
#######################################################
#                                                     #
#                        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  305 ( 2252),  selected  278 , name one
# Molecule2: number of CA atoms  281 ( 1997),  selected  278 , 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:   278       9_B - 313_B       4.20     4.20
  LCS_AVERAGE:     98.93

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   111      37_B - 147_B       1.99     4.78
  LONGEST_CONTINUOUS_SEGMENT:   111      38_B - 148_B       2.00     4.85
  LCS_AVERAGE:     29.11

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    70     244_B - 313_B       0.97     6.37
  LCS_AVERAGE:     13.95

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  278
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     K     9_B     K     9_B     12   16  278     20   52   77  109  143  185  211  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     I    10_B     I    10_B     12   34  278      7   32   77  109  142  185  211  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     T    11_B     T    11_B     12   34  278      7   23   77  109  159  190  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     N    12_B     N    12_B     12   90  278      7   11   33   99  139  185  211  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     S    13_B     S    13_B     12   90  278      7   11   81  128  164  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     I    14_B     I    14_B     12   90  278     14   55   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     V    15_B     V    15_B     12   90  278      7   55   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     N    16_B     N    16_B     12   90  278     12   49   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     L    17_B     L    17_B     27   90  278      9   45   86  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     I    18_B     I    18_B     29   90  278     18   80  109  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G    19_B     G    19_B     29   90  278      5   57  115  122  129  172  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     N    20_B     N    20_B     29   90  278     47   94  115  122  131  168  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     T    21_B     T    21_B     29  102  278     37   92  115  122  133  191  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     P    22_B     P    22_B     29  102  278     47   94  115  122  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     I    23_B     I    23_B     29  102  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     V    24_B     V    24_B     29  102  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     K    25_B     K    25_B     29  102  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     L    26_B     L    26_B     29  102  278     47   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     N    27_B     N    27_B     29  102  278     48   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     R    28_B     R    28_B     29  102  278     47   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     V    29_B     V    29_B     29  102  278     47   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     V    30_B     V    30_B     29  102  278     48   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     P    31_B     P    31_B     29  102  278     22   88  115  126  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     E    32_B     E    32_B     29  102  278     47   94  115  122  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     D    33_B     D    33_B     29  102  278     51   94  115  122  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     A    34_B     A    34_B     29  102  278     51   94  115  124  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     A    35_B     A    35_B     29  102  278     51   94  115  124  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     D    36_B     D    36_B     29  102  278     48   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     V    37_B     V    37_B     29  111  278     48   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     Y    38_B     Y    38_B     29  111  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     V    39_B     V    39_B     29  111  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     K    40_B     K    40_B     29  111  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     L    41_B     L    41_B     29  111  278     48   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     E    42_B     E    42_B     29  111  278     51   94  115  126  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     F    43_B     F    43_B     29  111  278     43   94  115  122  145  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     F    44_B     F    44_B     29  111  278     15   49  112  122  129  156  209  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     N    45_B     N    45_B     29  111  278     25   71  112  122  129  164  209  225  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     P    46_B     P    46_B     29  111  278      4   29   86  122  128  133  167  212  232  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G    47_B     G    47_B     28  111  278      6   30   81  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G    48_B     G    48_B     28  111  278      4    6    8   66  142  181  207  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     S    49_B     S    49_B     28  111  278      4   18   47   83  152  192  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     I    50_B     I    50_B     28  111  278      4   18   40   79  148  182  211  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     K    51_B     K    51_B     28  111  278      7   17   50   80  148  192  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     D    52_B     D    52_B     28  111  278      4   38   74  130  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     R    53_B     R    53_B     28  111  278      8   41   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     I    54_B     I    54_B     28  111  278      9   22   58  121  164  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     A    55_B     A    55_B     28  111  278      9   22   59  128  164  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     L    56_B     L    56_B     28  111  278      9   47   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     A    57_B     A    57_B     28  111  278      9   34   81  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     M    58_B     M    58_B     28  111  278      9   22   65  128  164  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     I    59_B     I    59_B     43  111  278      9   41   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     E    60_B     E    60_B     43  111  278      9   41   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     E    61_B     E    61_B     43  111  278      9   34   81  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     A    62_B     A    62_B     43  111  278      9   41   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     E    63_B     E    63_B     43  111  278      9   41   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     K    64_B     K    64_B     43  111  278      9   32   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     A    65_B     A    65_B     43  111  278      8   41   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G    66_B     G    66_B     43  111  278      7   46   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     K    67_B     K    67_B     43  111  278      5   55   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     L    68_B     L    68_B     43  111  278      8   55   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     