
#######################################################
#                                                     #
#                        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  250 ( 2016),  selected  226 , name one
# Molecule2: number of CA atoms  226 ( 1818),  selected  226 , 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:   226      11_B - 246_B       1.74     1.74
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   226      11_B - 246_B       1.74     1.74
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   199      14_B - 222_B       0.99     1.78
  LONGEST_CONTINUOUS_SEGMENT:   199      15_B - 223_B       0.96     1.79
  LONGEST_CONTINUOUS_SEGMENT:   199      16_B - 224_B       0.98     1.80
  LCS_AVERAGE:     81.42

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  226
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     R    11_B     R    11_B      5  226  226      0    4    5    6   18   22   35   39   55   75  126  144  192  213  224  226  226  226  226  226 
LCS_GDT     K    12_B     K    12_B      6  226  226      3    4    6    8   52   66   78  117  136  155  202  223  225  225  225  226  226  226  226  226 
LCS_GDT     K    13_B     K    13_B     15  226  226      5    9   38   80  131  202  216  220  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     I    14_B     I    14_B    199  226  226      5    9   49   95  168  209  218  220  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     E    15_B     E    15_B    199  226  226      5   40  142  209  215  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     P    16_B     P    16_B    199  226  226     76  151  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     F    17_B     F    17_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     S    18_B     S    18_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     T    19_B     T    19_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     L    20_B     L    20_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     V    21_B     V    21_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     I    22_B     I    22_B    199  226  226     76  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     L    23_B     L    23_B    199  226  226     72  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     R    24_B     R    24_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     H    25_B     H    25_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     G    26_B     G    26_B    199  226  226     55  150  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     E    27_B     E    27_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     S    28_B     S    28_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     L    29_B     L    29_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     S    30_B     S    30_B    199  226  226     43  160  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     N    31_B     N    31_B    199  226  226     55  160  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     L    32_B     L    32_B    199  226  226     85  163  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     N    33_B     N    33_B    199  226  226     30  155  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     R    34_B     R    34_B    199  226  226     30  121  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     T    35_B     T    35_B    199  226  226     55  156  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     Y    36_B     Y    36_B    199  226  226     56  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     S    37_B     S    37_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     G    38_B     G    38_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     W    39_B     W    39_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     Y    40_B     Y    40_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     D    41_B     D    41_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     T    42_B     T    42_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     D    43_B     D    43_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     L    44_B     L    44_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     T    45_B     T    45_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     E    46_B     E    46_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     K    47_B     K    47_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     G    48_B     G    48_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     I    49_B     I    49_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     E    50_B     E    50_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     D    51_B     D    51_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     A    52_B     A    52_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     Y    53_B     Y    53_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     A    54_B     A    54_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     A    55_B     A    55_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     G    56_B     G    56_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     R    57_B     R    57_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     L    58_B     L    58_B    199  226  226     80  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     L    59_B     L    59_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     K    60_B     K    60_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     S    61_B     S    61_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     H    62_B     H    62_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     G    63_B     G    