    F   180_B      F   180_B     1.603     0    0.015   0.157     2.249   77.143   72.208
LGA    V   181_B      V   181_B     1.031     0    0.022   1.332     2.873   81.429   76.871
LGA    A   182_B      A   182_B     1.488     0    0.051   0.073     1.839   77.143   76.286
LGA    G   183_B      G   183_B     1.543     0    0.043   0.043     1.553   77.143   77.143
LGA    V   184_B      V   184_B     1.792     0    0.161   0.665     3.829   68.810   67.551
LGA    G   185_B      G   185_B     2.696     0    0.097   0.097     4.139   50.595   50.595
LGA    T   186_B      T   186_B     5.220     0    0.062   0.119     6.715   27.738   23.265
LGA    G   187_B      G   187_B     3.583     0    0.034   0.034     4.012   43.452   43.452
LGA    G   188_B      G   188_B     4.822     0    0.093   0.093     4.822   34.286   34.286
LGA    T   189_B      T   189_B     4.082     0    0.036   0.133     4.958   41.905   38.231
LGA    L   190_B      L   190_B     2.260     0    0.021   0.170     2.727   62.857   66.845
LGA    T   191_B      T   191_B     2.477     0    0.021   0.127     3.272   60.952   58.299
LGA    G   192_B      G   192_B     3.335     0    0.025   0.025     3.335   50.000   50.000
LGA    V   193_B      V   193_B     3.128     0    0.066   1.336     5.408   53.571   50.748
LGA    G   194_B      G   194_B     2.224     0    0.055   0.055     2.463   64.762   64.762
LGA    H   195_B      H   195_B     2.638     0    0.050   0.355     2.910   59.048   60.190
LGA    A   196_B      A   196_B     3.511     0    0.012   0.026     3.861   46.667   46.000
LGA    L   197_B      L   197_B     3.157     0    0.030   1.233     4.287   51.786   48.571
LGA    K   198_B      K   198_B     2.530     0    0.067   0.757     3.321   57.143   62.540
LGA    K   199_B      K   199_B     3.059     2    0.077   0.510     4.110   51.786   36.825
LGA    A   200_B      A   200_B     3.381     0    0.060   0.067     3.592   50.000   48.667
LGA    N   201_B      N   201_B     3.104     0    0.027   0.081     3.592   53.571   50.952
LGA    P   202_B      P   202_B     2.459     0    0.062   0.077     2.868   62.857   60.408
LGA    N   203_B      N   203_B     2.423     0    0.026   1.125     3.681   64.762   60.179
LGA    V   204_B      V   204_B     2.488     0    0.020   0.068     2.663   66.786   62.653
LGA    Q   205_B      Q   205_B     1.824     0    0.018   0.437     2.883   70.833   68.413
LGA    I   206_B      I   206_B     1.554     0    0.017   0.106     2.208   77.143   73.988
LGA    Y   207_B      Y   207_B     1.110     0    0.035   0.118     1.651   81.429   82.222
LGA    A   208_B      A   208_B     1.497     0    0.071   0.078     1.733   81.429   79.714
LGA    L   209_B      L   209_B     1.699     0    0.017   0.276     2.568   72.857   70.893
LGA    E   210_B      E   210_B     2.441     0    0.022   0.461     2.616   60.952   65.767
LGA    P   211_B      P   211_B     3.066     0    0.057   0.337     3.517   55.357   52.109
LGA    A   212_B      A   212_B     3.162     0    0.561   0.507     3.250   51.786   51.429
LGA    P   236_B      P   236_B    14.509     0    0.480   0.927    15.612    0.000    0.000
LGA    K   237_B      K   237_B    14.884     0    0.521   0.997    17.760    0.000    0.000
LGA    V   238_B      V   238_B    14.700     0    0.613   0.936    16.975    0.000    0.000
LGA    L   239_B      L   239_B     8.849     0    0.116   1.418    10.978    2.619    7.976
LGA    D   240_B      D   240_B     6.992     0    0.023   0.076     8.412   19.524   15.179
LGA    T   241_B      T   241_B     3.482     0    0.094   0.127     5.775   54.762   42.585
LGA    D   242_B      D   242_B     2.284     0    0.186   0.188     3.631   64.881   57.500