Q    69_B     Q    69_B     43  111  278     13   55   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     A    70_B     A    70_B     43  111  278     14   55   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G    71_B     G    71_B     43  111  278      9   46   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G    72_B     G    72_B     43  111  278     21   55   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     T    73_B     T    73_B     43  111  278     22   55   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     I    74_B     I    74_B     43  111  278     23   55   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     V    75_B     V    75_B     43  111  278     23   55   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     E    76_B     E    76_B     43  111  278     23   55   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     P    77_B     P    77_B     43  111  278     23   52   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     T    78_B     T    78_B     43  111  278     22   52   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     S    79_B     S    79_B     43  111  278     21   52   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G    80_B     G    80_B     43  111  278     21   52   96  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     N    81_B     N    81_B     43  111  278     21   67  103  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     T    82_B     T    82_B     43  111  278     21   52  100  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G    83_B     G    83_B     43  111  278     20   55   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     V    84_B     V    84_B     43  111  278     22   52   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G    85_B     G    85_B     43  111  278     21   55   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     L    86_B     L    86_B     43  111  278     21   55   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     A    87_B     A    87_B     43  111  278     21   55   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     M    88_B     M    88_B     43  111  278     21   55   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     V    89_B     V    89_B     43  111  278     22   55   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     A    90_B     A    90_B     43  111  278     22   55   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     A    91_B     A    91_B     43  111  278     22   55   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     A    92_B     A    92_B     43  111  278     22   52   89  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     K    93_B     K    93_B     43  111  278     22   55   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G    94_B     G    94_B     43  111  278     22   55   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     Y    95_B     Y    95_B     43  111  278     20   55   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     H    96_B     H    96_B     43  111  278     22   55   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     L    97_B     L    97_B     43  111  278     22   55   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     V    98_B     V    98_B     43  111  278     23   55   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     I    99_B     I    99_B     43  111  278     23   52   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     T   100_B     T   100_B     43  111  278     23   52   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     M   101_B     M   101_B     43  111  278     17   50   77  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     P   102_B     P   102_B     42  111  278     17   42   71  106  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     E   103_B     E   103_B     42  111  278     23   49   71  106  154  192  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     T   104_B     T   104_B     40  111  278     12   42   65   85  113  160  210  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     M   105_B     M   105_B     17  111  278      4    5   19   71  125  170  211  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     S   106_B     S   106_B     18  111  278      4    4    5   44  109  165  199  228  233  239  243  251  251  255  262  264  267  269  270  272 
LCS_GDT     V   107_B     V   107_B     18  111  278      3   18   49   91  147  180  211  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     E   108_B     E   108_B     22  111  278      5   22   64  119  162  192  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     R   109_B     R   109_B     39  111  278      9   36   74  130  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     R   110_B     R   110_B     39  111  278      8   34   74  130  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     K   111_B     K   111_B     39  111  278      9   36   79  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     L   112_B     L   112_B     39  111  278     20   43   84  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     M   113_B     M   113_B     39  111  278     20   49   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     Q   114_B     Q   114_B     39  111  278     20   55   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G   115_B     G   115_B     39  111  278     20   50   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     Y   116_B     Y   116_B     39  111  278     22   55   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G   117_B     G   117_B     39  111  278     23   55   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     A   118_B     A   118_B     39  111  278     22   55   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     E   119_B     E   119_B     39  111  278     23   52   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     L   120_B     L   120_B     39  111  278     23   52   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     I   121_B     I   121_B     39  111  278     22   52   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     L   122_B     L   122_B     39  111  278     20   50   77  131  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     T   123_B     T   123_B     39  111  278     23   50   72  112  158  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     P   124_B     P   124_B     39  111  278     12   42   68   94  120  172  210  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G   125_B     G   125_B     39  111  278     10   42   53   82  107  134  192  227  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     A   126_B     A   126_B     39  111  278      5   24   46   66   87  114  150  165  210  237  240  246  250  253  262  264  267  269  270  272 