63_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     F    64_B     F    64_B    199  226  226     84  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     H    65_B     H    65_B    199  226  226     50  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     F    66_B     F    66_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     D    67_B     D    67_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     V    68_B     V    68_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     C    69_B     C    69_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     F    70_B     F    70_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     S    71_B     S    71_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     S    72_B     S    72_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     Y    73_B     Y    73_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     L    74_B     L    74_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     K    75_B     K    75_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     R    76_B     R    76_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     S    77_B     S    77_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     I    78_B     I    78_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     R    79_B     R    79_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     T    80_B     T    80_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     M    81_B     M    81_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     W    82_B     W    82_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     I    83_B     I    83_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     V    84_B     V    84_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     L    85_B     L    85_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     D    86_B     D    86_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     V    87_B     V    87_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     L    88_B     L    88_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     D    89_B     D    89_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     Q    90_B     Q    90_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     M    91_B     M    91_B    199  226  226     76  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     H    92_B     H    92_B    199  226  226     76  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     I    93_B     I    93_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     Q    94_B     Q    94_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     T    95_B     T    95_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     I    96_B     I    96_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     S    97_B     S    97_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     N    98_B     N    98_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     W    99_B     W    99_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     R   100_B     R   100_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     L   101_B     L   101_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     N   102_B     N   102_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     E   103_B     E   103_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     C   104_B     C   104_B    199  226  226     63  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     H   105_B     H   105_B    199  226  226     74  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     F   106_B     F   106_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     G   107_B     G   107_B    199  226  226     86  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     L   108_B     L   108_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     L   109_B     L   109_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     T   110_B     T   110_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     G   111_B     G   111_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     M   112_B     M   112_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     N   113_B     N   113_B    199  226  226     55  152  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     K   114_B     K   114_B    199  226  226     13  121  200  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     E   115_B     E   115_B    199  226  226     13  121  186  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     Q   116_B     Q   116_B    199  226  226     28  134  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     I   117_B     I   117_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     C   118_B     C   118_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     T   119_B     T   119_B    199  226  226     72  166  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     T   120_B     T   120_B    199  226  226     61  160  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     L   121_B     L   121_B    199  226  226     80  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     T   122_B     T   122_B    199  226  226     80  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     E   123_B     E   123_B    199  226  226     73  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     E   124_B     E   124_B    199  226  226     17  150  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     E   125_B     E   125_B    199  226  226     72  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     L   126_B     L   126_B    199  226  226     25  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     N   127_B     N   127_B    199  226  226     12  119  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     