
#######################################################
#                                                     #
#                        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  258 ( 2089),  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       1.83     1.83
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   226      11_B - 246_B       1.83     1.83
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   107      14_B - 120_B       0.97     1.88
  LONGEST_CONTINUOUS_SEGMENT:   107      15_B - 121_B       0.95     1.88
  LONGEST_CONTINUOUS_SEGMENT:   107      16_B - 122_B       0.98     1.88
  LCS_AVERAGE:     33.00

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      3  226  226      0   21   33   52   81  104  135  178  216  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     K    12_B     K    12_B      3  226  226      0   21   33   52   81  117  135  178  216  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     K    13_B     K    13_B      3  226  226      3    3    3   41   62   97  131  161  199  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     I    14_B     I    14_B    107  226  226      7   38   99  163  196  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E    15_B     E    15_B    107  226  226      8   59  126  173  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     P    16_B     P    16_B    107  226  226     12   65  137  183  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     F    17_B     F    17_B    107  226  226     17   87  158  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S    18_B     S    18_B    107  226  226     17  102  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     T    19_B     T    19_B    107  226  226     22  112  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L    20_B     L    20_B    107  226  226     19  128  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     V    21_B     V    21_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     I    22_B     I    22_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L    23_B     L    23_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     R    24_B     R    24_B    107  226  226     31  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     H    25_B     H    25_B    107  226  226     54  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     G    26_B     G    26_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E    27_B     E    27_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S    28_B     S    28_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L    29_B     L    29_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S    30_B     S    30_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     N    31_B     N    31_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L    32_B     L    32_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     N    33_B     N    33_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     R    34_B     R    34_B    107  226  226     19  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     T    35_B     T    35_B    107  226  226     71  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     Y    36_B     Y    36_B    107  226  226     59  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S    37_B     S    37_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     G    38_B     G    38_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     W    39_B     W    39_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     Y    40_B     Y    40_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     D    41_B     D    41_B    107  226  226     76  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     T    42_B     T    42_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     D    43_B     D    43_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L    44_B     L    44_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     T    45_B     T    45_B    107  226  226     34  128  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E    46_B     E    46_B    107  226  226     79  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     K    47_B     K    47_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     G    48_B     G    48_B    107  226  226     47  129  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     I    49_B     I    49_B    107  226  226     47  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E    50_B     E    50_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     D    51_B     D    51_B    107  226  226     79  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     A    52_B     A    52_B    107  226  226     47  129  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     Y    53_B     Y    53_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     A    54_B     A    54_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     A    55_B     A    55_B    107  226  226     77  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     G    56_B     G    56_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     R    57_B     R    57_B    107  226  226     78  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L    58_B     L    58_B    107  226  226     22  128  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L    59_B     L    59_B    107  226  226     30  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     K    60_B     K    60_B    107  226  226     42  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S    61_B     S    61_B    107  226  226     22  128  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     H    62_B     H    62_B    107  226  226     22   75  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     G    63_B     G    63_B    107  226  226     22  128  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     F    64_B     F    64_B    107  226  226     30  129  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     H    65_B     H    65_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     F    66_B     F    66_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     D    67_B     D    67_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     V    68_B     V    68_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     C    69_B     C    69_B    107  226  226     69  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     F    70_B     F    70_B    107  226  226     48  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S    71_B     S    71_B    107  226  226     69  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S    72_B     S    72_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     Y    73_B     Y    73_B    107  226  226     74  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L    74_B     L    74_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     K    75_B     K    75_B    107  226  226     79  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     R    76_B     R    76_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S    77_B     S    77_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     I    78_B     I    78_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     R    79_B     R    79_B    107  226  226     79  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     T    80_B     T    80_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     M    81_B     M    81_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     W    82_B     W    82_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     I    83_B     I    83_B    107  226  226     79  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     V    84_B     V    84_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L    85_B     L    85_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     D    86_B     D    86_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     V    87_B     V    87_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L    88_B     L    88_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     D    89_B     D    89_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     Q    90_B     Q    90_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     M    91_B     M    91_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     H    92_B     H    92_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     I    93_B     I    93_B    107  226  226     79  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     Q    94_B     Q    