LCS_GDT     D   127_B     D   127_B     39  111  278     14   42   67   93  120  159  210  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G   128_B     G   128_B     39  111  278     20   42   68   89  120  178  211  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     M   129_B     M   129_B     39  111  278     22   42   71  101  164  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     K   130_B     K   130_B     39  111  278     23   43   71  106  158  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G   131_B     G   131_B     39  111  278     23   49   71  106  154  192  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     A   132_B     A   132_B     39  111  278     23   52   77  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     I   133_B     I   133_B     39  111  278     23   52   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     A   134_B     A   134_B     39  111  278     23   52   81  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     K   135_B     K   135_B     39  111  278     23   52   81  130  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     A   136_B     A   136_B     39  111  278     23   52   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     E   137_B     E   137_B     39  111  278     23   52   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     E   138_B     E   138_B     39  111  278     23   52   81  130  164  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     L   139_B     L   139_B     39  111  278     19   52   81  128  164  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     V   140_B     V   140_B     39  111  278     19   52   81  128  164  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     K   141_B     K   141_B     39  111  278     23   52   81  128  164  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     E   142_B     E   142_B     39  111  278     13   52   81  128  164  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     K   143_B     K   143_B     39  111  278     17   52   81  128  164  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G   144_B     G   144_B     39  111  278     15   52   81  128  164  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     Y   145_B     Y   145_B     39  111  278     22   52   90  130  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     F   146_B     F   146_B     39  111  278     20   52   92  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     M   147_B     M   147_B     39  111  278     23   55   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     P   148_B     P   148_B     36  111  278      3    6   24   72  106  170  201  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     M   149_B     M   149_B      4  105  278      3    6   10   20   42   65  109  166  214  229  241  245  250  253  258  264  267  269  270  272 
LCS_GDT     Q   150_B     Q   150_B      4   99  278      3    4    6   11   22   40   46   54   80  134  183  199  229  245  253  257  264  268  270  272 
LCS_GDT     F   151_B     F   151_B      4    8  278      3    4    4    6    7   21   23   38   43   50   66   72   81   89  117  183  210  252  259  262 
LCS_GDT     D   152_B     D   152_B      4    8  278      3    4    6    6    8   11   20   33   55   61   84   90  100  117  129  144  210  221  233  262 
LCS_GDT     N   153_B     N   153_B      4    8  278      3    4    6    6    8    9   15   22   44   75   84   90  114  179  190  220  232  252  268  271 
LCS_GDT     P   154_B     P   154_B      4    8  278      3    4    6    6   28   32   49   63   80  128  140  179  222  230  240  254  259  266  269  272 
LCS_GDT     A   155_B     A   155_B      3    8  278      3    3    5    6   31   77  116  140  166  185  222  239  246  252  262  264  267  269  270  272 
LCS_GDT     H   160_B     H   160_B      3   14  278      0    3    6    6    8   12   22   23   26   31   77   94  204  251  254  257  265  269  270  272 
LCS_GDT     E   161_B     E   161_B      3   18  278      1    3    8   11   13   13   26   46   61   97  230  241  248  253  262  264  267  269  270  272 
LCS_GDT     E   162_B     E   162_B     12   18  278      3    4   10   14   15   19   22   27   39  116  213  234  248  253  262  264  267  269  270  272 
LCS_GDT     T   163_B     T   163_B     12   18  278      8   11   12   14   17   22   31   91  102  139  213  235  248  255  262  264  267  269  270  272 
LCS_GDT     T   164_B     T   164_B     12   18  278      8   11   12   14   17   37   47   69   96  108  142  192  217  248  262  264  267  269  270  272 
LCS_GDT     G   165_B     G   165_B     12   18  278      8   11   12   14   17   61   72   97  148  209  234  251  251  255  262  264  267  269  270  272 
LCS_GDT     K   166_B     K   166_B     12   18  278      8   11   12   19   43   67  133  178  219  237  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     E   167_B     E   167_B     12   18  278      8   11   15   33   49   63  100  138  150  171  207  235  245  255  262  264  267  269  270  272 
LCS_GDT     I   168_B     I   168_B     12   18  278      8   11   12   16   47   60   83  134  148  157  188  217  245  255  262  264  267  269  270  272 
LCS_GDT     L   169_B     L   169_B     12   18  278      8   13   36   88  126  133  137  147  166  209  234  251  251  255  262  264  267  269  270  272 
LCS_GDT     E   170_B     E   170_B     12   18  278      8   13   32   48   96  131  136  142  150  163  191  217  243  255  262  264  267  269  270  272 
LCS_GDT     A   171_B     A   171_B     12   18  278      7   11   15   33   51   65   91  122  135  150  160  174  192  220  252  262  267  269  270  272 
LCS_GDT     F   172_B     F   172_B     12   41  278      5   11   17   39   53   83  113  137  147  157  172  205  243  253  262  264  267  269  270  272 
LCS_GDT     G   173_B     G   173_B     12   41  278      4   11   13   31   51   79  113  133  138  144  154  165  188  243  254  262  267  269  270  272 
LCS_GDT     D   174_B     D   174_B      3   41  278      3    5   12   30   51   69  113  123  138  144  154  163  183  206  252  260  265  269  270  272 
LCS_GDT     D   175_B     D   175_B      3   41  278      3   10   17   41   56   83  125  133  145  150  163  205  235  252  262  264  267  269  270  272 
LCS_GDT     I   176_B     I   176_B      3   41  278      2    3   49   82  128  133  139  168  219  238  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     P   177_B     P   177_B      4   41  278      0   10   12   41   55   99  129  141  208  234  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     D   178_B     D   178_B      7   41  278     17   87  115  122  149  191  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     A   179_B     A   179_B      7   41  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     F   180_B     F   180_B      7   41  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     V   181_B     V   181_B      7   41  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     A   182_B     A   182_B      7   41  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G   183_B     G   183_B      7   41  278     44   93  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     V   184_B     V   184_B      7   41  278     15   76  111  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G   185_B     G   185_B      3   41  278     20   42   67  101  134  187  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     T   186_B     T   186_B      3   41  278      3   13   26   45   64   78  100  115  131  145  174  217  239  248  262  264  267  269  270  272 
LCS_GDT     G   187_B     G   187_B     26   41  278      4   10   53   90  111  161  204  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G   188_B     G   188_B     26   41  278     14   51   84  118  136  173  209  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     T   189_B     T   189_B     26   41  278     14   59   97  121  136  187  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     L   190_B     L   190_B     26   41  278     22   87  115  126  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     T   191_B     T   191_B     26   41  278     20   71  106  130  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G   192_B     G   192_B     26   41  278     20   79  110  124  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     V   193_B     V   193_B     26   41  278     22   87  115  122  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G   194_B     G   194_B     26   41  278     20   87  115  128  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     H   195_B     H   195_B     26   41  278     22   87  115  122  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     A   196_B     A   196_B     26   41  278     34   94  115  122  146  187  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     L   197_B     L   197_B     26   41  278     45   94  115  122  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     K   198_B     K   198_B     26   41  278     45   94  115  122  