I   128_B     I   128_B    199  226  226     12   65  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     W   129_B     W   129_B    199  226  226     12  160  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     K   130_B     K   130_B    199  226  226     12   88  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     K   131_B     K   131_B    199  226  226     12   40  198  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     D   132_B     D   132_B    199  226  226     15  135  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     T   133_B     T   133_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     C   134_B     C   134_B    199  226  226     55  152  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     L   135_B     L   135_B    199  226  226     48  160  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     Q   136_B     Q   136_B    199  226  226     56  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     P   137_B     P   137_B    199  226  226     63  160  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     P   138_B     P   138_B    199  226  226     44  148  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     P   139_B     P   139_B    199  226  226     44  152  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     C   140_B     C   140_B    199  226  226     63  160  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     A   141_B     A   141_B    199  226  226     63  154  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     P   142_B     P   142_B    199  226  226     28  154  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     G   143_B     G   143_B    199  226  226     15  161  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     Q   144_B     Q   144_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     E   145_B     E   145_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     N   146_B     N   146_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     P   147_B     P   147_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     S   148_B     S   148_B    199  226  226     58  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     D   149_B     D   149_B    199  226  226     74  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     D   150_B     D   150_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     P   151_B     P   151_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     K   152_B     K   152_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     Y   153_B     Y   153_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     K   154_B     K   154_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     D   155_B     D   155_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     L   156_B     L   156_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     D   157_B     D   157_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     P   158_B     P   158_B    199  226  226     58  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     R   159_B     R   159_B    199  226  226     74  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     V   160_B     V   160_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     I   161_B     I   161_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     P   162_B     P   162_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     N   163_B     N   163_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     G   164_B     G   164_B    199  226  226     55  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     E   165_B     E   165_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     S   166_B     S   166_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     I   167_B     I   167_B    199  226  226     87  162  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     D   168_B     D   168_B    199  226  226     56  152  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     M   169_B     M   169_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     M   170_B     M   170_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     W   171_B     W   171_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     E   172_B     E   172_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     R   173_B     R   173_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     A   174_B     A   174_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     K   175_B     K   175_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     P   176_B     P   176_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     Y   177_B     Y   177_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     F   178_B     F   178_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     I   179_B     I   179_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     D   180_B     D   180_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     Q   181_B     Q   181_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     I   182_B     I   182_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     V   183_B     V   183_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     P   184_B     P   184_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     R   185_B     R   185_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     L   186_B     L   186_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     M   187_B     M   187_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     E   188_B     E   188_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     G   189_B     G   189_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     K   190_B     K   190_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     K   