LGA    V   243_B      V   243_B     1.635     0    0.164   1.336     3.158   75.000   70.884
LGA    Y   244_B      Y   244_B     1.187     0    0.072   0.977     4.727   85.952   68.373
LGA    N   245_B      N   245_B     1.074     0    0.024   0.328     1.976   83.690   80.417
LGA    G   246_B      G   246_B     1.064     0    0.071   0.071     1.064   88.214   88.214
LGA    I   247_B      I   247_B     0.853     0    0.024   0.109     1.238   90.476   85.952
LGA    L   248_B      L   248_B     1.128     0    0.021   1.238     3.007   81.548   76.607
LGA    E   249_B      E   249_B     1.894     0    0.098   0.666     2.314   68.810   69.259
LGA    I   250_B      I   250_B     2.790     0    0.041   0.106     3.199   53.571   57.262
LGA    K   251_B      K   251_B     3.811     2    0.038   0.103     4.363   45.000   32.381
LGA    S   252_B      S   252_B     4.281     0    0.016   0.586     5.304   37.143   34.365
LGA    D   253_B      D   253_B     4.727     0    0.035   1.038     8.105   34.286   24.226
LGA    D   254_B      D   254_B     3.704     0    0.075   0.564     4.985   45.119   41.190
LGA    A   255_B      A   255_B     3.059     0    0.070   0.087     3.322   50.000   50.000
LGA    I   256_B      I   256_B     4.088     0    0.017   0.136     5.013   38.690   35.119
LGA    T   257_B      T   257_B     4.059     0    0.061   0.111     4.600   41.905   39.048
LGA    M   258_B      M   258_B     2.883     0    0.027   0.842     3.553   55.357   56.429
LGA    A   259_B      A   259_B     2.868     0    0.045   0.049     3.104   57.143   55.714
LGA    R   260_B      R   260_B     3.472     0    0.023   1.331     9.613   50.000   30.000
LGA    E   261_B      E   261_B     3.018     0    0.065   0.845     3.554   55.476   58.466
LGA    V   262_B      V   262_B     1.889     0    0.042   1.337     3.181   70.833   66.190
LGA    G   263_B      G   263_B     2.208     0    0.093   0.093     2.231   64.762   64.762
LGA    H   264_B      H   264_B     2.598     0    0.112   0.240     4.085   60.952   53.857
LGA    Q   265_B      Q   265_B     2.214     0    0.050   1.383     5.198   68.810   59.788
LGA    E   266_B      E   266_B     1.298     0    0.049   0.139     1.604   79.286   80.476
LGA    G   267_B      G   267_B     1.300     0    0.058   0.058     1.324   81.429   81.429
LGA    I   268_B      I   268_B     1.299     0    0.069   0.169     1.939   77.143   82.679
LGA    L   269_B      L   269_B     2.355     0    0.034   0.117     3.420   62.976   57.381
LGA    V   270_B      V   270_B     2.640     0    0.050   0.096     3.389   55.476   57.279
LGA    G   271_B      G   271_B     3.724     0    0.042   0.042     3.724   46.667   46.667
LGA    I   272_B      I   272_B     3.717     0    0.032   0.196     5.186   46.667   40.595
LGA    S   273_B      S   273_B     3.041     0    0.106   0.554     3.554   53.571   51.270
LGA    A   274_B      A   274_B     2.309     0    0.051   0.050     2.457   66.786   66.381
LGA    G   275_B      G   275_B     2.462     0    0.050   0.050     2.462   64.762   64.762
LGA    A   276_B      A   276_B     2.462     0    0.036   0.042     2.727   62.857   61.714
LGA    N   277_B      N   277_B     1.812     0    0.010   0.057     2.139   72.976   69.881
LGA    I   278_B      I   278_B     1.492     0    0.068   0.149     1.662   77.143   78.214
LGA    K   279_B      K   279_B     2.066     0    0.045   0.146     3.505   70.833   60.899
LGA    G   280_B      G   280_B     1.433     0    0.026   0.026     1.666   79.286   79.286
LGA    A   281_B      A   281_B     0.857     0    0.024   0.029     1.215   83.690   85.048
LGA    I   282_B      I   282_B     1.702     0    0.046   0.162     2.357   70.952   70.893
LGA    E   283_B      E   283_B     2.174     0    0.095   0.958     2.571   64.881   67.566