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     K   199_B     K   199_B     26   41  278     51   94  115  122  136  178  211  227  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     A   200_B     A   200_B     26   41  278     36   94  115  122  152  190  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     N   201_B     N   201_B     26   41  278     34   92  115  122  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     P   202_B     P   202_B     26   41  278     36   94  115  122  164  191  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     N   203_B     N   203_B     26   41  278     51   94  115  122  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     V   204_B     V   204_B     26   41  278     51   94  115  122  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     Q   205_B     Q   205_B     26   41  278     42   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     I   206_B     I   206_B     26   41  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     Y   207_B     Y   207_B     26   41  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     A   208_B     A   208_B     26   41  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     L   209_B     L   209_B     26   41  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     E   210_B     E   210_B     26   41  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     P   211_B     P   211_B     26   41  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     A   212_B     A   212_B     26   41  278     51   94  115  130  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     P   236_B     P   236_B      3    4  278      0    3    3    3    7   14   30   41   55   73   87  122  132  171  193  211  232  246  251  259 
LCS_GDT     K   237_B     K   237_B      6   10  278      1    4    8   11   13   17   20   23   25   27   42   57   67   96  126  133  157  196  229  246 
LCS_GDT     V   238_B     V   238_B      6   10  278      3    5    6   11   13   17   20   23   28   36   68   83  113  140  192  211  226  246  251  259 
LCS_GDT     L   239_B     L   239_B      7   75  278      4    6    8   11   13   17   30   41   55   88  107  146  164  197  219  242  255  258  267  272 
LCS_GDT     D   240_B     D   240_B      7   75  278      4    6   13   23   70  113  130  141  161  194  213  235  250  254  258  264  267  269  270  272 
LCS_GDT     T   241_B     T   241_B      7   75  278      4   14   45   88  121  132  149  192  223  237  243  251  251  255  262  264  267  269  270  272 
LCS_GDT     D   242_B     D   242_B     63   75  278      4   27   62   87  127  141  183  221  233  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     V   243_B     V   243_B     69   75  278      3   41   94  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     Y   244_B     Y   244_B     70   75  278     14   87  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     N   245_B     N   245_B     70   75  278     20   87  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G   246_B     G   246_B     70   75  278     32   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     I   247_B     I   247_B     70   75  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     L   248_B     L   248_B     70   75  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     E   249_B     E   249_B     70   75  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     I   250_B     I   250_B     70   75  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     K   251_B     K   251_B     70   75  278     51   94  115  126  164  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     S   252_B     S   252_B     70   75  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     D   253_B     D   253_B     70   75  278     29   91  114  130  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     D   254_B     D   254_B     70   75  278     29   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     A   255_B     A   255_B     70   75  278     49   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     I   256_B     I   256_B     70   75  278     36   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     T   257_B     T   257_B     70   75  278     28   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     M   258_B     M   258_B     70   75  278     48   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     A   259_B     A   259_B     70   75  278     23   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     R   260_B     R   260_B     70   75  278     42   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     E   261_B     E   261_B     70   75  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     V   262_B     V   262_B     70   75  278     28   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G   263_B     G   263_B     70   75  278     20   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     H   264_B     H   264_B     70   75  278     22   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     Q   265_B     Q   265_B     70   75  278     40   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     E   266_B     E   266_B     70   75  278     38   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G   267_B     G   267_B     70   75  278      4   90  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     I   268_B     I   268_B     70   75  278     13   90  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     L   269_B     L   269_B     70   75  278     13   94  115  129  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     V   270_B     V   270_B     70   75  278     12   88  115  122  164  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G   271_B     G   271_B     70   75  278     24   93  115  122  152  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     I   272_B     I   272_B     70   75  278     38   94  115  122  157  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     S   273_B     S   273_B     70   75  278     38   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     A   274_B     A   274_B     70   75  278     24   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G   275_B     G   275_B     70   75  278     24   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     A   276_B     A   276_B     70   75  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     N   277_B     N   277_B     70   75  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     I   278_B     I   278_B     70   75  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     K   279_B     K   279_B     70   75  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G   280_B     G   280_B     70   75  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     A   281_B     A   281_B     70   75  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     I   282_B     I   282_B     70   75  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     E   283_B     E   283_B     70   75  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     V   284_B     V   284_B     70   75  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     A   285_B     A   285_B     70   75  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     K   286_B     K   286_B     70   75  278     51   94  115  130  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     K   287_B     K   287_B     70   75  278     47   93  115  122  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     L   288_B     L   288_B     70   75  278     51   94  115  122  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G   289_B     G   289_B     70   75  278     51   94  115  122  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     K   290_B     K   290_B     70   75  278     51   94  115  122  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G   291_B     G   291_B     70   75  278     40   94  115  122  152  191  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     