191_B     K   191_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     V   192_B     V   192_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     L   193_B     L   193_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     I   194_B     I   194_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     V   195_B     V   195_B    199  226  226     87  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     A   196_B     A   196_B    199  226  226     33  146  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     H   197_B     H   197_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     G   198_B     G   198_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     N   199_B     N   199_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     V   200_B     V   200_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     M   201_B     M   201_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     R   202_B     R   202_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     A   203_B     A   203_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     M   204_B     M   204_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     K   205_B     K   205_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     K   206_B     K   206_B    199  226  226     76  151  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     Y   207_B     Y   207_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     L   208_B     L   208_B    199  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     Q   209_B     Q   209_B    199  226  226     85  166  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     K   210_B     K   210_B    199  226  226     84  151  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     M   211_B     M   211_B    199  226  226     76  137  200  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     L   222_B     L   222_B    199  226  226      3   16   86  112  174  215  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     S   223_B     S   223_B    199  226  226      3   16   30  106  153  211  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     N   224_B     N   224_B    199  226  226      4   12   30   45  172  215  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     G   225_B     G   225_B     71  226  226      5   12   30   59  198  217  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     S   226_B     S   226_B     71  226  226      5   53  116  202  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     A   227_B     A   227_B     71  226  226     37  124  202  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     L   228_B     L   228_B     71  226  226     65  144  203  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     V   229_B     V   229_B     71  226  226     50  144  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     F   230_B     F   230_B     71  226  226     85  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     K   231_B     K   231_B     71  226  226     84  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     F   232_B     F   232_B     71  226  226     84  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     D   233_B     D   233_B     71  226  226     76  152  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     N   234_B     N   234_B     71  226  226     84  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     K   235_B     K   235_B     71  226  226     77  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     F   236_B     F   236_B     71  226  226     50  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     N   237_B     N   237_B     71  226  226     76  160  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     L   238_B     L   238_B     71  226  226     84  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     L   239_B     L   239_B     71  226  226     84  152  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     E   240_B     E   240_B     71  226  226     84  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     T   241_B     T   241_B     71  226  226     84  167  205  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     E   242_B     E   242_B     71  226  226     65  139  202  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     I   243_B     I   243_B     71  226  226     37  127  200  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     I   244_B     I   244_B     71  226  226     15   94  196  213  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     S   245_B     S   245_B     71  226  226     15   80  122  202  216  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_GDT     E   246_B     E   246_B     71  226  226      3   72  117  152  211  218  220  222  223  224  224  224  225  225  225  226  226  226  226  226 
LCS_AVERAGE  LCS_A:  93.81  (  81.42  100.00  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     87    167    205    213    216    218    220    222    223    224    224    224    225    225    225    226    226    226    226    226 
GDT PERCENT_AT  38.50  73.89  90.71  94.25  95.58  96.46  97.35  98.23  98.67  99.12  99.12  99.12  99.56  99.56  99.56 100.00 100.00 100.00 100.00 100.00
GDT RMS_LOCAL    0.33   0.63   0.80   0.86   0.91   0.96   1.05   1.11   1.18   1.26   1.26   1.26   1.46   1.46   1.46   1.74   1.74   1.74   1.74   1.74
GDT RMS_ALL_AT   1.93   1.79   1.79   1.79   1.79   1.78   1.79   1.79   1.78   1.77   1.77   1.77   1.75   1.75   1.75   1.74   1.74   1.74   1.74   1.74