94_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     T    95_B     T    95_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     I    96_B     I    96_B    107  226  226     72  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S    97_B     S    97_B    107  226  226     72  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     N    98_B     N    98_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     W    99_B     W    99_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     R   100_B     R   100_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L   101_B     L   101_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     N   102_B     N   102_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E   103_B     E   103_B    107  226  226     73  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     C   104_B     C   104_B    107  226  226     25  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     H   105_B     H   105_B    107  226  226     42  129  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     F   106_B     F   106_B    107  226  226     42  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     G   107_B     G   107_B    107  226  226     42  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L   108_B     L   108_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L   109_B     L   109_B    107  226  226     75  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     T   110_B     T   110_B    107  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     G   111_B     G   111_B    107  226  226     58  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     M   112_B     M   112_B    107  226  226     47  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     N   113_B     N   113_B    107  226  226     47  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     K   114_B     K   114_B    107  226  226     37  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E   115_B     E   115_B    107  226  226     22  110  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     Q   116_B     Q   116_B    107  226  226     20  104  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     I   117_B     I   117_B    107  226  226     22  113  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     C   118_B     C   118_B    107  226  226     35  119  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     T   119_B     T   119_B    107  226  226      9   47  148  181  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     T   120_B     T   120_B    107  226  226      6   16   94  147  201  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L   121_B     L   121_B    107  226  226      9   29   97  180  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     T   122_B     T   122_B    107  226  226      4   32   98  170  200  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E   123_B     E   123_B    105  226  226      9   19   88  170  200  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E   124_B     E   124_B     73  226  226      9   45  120  178  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E   125_B     E   125_B     73  226  226      9   41  140  182  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L   126_B     L   126_B     22  226  226     23  101  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     N   127_B     N   127_B     22  226  226     23  101  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     I   128_B     I   128_B     22  226  226      9   44  123  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     W   129_B     W   129_B     22  226  226      9   69  153  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     K   130_B     K   130_B     22  226  226     14   78  153  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     K   131_B     K   131_B     22  226  226      9   72  153  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     D   132_B     D   132_B     22  226  226      8   35  111  170  201  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     T   133_B     T   133_B     12  226  226      5   74  155  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     C   134_B     C   134_B      8  226  226      5  124  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L   135_B     L   135_B      8  226  226      5   44  156  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     Q   136_B     Q   136_B      8  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     P   137_B     P   137_B      8  226  226     18  128  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     P   138_B     P   138_B      8  226  226      6   80  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     P   139_B     P   139_B      8  226  226      6  128  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     C   140_B     C   140_B      8  226  226     10  128  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     A   141_B     A   141_B      6  226  226      3    6   77  160  201  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     P   142_B     P   142_B      6  226  226      3   10   57  165  201  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     G   143_B     G   143_B      5  226  226      3    4  122  175  203  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     Q   144_B     Q   144_B     14  226  226      3   35  128  181  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E   145_B     E   145_B     58  226  226      4  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     N   146_B     N   146_B     58  226  226      9   47  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     P   147_B     P   147_B     58  226  226      6   70  157  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S   148_B     S   148_B     58  226  226      6   21   36  175  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     D   149_B     D   149_B     62  226  226     13  104  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     D   150_B     D   150_B     62  226  226     38  129  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     P   151_B     P   151_B     62  226  226     23  107  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     K   152_B     K   152_B     62  226  226     21  123  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     Y   153_B     Y   153_B     62  226  226     18  128  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     K   154_B     K   154_B     62  226  226     30  128  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     D   155_B     D   155_B     62  226  226     18   82  158  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L   156_B     L   156_B     62  226  226     10   82  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     D   157_B     D   157_B     62  226  226     10   94  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     P   158_B     P   158_B     62  226  226      4   38  116  176  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     R   159_B     R   159_B     62  226  226      5   47  128  176  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     V   160_B     V   160_B     62  226  226      5  128  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     I   161_B     I   161_B     62  226  226     69  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     P   162_B     P   162_B     62  226  226     23  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     N   163_B     N   163_B     62  226  226     12  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     G   164_B     G   164_B     62  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E   165_B     E   165_B     62  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S   166_B     S   166_B     62  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     I   167_B     I   167_B     62  226  226     77  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     D   168_B     D   168_B     62  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     M   169_B     M   169_B     62  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     M   170_B     M   170_B     62  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     W   171_B     W   171_B     62  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E   172_B     E   172_B     62  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     R   173_B     R   173_B     62  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     A   174_B     A   174_B     62  226  226     