K   292_B     K   292_B     70   75  278     51   94  115  122  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     Q   293_B     Q   293_B     70   75  278     51   94  115  122  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     V   294_B     V   294_B     70   75  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     I   295_B     I   295_B     70   75  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     T   296_B     T   296_B     70   75  278     51   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     V   297_B     V   297_B     70   75  278     26   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     A   298_B     A   298_B     70   75  278     47   94  115  132  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     P   299_B     P   299_B     70   75  278     51   94  115  125  165  194  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     D   300_B     D   300_B     70   75  278     12   88  115  122  132  182  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G   301_B     G   301_B     70   75  278     33   94  115  122  145  190  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     G   302_B     G   302_B     70   75  278     39   94  115  122  133  184  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     D   303_B     D   303_B     70   75  278     47   94  115  122  136  190  212  229  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     R   304_B     R   304_B     70   75  278     12   81  115  122  129  138  181  223  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     Y   305_B     Y   305_B     70   75  278      7   82  115  122  129  137  161  202  232  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     L   306_B     L   306_B     70   75  278      6   94  115  122  129  143  181  223  234  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     S   307_B     S   307_B     70   75  278      6   74  115  122  129  136  151  186  218  238  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     T   308_B     T   308_B     70   75  278      6   54  112  122  129  136  151  186  205  230  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     E   309_B     E   309_B     70   75  278      6   39  110  122  129  136  151  186  205  230  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     L   310_B     L   310_B     70   75  278     17   59  110  122  129  143  179  212  232  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     F   311_B     F   311_B     70   75  278      5    8   76  122  129  143  174  209  232  239  245  251  251  255  262  264  267  269  270  272 
LCS_GDT     N   312_B     N   312_B     70   75  278      3    4   78  120  128  133  141  161  205  220  241  251  251  255  259  264  267  269  270  272 
LCS_GDT     Y   313_B     Y   313_B     70   75  278      8   50   98  122  128  136  146  186  207  232  243  251  251  255  262  264  267  269  270  272 
LCS_AVERAGE  LCS_A:  47.33  (  13.95   29.11   98.93 )

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     51     94    115    132    165    194    212    229    234    239    245    251    251    255    262    264    267    269    270    272 
GDT PERCENT_AT  18.15  33.45  40.93  46.98  58.72  69.04  75.44  81.49  83.27  85.05  87.19  89.32  89.32  90.75  93.24  93.95  95.02  95.73  96.09  96.80
GDT RMS_LOCAL    4.44   0.58   0.79   1.36   1.62   1.85   2.04   2.25   2.32   2.41   2.56   2.72   2.72   2.90   3.17   3.21   3.35   3.45   3.48   3.61
GDT RMS_ALL_AT   5.74   5.77   5.88   4.28   4.26   4.27   4.26   4.28   4.27   4.26   4.26   4.25   4.25   4.24   4.24   4.24   4.23   4.24   4.24   4.22

# Checking swapping
#   possible swapping detected:  Y    38_B      Y    38_B
#   possible swapping detected:  E    42_B      E    42_B
#   possible swapping detected:  F    44_B      F    44_B
#   possible swapping detected:  E    63_B      E    63_B
#   possible swapping detected:  E    76_B      E    76_B
#   possible swapping detected:  Y    95_B      Y    95_B
#   possible swapping detected:  E   108_B      E   108_B
#   possible swapping detected:  E   119_B      E   119_B
#   possible swapping detected:  E   138_B      E   138_B
#   possible swapping detected:  F   151_B      F   151_B
#   possible swapping detected:  E   161_B      E   161_B
#   possible swapping detected:  E   162_B      E   162_B
#   possible swapping detected:  F   172_B      F   172_B
#   possible swapping detected:  D   175_B      D   175_B
#   possible swapping detected:  E   210_B      E   210_B
#   possible swapping detected:  D   240_B      D   240_B
#   possible swapping detected:  D   242_B      D   242_B
#   possible swapping detected:  E   249_B      E   249_B
#   possible swapping detected:  E   266_B      E   266_B
#   possible swapping detected:  E   283_B      E   283_B
#   possible swapping detected:  D   300_B      D   300_B

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    K     9_B      K     9_B     3.643     4    0.186   0.193     4.017   45.000   24.127
LGA    I    10_B      I    10_B     3.618     0    0.065   0.609     5.563   43.333   39.048
LGA    T    11_B      T    11_B     3.239     0    0.087   1.077     3.377   50.000   51.020
LGA    N    12_B      N    12_B     3.435     0    0.151   1.327     8.329   55.476   36.369
LGA    S    13_B      S    13_B     2.388     0    0.118   0.664     2.814   66.905   63.651
LGA    I    14_B      I    14_B     0.944     0    0.073   0.563     2.113   88.452   86.310
LGA    V    15_B      V    15_B     0.926     0    0.034   1.357     3.631   90.595   78.027
LGA    N    16_B      N    16_B     1.630     0    0.112   0.158     2.426   75.000   70.893
LGA    L    17_B      L    17_B     1.537     0    0.046   0.867     3.824   72.976   70.357
LGA    I    18_B      I    18_B     1.754     0    0.054   0.092     2.331   70.952   70.893
LGA    G    19_B      G    19_B     3.652     0    0.679   0.679     3.970   46.667   46.667
LGA    N    20_B      N    20_B     3.829     0    0.111   0.174     4.516   46.905   42.857
LGA    T    21_B      T    21_B     3.415     0    0.050   0.207     4.280   48.333   44.422
LGA    P    22_B      P    22_B     2.449     0    0.036   0.142     2.975   64.881   62.653
LGA    I    23_B      I    23_B     1.731     0    0.117   1.028     4.877   70.833   59.226
LGA    V    24_B      V    24_B     1.372     0    0.066   0.097     1.702   81.429   80.204
LGA    K    25_B      K    25_B     1.338     0    0.027   0.155     1.958   81.429   76.667
LGA    L    26_B      L    26_B     0.951     0    0.031   0.290     1.700   83.690   82.619
LGA    N    27_B      N    27_B     1.438     0    0.217   0.349     2.253   77.381   74.107
LGA    R    28_B      R    28_B     1.462     0    0.107   1.799     9.028   79.286   50.130
LGA    V    29_B      V    29_B     1.251     0    0.064   1.204     2.790   79.286   74.558
LGA    V    30_B      V    30_B     1.835     0    0.036   0.733     2.623   72.857   68.367
LGA    P    31_B      P    31_B     2.331     0    0.097   0.363     2.512   66.786   69.592
LGA    E    32_B      E    32_B     2.631     4    0.026   0.069     2.834   57.143   31.746
LGA    D    33_B      D    33_B     3.231     0    0.152   0.817     3.768   53.571   53.869
LGA    A    34_B      A    34_B     2.517     0    0.015   0.048     2.815   57.143   58.667
LGA    A    35_B      A    35_B     2.357     0    0.110   0.117     2.391   68.810   68.000
LGA    D    36_B      D    36_B     1.853     0    0.058   0.129     2.919   72.857   66.905
LGA    V    37_B      V    37_B     1.211     0    0.050   0.991     3.150   81.429   75.850
LGA    Y    38_B      Y    38_B     1.291     0    0.030   0.229     2.636   81.429   72.421
LGA    V    39_B      V    39_B     1.143     0    0.029   1.030     2.966   81.429   76.871
LGA    K    40_B      K    40_B     1.818     0    0.045   0.505     4.133   72.857   57.672