# Checking swapping
#   possible swapping detected:  F    17_B      F    17_B
#   possible swapping detected:  Y    36_B      Y    36_B
#   possible swapping detected:  Y    40_B      Y    40_B
#   possible swapping detected:  E    46_B      E    46_B
#   possible swapping detected:  F    70_B      F    70_B
#   possible swapping detected:  E   123_B      E   123_B
#   possible swapping detected:  E   124_B      E   124_B
#   possible swapping detected:  E   125_B      E   125_B
#   possible swapping detected:  E   145_B      E   145_B
#   possible swapping detected:  D   155_B      D   155_B
#   possible swapping detected:  E   165_B      E   165_B
#   possible swapping detected:  E   172_B      E   172_B
#   possible swapping detected:  Y   177_B      Y   177_B
#   possible swapping detected:  F   178_B      F   178_B
#   possible swapping detected:  D   180_B      D   180_B
#   possible swapping detected:  E   188_B      E   188_B
#   possible swapping detected:  Y   207_B      Y   207_B
#   possible swapping detected:  F   236_B      F   236_B
#   possible swapping detected:  E   240_B      E   240_B

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    R    11_B      R    11_B    15.097     0    0.078   1.313    18.909    0.000    0.000
LGA    K    12_B      K    12_B    11.718     0    0.158   1.170    14.400    0.119    0.053
LGA    K    13_B      K    13_B     6.740     0    0.120   0.692     8.530   11.667   33.757
LGA    I    14_B      I    14_B     6.034     0    0.066   0.078     8.469   25.714   19.167
LGA    E    15_B      E    15_B     3.394     0    0.062   0.535     5.440   52.262   40.265
LGA    P    16_B      P    16_B     1.453     0    0.065   0.081     1.891   79.286   78.980
LGA    F    17_B      F    17_B     0.951     0    0.035   0.085     1.096   88.214   90.519
LGA    S    18_B      S    18_B     0.670     0    0.026   0.034     0.745   90.476   93.651
LGA    T    19_B      T    19_B     0.548     0    0.039   0.062     0.883   95.238   93.197
LGA    L    20_B      L    20_B     0.289     0    0.018   0.069     0.471  100.000  100.000
LGA    V    21_B      V    21_B     0.555     0    0.051   0.074     0.682   95.238   93.197
LGA    I    22_B      I    22_B     0.777     0    0.041   0.102     1.010   88.214   89.345
LGA    L    23_B      L    23_B     0.792     0    0.090   1.350     3.444   90.476   80.000
LGA    R    24_B      R    24_B     0.438     0    0.058   0.446     2.638   97.619   87.013
LGA    H    25_B      H    25_B     0.577     0    0.056   0.084     0.892   90.476   93.333
LGA    G    26_B      G    26_B     1.288     0    0.069   0.069     1.288   83.690   83.690
LGA    E    27_B      E    27_B     0.826     0    0.044   0.075     1.034   92.857   90.529
LGA    S    28_B      S    28_B     0.478     0    0.017   0.116     0.707   92.857   93.651
LGA    L    29_B      L    29_B     0.692     0    0.010   0.859     2.527   88.214   82.976
LGA    S    30_B      S    30_B     1.232     0    0.027   0.066     1.660   81.548   81.508
LGA    N    31_B      N    31_B     1.418     0    0.034   1.146     3.611   79.286   69.583
LGA    L    32_B      L    32_B     1.213     0    0.048   0.089     1.606   79.286   86.071
LGA    N    33_B      N    33_B     1.596     0    0.030   0.840     3.247   75.000   68.274
LGA    R    34_B      R    34_B     1.900     0    0.035   1.097     3.760   70.833   65.844
LGA    T    35_B      T    35_B     1.443     0    0.042   0.064     1.693   79.286   76.531
LGA    Y    36_B      Y    36_B     0.990     0    0.130   0.127     1.179   85.952   85.198
LGA    S    37_B      S    37_B     0.785     0    0.057   0.102     0.941   90.476   90.476
LGA    G    38_B      G    38_B     0.527     0    0.052   0.052     0.527   92.857   92.857
LGA    W    39_B      W    39_B     0.372     0    0.017   0.059     0.471  100.000  100.000
LGA    Y    40_B      Y    40_B     0.397     0    0.033   0.148     0.864  100.000   96.825
LGA    D    41_B      D    41_B     0.292     0    0.013   0.052     0.501  100.000   98.810
LGA    T    42_B      T    42_B     0.124     0    0.017   0.095     0.367  100.000  100.000
LGA    D    43_B      D    43_B     0.324     0    0.017   0.040     1.070  100.000   94.107
LGA    L    44_B      L    44_B     0.206     0    0.010   0.059     0.304  100.000  100.000
LGA    T    45_B      T    45_B     0.388     0    0.017   0.053     0.572  100.000   95.918
LGA    E    46_B      E    46_B     0.329     0    0.024   0.906     4.069  100.000   82.698
LGA    K    47_B      K    47_B     0.502     0    0.019   0.550     1.229   95.238   90.582
LGA    G    48_B      G    48_B     0.464     0    0.047   0.047     0.464  100.000  100.000
LGA    I    49_B      I    49_B     0.421     0    0.035   0.090     0.525  100.000   98.810
LGA    E    50_B      E    50_B     0.369     0    0.038   0.347     1.091  100.000   96.878
LGA    D    51_B      D    51_B     0.319     0    0.021   0.108     0.447  100.000  100.000
LGA    A    52_B      A    52_B     0.275     0    0.032   0.035     0.321  100.000  100.000
LGA    Y    53_B      Y    53_B     0.319     0    0.020   0.107     0.473  100.000  100.000
LGA    A    54_B      A    54_B     0.332     0    0.057   0.062     0.433  100.000  100.000
LGA    A    55_B      A    55_B     0.270     0    0.041   0.043     0.329  100.000  100.000
LGA    G    56_B      G    56_B     0.221     0    0.021   0.021     0.299  100.000  100.000
LGA    R    57_B      R    57_B     0.392     0    0.044   0.134     0.505   97.619   99.134
LGA    L    58_B      L    58_B     0.567     0    0.018   0.158     1.866   95.238   87.321
LGA    L    59_B      L    59_B     0.329     0    0.011   0.173     0.655  100.000   98.810
LGA    K    60_B      K    60_B     0.395     0    0.031   0.538     1.791  100.000   92.804
LGA    S    61_B      S    61_B     0.288     0    0.058   0.070     0.572  100.000   98.413
LGA    H    62_B      H    62_B     0.811     0    0.023   0.113     1.114   88.214   87.762