LGA    V   284_B      V   284_B     1.628     0    0.047   1.348     3.409   70.833   69.660
LGA    A   285_B      A   285_B     2.074     0    0.029   0.039     2.849   62.976   64.952
LGA    K   286_B      K   286_B     3.026     0    0.020   0.327     4.668   50.119   48.783
LGA    K   287_B      K   287_B     3.182     2    0.062   0.162     3.678   48.333   40.529
LGA    L   288_B      L   288_B     3.267     0    0.024   1.242     4.369   45.119   47.738
LGA    G   289_B      G   289_B     4.026     0    0.026   0.026     4.141   40.238   40.238
LGA    K   290_B      K   290_B     4.457     2    0.027   0.523     4.898   34.286   27.778
LGA    G   291_B      G   291_B     4.667     0    0.106   0.106     4.667   35.714   35.714
LGA    K   292_B      K   292_B     3.723     0    0.026   0.515     4.989   45.119   41.429
LGA    Q   293_B      Q   293_B     2.831     0    0.056   0.643     5.692   57.262   42.169
LGA    V   294_B      V   294_B     1.659     0    0.033   1.344     3.407   75.000   70.884
LGA    I   295_B      I   295_B     1.559     0    0.042   1.343     4.391   77.143   69.583
LGA    T   296_B      T   296_B     1.234     0    0.037   0.153     1.430   81.429   82.721
LGA    V   297_B      V   297_B     1.955     0    0.052   0.088     2.272   68.810   67.075
LGA    A   298_B      A   298_B     2.322     0    0.046   0.051     2.934   60.952   61.714
LGA    P   299_B      P   299_B     3.278     0    0.092   0.271     4.496   46.905   50.272
LGA    D   300_B      D   300_B     4.784     0    0.134   0.237     6.800   38.810   30.357
LGA    G   301_B      G   301_B     3.881     0    0.037   0.037     4.430   38.690   38.690
LGA    G   302_B      G   302_B     4.235     0    0.117   0.117     4.751   35.833   35.833
LGA    D   303_B      D   303_B     4.699     0    0.190   1.128     5.969   27.619   32.440
LGA    R   304_B      R   304_B     5.461     6    0.122   0.130     6.003   22.738   10.216
LGA    Y   305_B      Y   305_B     5.631     0    0.041   0.158     5.789   22.619   25.000
LGA    L   306_B      L   306_B     5.808     0    0.041   1.255     7.454   19.286   20.893
LGA    S   307_B      S   307_B     7.228     0    0.134   0.663     8.352    8.810    8.254
LGA    T   308_B      T   308_B     7.545     0    0.047   0.190     7.545    9.286    9.592
LGA    E   309_B      E   309_B     7.772     3    0.108   0.686     9.416    8.571    4.286
LGA    L   310_B      L   310_B     6.013     0    0.085   0.133     6.738   18.333   22.976
LGA    F   311_B      F   311_B     5.498     0    0.323   0.464     5.729   23.810   29.740
LGA    N   312_B      N   312_B     7.322     0    0.538   1.154    12.587   11.667    6.012
LGA    Y   313_B      Y   313_B     6.978     0    0.068   0.232     7.981   10.119   18.889

# 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):     4.372          4.343                  4.587           51.178   47.988

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  313  281    4.0    201    2.48    62.011    56.502     7.783

LGA_LOCAL      RMSD:   2.482  Number of atoms:  201  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   4.471  Number of assigned atoms:  281 
Std_ASGN_ATOMS RMSD:   4.372  Standard rmsd on all 281 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.121161 * X  +   0.903908 * Y  +   0.410208 * Z  +   8.692442
  Y_new =  -0.966396 * X  +   0.201800 * Y  +  -0.159233 * Z  +   8.621114
  Z_new =  -0.226712 * X  +  -0.377130 * Y  +   0.897984 * Z  +  23.769651 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -1.446073  0.228700 -0.397606   [DEG:  -82.8539   13.1036  -22.7812 ]
ZXZ:  1.200523  0.455631 -2.600328   [DEG:   68.7849   26.1057 -148.9878 ]
 
# END of job