LGA    L    41_B      L    41_B     1.790     0    0.133   0.147     2.882   66.905   74.226
LGA    E    42_B      E    42_B     2.245     0    0.097   0.981     4.939   62.976   58.042
LGA    F    43_B      F    43_B     2.999     0    0.052   0.314     4.568   50.238   48.615
LGA    F    44_B      F    44_B     4.137     0    0.150   0.692     5.700   33.333   38.701
LGA    N    45_B      N    45_B     4.201     0    0.118   1.079     5.424   43.690   37.619
LGA    P    46_B      P    46_B     5.290     0    0.042   0.140     7.683   31.786   23.537
LGA    G    47_B      G    47_B     1.908     0    0.257   0.257     5.565   54.286   54.286
LGA    G    48_B      G    48_B     3.913     0    0.102   0.102     5.722   39.762   39.762
LGA    S    49_B      S    49_B     3.429     0    0.031   0.664     4.964   50.000   46.905
LGA    I    50_B      I    50_B     3.573     0    0.110   0.841     4.574   46.667   44.464
LGA    K    51_B      K    51_B     3.438     2    0.183   0.662     3.842   50.119   39.841
LGA    D    52_B      D    52_B     2.138     0    0.053   0.186     3.657   71.190   60.774
LGA    R    53_B      R    53_B     1.361     0    0.062   0.746     7.407   77.143   45.714
LGA    I    54_B      I    54_B     2.821     0    0.045   1.624     7.690   59.048   43.393
LGA    A    55_B      A    55_B     2.582     0    0.044   0.065     2.864   60.952   60.190
LGA    L    56_B      L    56_B     1.271     0    0.033   1.220     2.815   79.286   77.500
LGA    A    57_B      A    57_B     1.983     0    0.081   0.098     2.331   68.810   68.000
LGA    M    58_B      M    58_B     2.503     0    0.039   0.474     4.807   62.857   50.179
LGA    I    59_B      I    59_B     1.630     0    0.031   0.595     2.135   77.143   76.131
LGA    E    60_B      E    60_B     1.465     0    0.036   0.276     1.678   75.000   80.582
LGA    E    61_B      E    61_B     1.954     0    0.057   0.997     2.479   72.857   69.259
LGA    A    62_B      A    62_B     1.683     0    0.043   0.058     1.803   77.143   76.286
LGA    E    63_B      E    63_B     1.410     0    0.092   0.638     1.656   81.429   81.481
LGA    K    64_B      K    64_B     1.562     4    0.055   0.069     1.580   72.857   40.476
LGA    A    65_B      A    65_B     1.701     0    0.234   0.229     2.587   77.143   73.143
LGA    G    66_B      G    66_B     1.284     0    0.142   0.142     1.599   81.548   81.548
LGA    K    67_B      K    67_B     1.721     4    0.068   0.092     2.294   70.833   38.677
LGA    L    68_B      L    68_B     1.590     0    0.060   1.386     3.202   70.833   71.190
LGA    Q    69_B      Q    69_B     1.966     4    0.042   0.068     2.396   72.857   39.577
LGA    A    70_B      A    70_B     1.831     0    0.020   0.047     2.303   70.833   69.619
LGA    G    71_B      G    71_B     1.595     0    0.060   0.060     1.729   72.857   72.857
LGA    G    72_B      G    72_B     1.385     0    0.065   0.065     1.385   83.690   83.690
LGA    T    73_B      T    73_B     1.503     0    0.048   0.092     1.641   72.857   75.306
LGA    I    74_B      I    74_B     1.701     0    0.027   1.180     3.867   81.786   69.762
LGA    V    75_B      V    75_B     0.723     0    0.080   1.151     3.055   88.214   80.884
LGA    E    76_B      E    76_B     0.781     0    0.097   0.644     2.177   92.857   81.852
LGA    P    77_B      P    77_B     0.592     0    0.152   0.194     1.507   88.452   90.680
LGA    T    78_B      T    78_B     0.834     0    0.034   0.219     0.997   90.476   91.837
LGA    S    79_B      S    79_B     1.172     0    0.079   0.572     1.734   81.429   80.000
LGA    G    80_B      G    80_B     1.126     0    0.057   0.057     1.126   83.690   83.690
LGA    N    81_B      N    81_B     1.304     3    0.124   0.142     2.170   81.429   48.810
LGA    T    82_B      T    82_B     1.414     0    0.082   1.198     2.917   83.690   78.027
LGA    G    83_B      G    83_B     0.298     0    0.054   0.054     0.523   97.619   97.619
LGA    V    84_B      V    84_B     0.586     0    0.052   0.155     1.381   90.476   86.599
LGA    G    85_B      G    85_B     1.206     0    0.032   0.032     1.381   83.690   83.690
LGA    L    86_B      L    86_B     1.193     0    0.038   0.963     2.365   81.429   82.798
LGA    A    87_B      A    87_B     0.782     0    0.041   0.053     0.989   90.476   90.476
LGA    M    88_B      M    88_B     1.247     0    0.076   0.901     2.676   83.690   78.452
LGA    V    89_B      V    89_B     1.567     0    0.041   0.133     1.926   75.000   74.082
LGA    A    90_B      A    90_B     1.335     0    0.073   0.077     1.646   79.286   79.714
LGA    A    91_B      A    91_B     1.130     0    0.036   0.039     1.609   79.286   81.524
LGA    A    92_B      A    92_B     1.879     0    0.056   0.063     2.123   70.833   69.619
LGA    K    93_B      K    93_B     1.783     0    0.071   1.091     4.442   70.833   67.090
LGA    G    94_B      G    94_B     1.672     0    0.098   0.098     1.672   77.143   77.143
LGA    Y    95_B      Y    95_B     1.071     0    0.077   0.103     1.240   81.429   85.952
LGA    H    96_B      H    96_B     0.898     0    0.104   0.530     1.813   81.548   84.238
LGA    L    97_B      L    97_B     0.565     0    0.047   1.281     4.445   97.619   81.964
LGA    V    98_B      V    98_B     0.473     0    0.051   0.120     0.526   95.238   94.558
LGA    I    99_B      I    99_B     0.350     0    0.034   1.158     2.385   95.238   85.238
LGA    T   100_B      T   100_B     0.858     0    0.079   0.190     1.134   88.214   85.306
LGA    M   101_B      M   101_B     1.792     0    0.028   0.951     4.095   72.976   66.488
LGA    P   102_B      P   102_B     2.692     0    0.057   0.068     2.948   59.048   58.231
LGA    E   103_B      E   103_B     3.077     0    0.411   1.213     7.085   51.786   41.640
LGA    T   104_B      T   104_B     4.199     0    0.118   0.136     6.843   43.452   31.701
LGA    M   105_B      M   105_B     4.542     0    0.115   1.500     7.313   37.262   24.940
LGA    S   106_B      S   106_B     4.907     0    0.524   0.726     7.976   37.500   28.413
LGA    V   107_B      V   107_B     4.381     0    0.622   1.385     7.620   31.786   27.415
LGA    E   108_B      E   108_B     3.163     0    0.055   0.643     4.859   55.476   46.138
LGA    R   109_B      R   109_B     2.298     4    0.043   0.626     2.971   62.857   39.134
LGA    R   110_B      R   110_B     2.319     0    0.097   1.242     3.967   66.786   66.667
LGA    K   111_B      K   111_B     1.968     0    0.038   0.533     3.049   72.976   65.079
LGA    L   112_B      L   112_B     1.497     0    0.048   1.415     3.758   79.286   70.476
LGA    M   113_B      M   113_B     1.156     0    0.038   0.356     1.490   85.952   84.821
LGA    Q   114_B      Q   114_B     0.910     0    0.023   0.808     3.378   88.214   80.000
LGA    G   115_B      G   115_B     1.344     0    0.070   0.070     1.680   79.286   79.286
LGA    Y   116_B      Y   116_B     0.939     0    0.160   0.211     1.313   85.952   82.937
LGA    G   117_B      G   117_B     0.801     0    0.088   0.088     0.995   90.476   90.476
LGA    A   118_B      A   118_B     0.450     0    0.022   0.037     0.593   97.619   98.095
LGA    E   119_B      E   119_B     0.620     0    0.062   0.878     3.138   90.476   80.159
LGA    L   120_B      L   120_B     0.627     0    0.021   0.302     1.495   88.214   88.214
LGA    I   121_B      I   121_B     1.207     1    0.051   1.192     3.559   81.429   65.417
LGA    L   122_B      L   122_B     1.988     0    0.033   0.988     4.643   66.905   64.881
LGA    T   123_B      T   123_B     2.716     0    0.076   0.080     3.129   57.262   58.299
LGA    P   124_B      P   124_B     4.233     0    0.039   0.116     4.797   38.690   37.279
LGA    G   125_B      G   125_B     4.854     0    0.054   0.054     5.421   30.238   30.238
LGA    A   126_B      A   126_B     6.483     0    0.063   0.074     7.021   17.262   15.810