LGA    G    63_B      G    63_B     0.954     0    0.044   0.044     0.954   90.476   90.476
LGA    F    64_B      F    64_B     0.841     0    0.038   0.103     0.946   90.476   90.476
LGA    H    65_B      H    65_B     0.970     0    0.203   1.199     6.241   83.810   62.810
LGA    F    66_B      F    66_B     0.346     0    0.019   0.081     0.489  100.000  100.000
LGA    D    67_B      D    67_B     0.369     0    0.032   0.079     0.650  100.000   96.429
LGA    V    68_B      V    68_B     0.270     0    0.026   0.060     0.287  100.000  100.000
LGA    C    69_B      C    69_B     0.360     0    0.020   0.037     0.410  100.000  100.000
LGA    F    70_B      F    70_B     0.383     0    0.036   0.063     0.485  100.000  100.000
LGA    S    71_B      S    71_B     0.537     0    0.020   0.571     1.403   95.238   92.143
LGA    S    72_B      S    72_B     0.626     0    0.017   0.046     0.740   90.476   90.476
LGA    Y    73_B      Y    73_B     0.695     0    0.030   0.462     1.933   90.476   89.167
LGA    L    74_B      L    74_B     0.484     0    0.024   0.043     0.598   97.619   98.810
LGA    K    75_B      K    75_B     0.518     0    0.041   0.305     1.252   90.476   92.646
LGA    R    76_B      R    76_B     0.731     0    0.039   0.170     1.124   90.476   89.654
LGA    S    77_B      S    77_B     0.380     0    0.016   0.052     0.532   97.619   98.413
LGA    I    78_B      I    78_B     0.457     0    0.025   0.110     0.609  100.000   98.810
LGA    R    79_B      R    79_B     0.494     0    0.044   1.087     2.947   97.619   86.017
LGA    T    80_B      T    80_B     0.421     0    0.015   0.068     0.667  100.000   98.639
LGA    M    81_B      M    81_B     0.289     0    0.024   0.107     0.790  100.000   98.810
LGA    W    82_B      W    82_B     0.400     0    0.019   0.181     1.003  100.000   95.272
LGA    I    83_B      I    83_B     0.465     0    0.012   0.046     0.511   97.619   98.810
LGA    V    84_B      V    84_B     0.315     0    0.028   0.049     0.369  100.000  100.000
LGA    L    85_B      L    85_B     0.314     0    0.037   0.058     0.496  100.000  100.000
LGA    D    86_B      D    86_B     0.582     0    0.020   0.500     1.374   90.476   88.214
LGA    V    87_B      V    87_B     0.405     0    0.023   0.035     0.488  100.000  100.000
LGA    L    88_B      L    88_B     0.369     0    0.103   0.106     0.566   97.619   98.810
LGA    D    89_B      D    89_B     0.371     0    0.046   0.769     3.321  100.000   84.940
LGA    Q    90_B      Q    90_B     0.479     0    0.017   0.911     3.094   95.238   90.212
LGA    M    91_B      M    91_B     0.775     0    0.053   0.727     3.041   90.476   82.202
LGA    H    92_B      H    92_B     0.915     0    0.018   0.084     0.966   90.476   90.476
LGA    I    93_B      I    93_B     0.478     0    0.024   0.065     0.671   97.619   97.619
LGA    Q    94_B      Q    94_B     0.230     0    0.067   0.466     1.932  100.000   93.862
LGA    T    95_B      T    95_B     0.421     0    0.040   0.119     0.821  100.000   97.279
LGA    I    96_B      I    96_B     0.389     0    0.084   0.129     0.777  100.000   98.810
LGA    S    97_B      S    97_B     0.467     0    0.009   0.047     0.478  100.000  100.000
LGA    N    98_B      N    98_B     0.398     0    0.015   0.090     0.456  100.000  100.000
LGA    W    99_B      W    99_B     0.398     0    0.032   0.154     0.956  100.000   94.558
LGA    R   100_B      R   100_B     0.432     0    0.026   0.073     0.657   95.238   94.805
LGA    L   101_B      L   101_B     0.620     0    0.021   0.051     0.909   90.476   90.476
LGA    N   102_B      N   102_B     0.581     0    0.027   0.100     0.685   90.476   92.857
LGA    E   103_B      E   103_B     0.617     0    0.032   0.142     1.367   90.476   86.455
LGA    C   104_B      C   104_B     0.983     0    0.041   0.685     1.471   90.476   88.968
LGA    H   105_B      H   105_B     0.999     0    0.032   0.131     1.257   85.952   85.952
LGA    F   106_B      F   106_B     0.998     0    0.020   0.123     1.104   85.952   87.186
LGA    G   107_B      G   107_B     1.050     0    0.030   0.030     1.050   85.952   85.952
LGA    L   108_B      L   108_B     0.882     0    0.020   0.106     1.047   90.476   89.345
LGA    L   109_B      L   109_B     0.878     0    0.043   0.086     1.079   88.214   88.214
LGA    T   110_B      T   110_B     0.856     0    0.036   0.077     1.056   90.476   89.184
LGA    G   111_B      G   111_B     0.839     0    0.069   0.069     1.266   88.214   88.214
LGA    M   112_B      M   112_B     1.000     0    0.027   0.143     1.099   85.952   87.083
LGA    N   113_B      N   113_B     1.594     0    0.036   0.085     2.574   77.143   70.000
LGA    K   114_B      K   114_B     1.953     4    0.044   0.047     2.506   70.833   37.831
LGA    E   115_B      E   115_B     2.284     4    0.023   0.036     2.872   68.810   36.931
LGA    Q   116_B      Q   116_B     1.705     0    0.020   0.078     2.456   77.143   71.164
LGA    I   117_B      I   117_B     0.472     0    0.047   0.575     1.665   97.619   94.226
LGA    C   118_B      C   118_B     0.709     0    0.061   0.075     1.503   90.476   86.032
LGA    T   119_B      T   119_B     1.086     0    0.115   1.083     4.204   81.548   72.721
LGA    T   120_B      T   120_B     1.158     0    0.024   0.066     1.460   83.690   82.721
LGA    L   121_B      L   121_B     0.735     0    0.013   1.039     3.542   92.857   83.512
LGA    T   122_B      T   122_B     0.564     0    0.059   0.115     0.968   90.476   90.476
LGA    E   123_B      E   123_B     0.648     0    0.019   0.809     2.898   88.214   79.048