LGA    D   127_B      D   127_B     4.379     0    0.056   0.920     6.340   37.262   32.619
LGA    G   128_B      G   128_B     3.965     0    0.091   0.091     4.087   45.119   45.119
LGA    M   129_B      M   129_B     2.885     0    0.034   1.051     3.397   57.262   57.262
LGA    K   130_B      K   130_B     2.931     4    0.046   0.109     3.050   59.048   31.799
LGA    G   131_B      G   131_B     3.021     0    0.041   0.041     3.087   53.571   53.571
LGA    A   132_B      A   132_B     1.677     0    0.048   0.065     2.287   75.119   74.667
LGA    I   133_B      I   133_B     1.017     0    0.100   0.155     1.616   81.429   81.488
LGA    A   134_B      A   134_B     1.868     0    0.042   0.061     2.223   72.857   71.238
LGA    K   135_B      K   135_B     2.101     0    0.042   0.964     2.643   68.810   65.714
LGA    A   136_B      A   136_B     1.294     0    0.064   0.080     1.639   79.286   81.524
LGA    E   137_B      E   137_B     1.375     2    0.083   0.152     2.185   75.119   62.540
LGA    E   138_B      E   138_B     2.313     0    0.020   0.563     3.516   62.857   59.048
LGA    L   139_B      L   139_B     2.559     0    0.041   0.234     2.933   59.048   61.964
LGA    V   140_B      V   140_B     2.556     0    0.152   1.016     4.171   57.143   55.374
LGA    K   141_B      K   141_B     2.635     4    0.043   0.091     2.879   57.143   31.746
LGA    E   142_B      E   142_B     2.602     4    0.158   0.208     2.803   60.952   34.286
LGA    K   143_B      K   143_B     2.457     4    0.110   0.124     2.841   59.048   34.339
LGA    G   144_B      G   144_B     2.781     0    0.040   0.040     2.781   57.143   57.143
LGA    Y   145_B      Y   145_B     2.117     0    0.012   0.328     2.360   68.810   72.937
LGA    F   146_B      F   146_B     1.969     0    0.069   0.263     2.796   72.857   65.628
LGA    M   147_B      M   147_B     1.560     0    0.256   0.309     2.771   70.952   65.952
LGA    P   148_B      P   148_B     4.003     0    0.138   0.331     5.052   36.190   40.476
LGA    M   149_B      M   149_B     6.035     3    0.139   0.144     7.343   17.976   10.238
LGA    Q   150_B      Q   150_B     8.095     4    0.197   0.269    10.026    3.810    2.487
LGA    F   151_B      F   151_B    12.395     0    0.641   1.406    20.681    0.000    0.000
LGA    D   152_B      D   152_B    12.912     3    0.105   0.130    15.000    0.000    0.000
LGA    N   153_B      N   153_B    11.775     3    0.147   0.196    11.916    0.714    0.357
LGA    P   154_B      P   154_B    10.896     0    0.511   0.538    14.145    1.071    0.612
LGA    A   155_B      A   155_B     8.679     0    0.201   0.304    10.470    2.143    1.714
LGA    H   160_B      H   160_B     8.886     5    0.036   0.074    10.189   12.857    5.143
LGA    E   161_B      E   161_B     7.235     0    0.658   1.039    11.808    8.690    4.021
LGA    E   162_B      E   162_B     7.777     0    0.555   1.252     9.932   14.167    8.730
LGA    T   163_B      T   163_B     7.961     0    0.093   0.268     9.204    5.357    4.354
LGA    T   164_B      T   164_B     9.218     0    0.090   0.164    10.611    2.976    1.769
LGA    G   165_B      G   165_B     6.980     0    0.073   0.073     7.621   11.786   11.786
LGA    K   166_B      K   166_B     6.308     4    0.040   0.077     7.062   13.571    8.413
LGA    E   167_B      E   167_B     8.725     0    0.034   0.852     9.590    3.571    2.275
LGA    I   168_B      I   168_B     8.792     0    0.035   0.571    10.392    3.333    2.738
LGA    L   169_B      L   169_B     7.473     0    0.045   0.699     8.416    6.667    9.405
LGA    E   170_B      E   170_B     9.154     0    0.025   0.129    10.782    1.667    0.952
LGA    A   171_B      A   171_B    10.515     0    0.121   0.119    11.116    0.119    0.095
LGA    F   172_B      F   172_B     9.146     0    0.148   0.412     9.466    1.429    4.848
LGA    G   173_B      G   173_B    10.336     0    0.676   0.676    10.336    0.238    0.238
LGA    D   174_B      D   174_B    11.224     0    0.232   1.120    15.892    0.119    0.060
LGA    D   175_B      D   175_B     9.275     0    0.057   0.959    10.819    2.381    1.905
LGA    I   176_B      I   176_B     6.228     0    0.253   1.353    10.006   22.024   18.929
LGA    P   177_B      P   177_B     6.358     0    0.630   0.534     9.667   20.476   12.585
LGA    D   178_B      D   178_B     3.434     0    0.221   0.300     6.050   51.905   42.917
LGA    A   179_B      A   179_B     1.856     0    0.019   0.042     2.194   70.833   71.238
LGA    F   180_B      F   180_B     1.603     0    0.043   0.104     2.393   77.143   71.472
LGA    V   181_B      V   181_B     1.027     0    0.039   0.093     1.369   81.429   86.667
LGA    A   182_B      A   182_B     1.486     0    0.022   0.030     1.704   81.429   79.714
LGA    G   183_B      G   183_B     1.461     0    0.039   0.039     1.561   79.286   79.286
LGA    V   184_B      V   184_B     1.298     0    0.632   0.553     4.032   66.190   72.925
LGA    G   185_B      G   185_B     3.509     0    0.376   0.376     6.754   35.714   35.714
LGA    T   186_B      T   186_B     8.509     0    0.069   0.127    12.015    6.905    4.354
LGA    G   187_B      G   187_B     4.038     0    0.575   0.575     4.875   40.476   40.476
LGA    G   188_B      G   188_B     3.980     0    0.189   0.189     3.980   43.333   43.333
LGA    T   189_B      T   189_B     3.672     0    0.059   0.157     4.403   46.667   43.469
LGA    L   190_B      L   190_B     2.561     0    0.043   1.347     4.056   60.952   63.631
LGA    T   191_B      T   191_B     2.258     0    0.040   1.202     5.085   64.762   58.163
LGA    G   192_B      G   192_B     2.765     0    0.039   0.039     2.765   57.143   57.143
LGA    V   193_B      V   193_B     2.804     0    0.089   0.179     3.087   57.143   56.122
LGA    G   194_B      G   194_B     2.367     0    0.106   0.106     2.511   62.857   62.857
LGA    H   195_B      H   195_B     2.966     0    0.039   1.041     4.805   53.571   46.952
LGA    A   196_B      A   196_B     3.761     0    0.023   0.053     4.202   46.667   44.762
LGA    L   197_B      L   197_B     2.603     0    0.025   0.118     2.884   57.143   61.964
LGA    K   198_B      K   198_B     2.692     0    0.041   0.739     3.386   55.476   62.646
LGA    K   199_B      K   199_B     4.097     2    0.053   0.796     7.371   38.690   24.339
LGA    A   200_B      A   200_B     3.584     0    0.024   0.057     3.738   45.000   46.000
LGA    N   201_B      N   201_B     3.144     0    0.030   1.260     3.884   51.786   51.012
LGA    P   202_B      P   202_B     3.247     0    0.040   0.111     3.849   53.571   50.136
LGA    N   203_B      N   203_B     2.744     0    0.112   1.116     4.735   60.952   54.940
LGA    V   204_B      V   204_B     2.519     0    0.047   0.975     3.828   60.952   55.374
LGA    Q   205_B      Q   205_B     1.740     0    0.073   0.891     3.590   72.857   67.778
LGA    I   206_B      I   206_B     1.486     0    0.035   0.649     1.973   83.690   79.345
LGA    Y   207_B      Y   207_B     0.867     0    0.046   0.131     1.219   85.952   86.706
LGA    A   208_B      A   208_B     1.062     0    0.061   0.068     1.313   88.214   86.857
LGA    L   209_B      L   209_B     0.950     0    0.009   1.139     4.472   85.952   75.179
LGA    E   210_B      E   210_B     1.731     0    0.042   1.069     3.594   75.000   63.704
LGA    P   211_B      P   211_B     2.487     0    0.039   0.436     2.819   64.762   62.585
LGA    A   212_B      A   212_B     2.580     0    0.556   0.505     2.874   59.048   58.667
LGA    P   236_B      P   236_B    18.042     0    0.534   0.692    18.949    0.000    0.000
LGA    K   237_B      K   237_B    19.307     0    0.543   1.368    23.569    0.000    0.000
LGA    V   238_B      V   238_B    17.114     0    0.036   1.018    17.796    0.000    0.000