LGA    E   124_B      E   124_B     1.381     0    0.069   1.146     6.497   81.429   59.788
LGA    E   125_B      E   125_B     0.923     0    0.023   0.210     1.392   88.214   88.466
LGA    L   126_B      L   126_B     0.770     0    0.036   1.389     3.720   85.952   75.893
LGA    N   127_B      N   127_B     1.380     0    0.035   1.302     4.468   77.143   66.786
LGA    I   128_B      I   128_B     1.479     0    0.052   0.086     1.551   79.286   78.214
LGA    W   129_B      W   129_B     1.207     0    0.030   0.214     1.594   79.286   80.816
LGA    K   130_B      K   130_B     1.646     0    0.130   0.686     2.382   72.976   73.968
LGA    K   131_B      K   131_B     1.978     0    0.032   1.123     7.917   70.833   53.069
LGA    D   132_B      D   132_B     1.468     0    0.214   0.439     2.624   77.143   75.179
LGA    T   133_B      T   133_B     0.789     0    0.129   0.167     0.890   90.476   90.476
LGA    C   134_B      C   134_B     1.325     0    0.032   0.702     4.523   81.429   71.667
LGA    L   135_B      L   135_B     1.157     0    0.066   0.070     1.450   85.952   83.690
LGA    Q   136_B      Q   136_B     0.943     0    0.034   0.152     1.212   83.690   85.450
LGA    P   137_B      P   137_B     1.202     0    0.025   0.123     1.202   81.429   84.014
LGA    P   138_B      P   138_B     1.577     0    0.101   0.151     1.930   79.286   76.531
LGA    P   139_B      P   139_B     1.386     0    0.047   0.064     1.868   81.429   77.755
LGA    C   140_B      C   140_B     1.111     0    0.049   0.058     1.200   83.690   82.937
LGA    A   141_B      A   141_B     1.234     0    0.016   0.019     1.270   81.429   81.429
LGA    P   142_B      P   142_B     1.322     0    0.042   0.115     1.495   83.690   82.721
LGA    G   143_B      G   143_B     1.058     0    0.051   0.051     1.179   85.952   85.952
LGA    Q   144_B      Q   144_B     0.782     0    0.030   0.177     0.876   90.476   90.476
LGA    E   145_B      E   145_B     0.829     0    0.035   0.387     2.576   90.476   82.804
LGA    N   146_B      N   146_B     0.618     0    0.017   0.158     1.047   90.476   89.345
LGA    P   147_B      P   147_B     0.613     0    0.025   0.039     0.802   90.476   90.476
LGA    S   148_B      S   148_B     0.949     0    0.045   0.690     2.760   88.214   81.905
LGA    D   149_B      D   149_B     0.819     0    0.022   0.233     1.598   90.476   87.143
LGA    D   150_B      D   150_B     0.753     0    0.040   0.104     0.801   90.476   90.476
LGA    P   151_B      P   151_B     0.724     0    0.047   0.076     1.090   90.476   89.184
LGA    K   152_B      K   152_B     0.395     0    0.053   0.610     2.198  100.000   92.963
LGA    Y   153_B      Y   153_B     0.370     0    0.039   0.074     0.510   97.619   99.206
LGA    K   154_B      K   154_B     0.697     0    0.035   0.748     2.984   90.476   86.772
LGA    D   155_B      D   155_B     0.486     0    0.064   0.119     1.292   97.619   91.786
LGA    L   156_B      L   156_B     0.311     0    0.012   0.084     0.521   97.619   98.810
LGA    D   157_B      D   157_B     0.693     0    0.057   0.250     1.182   92.857   90.536
LGA    P   158_B      P   158_B     1.011     0    0.034   0.061     1.357   88.214   85.306
LGA    R   159_B      R   159_B     0.897     0    0.031   0.973     5.015   90.476   76.753
LGA    V   160_B      V   160_B     0.620     0    0.052   1.202     2.558   90.476   82.041
LGA    I   161_B      I   161_B     0.426     0    0.043   0.096     0.500   97.619   98.810
LGA    P   162_B      P   162_B     0.419     0    0.023   0.062     0.617  100.000   97.279
LGA    N   163_B      N   163_B     0.326     0    0.170   0.250     1.635   95.357   91.905
LGA    G   164_B      G   164_B     0.963     0    0.111   0.111     1.208   85.952   85.952
LGA    E   165_B      E   165_B     0.922     0    0.066   0.364     1.128   90.476   88.466
LGA    S   166_B      S   166_B     0.976     0    0.034   0.108     0.989   90.476   90.476
LGA    I   167_B      I   167_B     1.093     0    0.010   0.105     1.348   81.429   81.429
LGA    D   168_B      D   168_B     1.270     0    0.027   0.180     2.422   83.690   75.238
LGA    M   169_B      M   169_B     0.698     0    0.028   0.118     0.927   90.476   90.476
LGA    M   170_B      M   170_B     0.549     0    0.021   0.657     1.840   90.476   89.524
LGA    W   171_B      W   171_B     0.745     0    0.065   0.083     1.045   90.476   88.537
LGA    E   172_B      E   172_B     0.843     0    0.066   0.088     1.413   90.476   86.455
LGA    R   173_B      R   173_B     0.499     0    0.132   0.710     1.961  100.000   90.693
LGA    A   174_B      A   174_B     0.638     0    0.016   0.017     0.834   90.476   90.476
LGA    K   175_B      K   175_B     0.923     0    0.037   0.491     1.717   90.476   86.508
LGA    P   176_B      P   176_B     0.952     0    0.082   0.138     0.952   90.476   90.476
LGA    Y   177_B      Y   177_B     0.903     0    0.018   0.100     0.958   90.476   90.476
LGA    F   178_B      F   178_B     0.721     0    0.021   0.161     0.862   90.476   92.208
LGA    I   179_B      I   179_B     0.673     0    0.044   0.044     0.679   90.476   90.476
LGA    D   180_B      D   180_B     0.713     0    0.020   0.157     0.809   90.476   90.476
LGA    Q   181_B      Q   181_B     0.706     0    0.052   0.213     1.160   90.476   89.471
LGA    I   182_B      I   182_B     0.615     0    0.022   0.170     0.891   95.238   94.048
LGA    V   183_B      V   183_B     0.345     0    0.036   0.045     0.449  100.000  100.000
LGA    P   184_B      P   184_B     0.514     0    0.047   0.055     0.733   95.238   93.197
LGA    R   185_B      R   185_B     0.444     0    0.022   0.161     0.762  100.000   99.134
LGA    L   186_B      L   186_B     0.260     0    0.030   0.050     0.647   97.619   97.619
LGA    M   187_B      M   187_B     0.415     0    0.010   0.707     2.582   97.619   90.060
LGA    E   188_B      E   188_B     0.655     0    0.038   0.468     1.126   90.476   88.466
LGA    G   189_B      G   189_B     0.752     0    0.090   0.090     1.262   88.214   88.214
LGA    K   190_B      K   190_B     0.466     0    0.084   0.198     0.940   97.619   96.825
LGA    K   191_B      K   191_B     0.346     0    0.032   0.275     0.814  100.000   97.884
LGA    V   192_B      V   192_B     0.073     0    0.019   0.039     0.312  100.000  100.000
LGA    L   193_B      L   193_B     0.218     0    0.004   0.032     0.370  100.000  100.000
LGA    I   194_B      I   194_B     0.441     0    0.032   0.058     0.584   95.238   96.429
LGA    V   195_B      V   195_B     0.617     0    0.059   0.128     0.810   90.476   90.476
LGA    A   196_B      A   196_B     1.249     0    0.179   0.269     1.872   85.952   83.333
LGA    H   197_B      H   197_B     0.554     0    0.088   0.122     0.701   92.857   93.333
LGA    G   198_B      G   198_B     0.834     0    0.025   0.025     0.834   90.476   90.476
LGA    N   199_B      N   199_B     0.617     0    0.026   1.105     2.639   90.476   86.488
LGA    V   200_B      V   200_B     0.658     0    0.022   0.041     0.923   90.476   90.476
LGA    M   201_B      M   201_B     0.316     0    0.049   0.828     2.881  100.000   94.643
LGA    R   202_B      R   202_B     0.932     0    0.043   1.250     5.295   90.476   69.654
LGA    A   203_B      A   203_B     0.853     0    0.031   0.040     0.883   90.476   90.476
LGA    M   204_B      M   204_B     0.508     0    0.021   0.071     0.628   90.476   95.238
LGA    K   205_B      K   205_B     0.895     0    0.027   0.538     2.082   85.952   82.593
LGA    K   206_B      K   206_B     1.230     0    0.029   0.152     1.928   81.429   77.619
LGA    Y   207_B      Y   207_B     0.702     0    0.019   0.042     0.855   90.476   96.032
LGA    L   208_B      L   208_B     0.713     0    0.011   0.039     0.830   90.476   90.476
LGA    Q   209_B      Q   209_B     1.022     0    0.089   0.101     1.720   81.548   87.566
LGA    K   210_B      K   210_B     1.212     0    0.130   0.136     2.203   75.119   80.635
LGA    M   211_B      M   211_B     1.657     3    0.069   0.093     2.086   75.000   45.595
LGA    L   222_B      L   222_B     4.156     0    0.096   0.617     5.285   32.976   48.036
LGA    S   223_B      S   223_B     4.649     0    0.047   0.603     4.756   37.262   39.603
LGA    N   224_B      N   224_B     4.317     3    0.609   0.590     4.922   43.929   25.893
LGA    G   225_B      G   225_B     3.920     0    0.126   0.126     4.750   45.476   45.476
LGA    S   226_B      S   226_B     2.835     0    0.070   0.126     3.667   59.167   55.000
LGA    A   227_B      A   227_B     1.500     0    0.036   0.046     1.962   77.143   78.000
LGA    L   228_B      L   228_B     1.285     0    0.044   1.359     3.078   81.429   76.429
LGA    V   229_B      V   229_B     1.250     0    0.065   0.074     1.445   81.429   81.429
LGA    F   230_B      F   230_B     0.824     0    0.018   0.072     0.879   90.476   90.476
LGA    K   231_B      K   231_B     0.885     0    0.014   0.116     1.082   90.476   88.466
LGA    F   232_B      F   232_B     0.915     0    0.013   0.079     1.011   88.214   89.654
LGA    D   233_B      D   233_B     1.202     0    0.028   0.096     1.366   83.690   82.560
LGA    N   234_B      N   234_B     0.964     0    0.018   0.118     1.337   88.214   84.821
LGA    K   235_B      K   235_B     0.737     0    0.030   1.275     6.915   90.476   70.476
LGA    F   236_B      F   236_B     0.687     0    0.026   0.130     0.997   90.476   90.476
LGA    N   237_B      N   237_B     1.117     0    0.029   0.067     1.569   85.952   82.619
LGA    L   238_B      L   238_B     0.982     0    0.020   0.044     1.170   83.690   83.690
LGA    L   239_B      L   239_B     1.178     0    0.100   0.166     1.665   79.286   80.357
LGA    E   240_B      E   240_B     0.959     0    0.044   0.322     1.346   90.476   88.466
LGA    T   241_B      T   241_B     0.887     0    0.016   0.036     1.145   85.952   87.891
LGA    E   242_B      E   242_B     1.479     0    0.061   0.727     2.212   81.429   73.968
LGA    I   243_B      I   243_B     1.656     0    0.084   0.199     2.175   72.857   71.845
LGA    I   244_B      I   244_B     2.082     0    0.130   1.191     3.977   66.786   68.393
LGA    S   245_B      S   245_B     2.807     0    0.011   0.638     3.587   55.357   52.460
LGA    E   246_B      E   246_B     3.266     4    0.158   0.172     4.729   43.929   25.079

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      226     904    904  100.00    1818   1818  100.00               226
SUMMARY(RMSD_GDC):     1.744          1.716                  1.982           87.651   84.991

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  250  226    4.0    222    1.11    91.593    95.886    18.281

LGA_LOCAL      RMSD:   1.114  Number of atoms:  222  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   1.788  Number of assigned atoms:  226 
Std_ASGN_ATOMS RMSD:   1.744  Standard rmsd on all 226 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.735316 * X  +  -0.658796 * Y  +   0.159053 * Z  +  39.805050
  Y_new =  -0.154120 * X  +   0.065991 * Y  +   0.985846 * Z  +  -2.079982
  Z_new =  -0.659968 * X  +  -0.749421 * Y  +  -0.053010 * Z  +   7.205168 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -0.206606  0.720776 -1.641413   [DEG:  -11.8377   41.2974  -94.0460 ]
ZXZ:  2.981635  1.623831 -2.419579   [DEG:  170.8351   93.0387 -138.6317 ]
 
# END of job