LGA    L   239_B      L   239_B    12.989     0    0.115   1.480    15.122    0.000    0.000
LGA    D   240_B      D   240_B     8.898     0    0.077   0.787    10.053    7.500    6.726
LGA    T   241_B      T   241_B     6.530     0    0.178   1.098    10.708   22.500   15.306
LGA    D   242_B      D   242_B     5.364     0    0.070   0.466     9.736   30.595   18.690
LGA    V   243_B      V   243_B     1.559     0    0.269   1.405     4.256   72.976   66.667
LGA    Y   244_B      Y   244_B     1.090     0    0.036   0.929     3.579   85.952   75.714
LGA    N   245_B      N   245_B     0.877     0    0.153   0.929     2.767   81.786   79.702
LGA    G   246_B      G   246_B     1.032     0    0.048   0.048     1.032   88.214   88.214
LGA    I   247_B      I   247_B     0.746     0    0.068   1.231     2.631   90.476   80.893
LGA    L   248_B      L   248_B     0.756     0    0.043   1.110     4.411   90.476   77.381
LGA    E   249_B      E   249_B     1.558     0    0.047   0.627     1.743   75.000   78.624
LGA    I   250_B      I   250_B     2.048     0    0.025   1.148     4.550   66.786   59.167
LGA    K   251_B      K   251_B     2.737     2    0.095   0.613     4.943   59.048   38.783
LGA    S   252_B      S   252_B     2.417     0    0.078   0.590     3.448   62.857   59.762
LGA    D   253_B      D   253_B     2.518     0    0.046   0.961     3.633   57.143   57.321
LGA    D   254_B      D   254_B     2.420     0    0.037   0.736     4.038   62.857   54.881
LGA    A   255_B      A   255_B     1.935     0    0.062   0.099     2.151   70.833   69.619
LGA    I   256_B      I   256_B     2.130     0    0.036   1.547     4.722   64.762   62.679
LGA    T   257_B      T   257_B     2.129     0    0.042   1.178     4.464   68.810   60.068
LGA    M   258_B      M   258_B     1.695     0    0.033   1.146     5.490   72.857   64.048
LGA    A   259_B      A   259_B     1.834     0    0.061   0.069     1.988   72.857   72.857
LGA    R   260_B      R   260_B     2.334     0    0.024   1.311     7.734   64.762   43.766
LGA    E   261_B      E   261_B     1.906     0    0.041   0.683     3.537   70.833   62.646
LGA    V   262_B      V   262_B     1.303     0    0.104   1.222     3.306   79.286   71.224
LGA    G   263_B      G   263_B     1.729     0    0.126   0.126     1.758   72.857   72.857
LGA    H   264_B      H   264_B     1.894     0    0.042   0.185     2.897   72.857   66.476
LGA    Q   265_B      Q   265_B     1.371     0    0.042   1.124     4.679   81.429   69.524
LGA    E   266_B      E   266_B     1.787     0    0.342   1.415     6.816   79.286   48.995
LGA    G   267_B      G   267_B     1.902     0    0.153   0.153     2.290   70.833   70.833
LGA    I   268_B      I   268_B     1.809     0    0.071   0.744     2.478   72.857   72.917
LGA    L   269_B      L   269_B     2.289     0    0.089   0.181     3.068   64.762   61.012
LGA    V   270_B      V   270_B     2.635     0    0.090   0.890     4.352   57.262   53.333
LGA    G   271_B      G   271_B     3.065     0    0.067   0.067     3.065   55.357   55.357
LGA    I   272_B      I   272_B     2.988     0    0.017   0.190     4.829   57.262   49.702
LGA    S   273_B      S   273_B     2.272     0    0.130   0.523     2.615   66.905   64.921
LGA    A   274_B      A   274_B     1.375     0    0.037   0.058     1.571   79.286   79.714
LGA    G   275_B      G   275_B     1.829     0    0.067   0.067     1.829   72.857   72.857
LGA    A   276_B      A   276_B     1.714     0    0.043   0.063     2.071   77.143   74.667
LGA    N   277_B      N   277_B     0.961     0    0.035   1.215     4.207   90.595   78.333
LGA    I   278_B      I   278_B     0.903     0    0.044   0.223     1.768   85.952   82.619
LGA    K   279_B      K   279_B     1.256     0    0.065   0.626     4.955   81.429   68.889
LGA    G   280_B      G   280_B     0.678     0    0.043   0.043     0.875   90.476   90.476
LGA    A   281_B      A   281_B     0.645     0    0.022   0.037     1.173   88.214   88.667
LGA    I   282_B      I   282_B     1.371     0    0.037   1.366     4.249   77.143   65.714
LGA    E   283_B      E   283_B     1.479     0    0.054   1.170     4.090   77.143   66.561
LGA    V   284_B      V   284_B     1.480     0    0.043   0.145     1.836   77.143   79.048
LGA    A   285_B      A   285_B     1.760     0    0.039   0.055     2.230   70.833   71.238
LGA    K   286_B      K   286_B     2.238     0    0.039   1.119     2.603   64.762   68.571
LGA    K   287_B      K   287_B     2.602     2    0.045   0.669     3.026   57.262   50.741
LGA    L   288_B      L   288_B     2.814     0    0.070   0.259     3.575   51.905   54.583
LGA    G   289_B      G   289_B     3.078     0    0.050   0.050     3.113   51.786   51.786
LGA    K   290_B      K   290_B     3.004     2    0.055   0.453     4.655   50.000   36.825
LGA    G   291_B      G   291_B     3.364     0    0.101   0.101     3.364   50.000   50.000
LGA    K   292_B      K   292_B     3.099     0    0.019   0.606     5.745   53.571   43.598
LGA    Q   293_B      Q   293_B     2.426     0    0.060   1.210     6.867   62.857   43.545
LGA    V   294_B      V   294_B     1.576     0    0.078   0.099     1.699   75.000   77.755
LGA    I   295_B      I   295_B     1.576     0    0.007   1.324     4.686   77.143   66.845
LGA    T   296_B      T   296_B     1.086     0    0.138   1.002     2.837   83.690   78.163
LGA    V   297_B      V   297_B     1.969     0    0.053   0.190     2.243   72.857   70.544
LGA    A   298_B      A   298_B     2.069     0    0.096   0.104     2.690   62.857   64.857
LGA    P   299_B      P   299_B     2.451     0    0.047   0.256     3.370   59.167   60.476
LGA    D   300_B      D   300_B     3.603     0    0.091   1.194     7.338   51.905   35.655
LGA    G   301_B      G   301_B     3.224     0    0.064   0.064     3.782   48.333   48.333
LGA    G   302_B      G   302_B     3.440     0    0.052   0.052     3.843   46.667   46.667
LGA    D   303_B      D   303_B     3.313     0    0.130   1.063     4.273   43.452   45.060
LGA    R   304_B      R   304_B     4.608     6    0.059   0.081     5.136   31.548   14.329
LGA    Y   305_B      Y   305_B     4.961     0    0.152   0.314     5.458   28.810   29.683
LGA    L   306_B      L   306_B     4.488     0    0.023   0.219     5.040   30.238   35.238
LGA    S   307_B      S   307_B     5.976     0    0.045   0.061     6.473   19.286   18.571
LGA    T   308_B      T   308_B     6.151     0    0.043   1.118     7.382   18.214   20.204
LGA    E   309_B      E   309_B     6.311     3    0.119   0.677     7.892   19.286   10.847
LGA    L   310_B      L   310_B     4.995     0    0.038   0.153     5.489   30.119   32.976
LGA    F   311_B      F   311_B     4.791     0    0.488   0.572     4.852   32.857   34.026
LGA    N   312_B      N   312_B     6.959     0    0.374   1.054    11.254   17.262    9.762
LGA    Y   313_B      Y   313_B     6.611     0    0.656   0.534     8.913    9.881   15.119

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      278    1112   1112  100.00    1970   1970  100.00               281
SUMMARY(RMSD_GDC):     4.198          4.124                  4.589           58.618   54.174

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  305  281    4.0    229    2.25    63.968    58.619     9.742

LGA_LOCAL      RMSD:   2.251  Number of atoms:  229  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   4.276  Number of assigned atoms:  278 
Std_ASGN_ATOMS RMSD:   4.198  Standard rmsd on all 278 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.569797 * X  +  -0.235002 * Y  +   0.787468 * Z  +  -7.460407
  Y_new =  -0.407255 * X  +  -0.913044 * Y  +   0.022204 * Z  +   4.371678
  Z_new =   0.713775 * X  +  -0.333352 * Y  +  -0.615956 * Z  +  30.096188 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -0.620549 -0.794873 -2.645535   [DEG:  -35.5548  -45.5429 -151.5780 ]
ZXZ:  1.598986  2.234395  2.007720   [DEG:   91.6152  128.0214  115.0339 ]
 
# END of job