79  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     K   175_B     K   175_B     62  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     P   176_B     P   176_B     62  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     Y   177_B     Y   177_B     62  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     F   178_B     F   178_B     62  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     I   179_B     I   179_B     62  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     D   180_B     D   180_B     62  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     Q   181_B     Q   181_B     62  226  226     69  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     I   182_B     I   182_B     62  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     V   183_B     V   183_B     62  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     P   184_B     P   184_B     62  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     R   185_B     R   185_B     62  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L   186_B     L   186_B     62  226  226     36  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     M   187_B     M   187_B     62  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E   188_B     E   188_B     62  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     G   189_B     G   189_B     62  226  226     36  130  159  184  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     K   190_B     K   190_B     62  226  226     32  130  159  184  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     K   191_B     K   191_B     62  226  226     77  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     V   192_B     V   192_B     62  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L   193_B     L   193_B     62  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     I   194_B     I   194_B     62  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     V   195_B     V   195_B     62  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     A   196_B     A   196_B     62  226  226     19  104  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     H   197_B     H   197_B     62  226  226     58  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     G   198_B     G   198_B     62  226  226     34  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     N   199_B     N   199_B     62  226  226     31  104  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     V   200_B     V   200_B     62  226  226     16  104  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     M   201_B     M   201_B     62  226  226     13   97  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     R   202_B     R   202_B     62  226  226     12   97  124  182  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     A   203_B     A   203_B     62  226  226     22   97  127  179  201  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     M   204_B     M   204_B     62  226  226     31  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     K   205_B     K   205_B     62  226  226     24  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     K   206_B     K   206_B     62  226  226     13  116  159  184  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     Y   207_B     Y   207_B     62  226  226     16  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L   208_B     L   208_B     62  226  226     80  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     Q   209_B     Q   209_B     62  226  226     49  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     K   210_B     K   210_B     62  226  226     24  130  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     M   211_B     M   211_B     62  226  226     11   78  155  184  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L   222_B     L   222_B     53  226  226      3    5   23   49  102  161  206  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S   223_B     S   223_B     39  226  226      3   14   38   92  151  205  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     N   224_B     N   224_B     22  226  226      4   22   52  100  171  215  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     G   225_B     G   225_B     22  226  226      4   22   47   94  161  212  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S   226_B     S   226_B     22  226  226      7   40   94  169  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     A   227_B     A   227_B     22  226  226     15   85  144  183  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L   228_B     L   228_B     22  226  226     27   89  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     V   229_B     V   229_B     22  226  226     29  123  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     F   230_B     F   230_B     22  226  226     23  118  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     K   231_B     K   231_B     22  226  226     11  103  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     F   232_B     F   232_B     22  226  226     10   92  159  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     D   233_B     D   233_B     19  226  226      9   28  135  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     N   234_B     N   234_B     19  226  226      9   22  120  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     K   235_B     K   235_B     19  226  226      9   18   41   72  173  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     F   236_B     F   236_B     19  226  226      9   16   42  164  203  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     N   237_B     N   237_B     19  226  226      9   18   53  101  199  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L   238_B     L   238_B     19  226  226     10   75  146  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L   239_B     L   239_B     19  226  226      9   62  144  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E   240_B     E   240_B     19  226  226      9   42  143  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     T   241_B     T   241_B     19  226  226     10   79  156  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E   242_B     E   242_B     19  226  226      5   62  136  186  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     I   243_B     I   243_B     19  226  226      9   67  130  182  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     I   244_B     I   244_B     19  226  226     21   88  146  183  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S   245_B     S   245_B     19  226  226      6   80  130  175  204  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E   246_B     E   246_B      4  226  226      3    3   56  156  203  219  220  222  223  226  226  226  226  226  226  226  226  226  226  226 
LCS_AVERAGE  LCS_A:  77.67  (  33.00  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     80    130    159    186    204    219    220    222    223    226    226    226    226    226    226    226    226    226    226    226 
GDT PERCENT_AT  35.40  57.52  70.35  82.30  90.27  96.90  97.35  98.23  98.67 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00
GDT RMS_LOCAL    0.35   0.55   0.76   1.09   1.28   1.47   1.49   1.53   1.56   1.83   1.83   1.83   1.83   1.83   1.83   1.83   1.83   1.83   1.83   1.83
GDT RMS_ALL_AT   1.99   1.97   1.96   1.88   1.85   1.85   1.85   1.85   1.85   1.83   1.83   1.83   1.83   1.83   1.83   1.83   1.83   1.83   1.83   1.83

# Checking swapping
#   possible swapping detected:  E    15_B      E    15_B
#   possible swapping detected:  F    17_B      F    17_B
#   possible swapping detected:  E    27_B      E    27_B
#   possible swapping detected:  Y    53_B      Y    53_B
#   possible swapping detected:  E   123_B      E   123_B
#   possible swapping detected:  D   155_B      D   155_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:  Y   207_B      Y   207_B
#   possible swapping detected:  E   242_B      E   242_B

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    R    11_B      R    11_B     8.783     0    0.598   1.205    10.341    1.548    3.766
LGA    K    12_B      K    12_B     8.736     0    0.627   1.227    14.647    2.500    1.481
LGA    K    13_B      K    13_B     8.509     0    0.619   0.905    16.314    5.952    2.646
LGA    I    14_B      I    14_B     3.733     0    0.612   0.595     4.615   43.452   45.298
LGA    E    15_B      E    15_B     2.907     0    0.056   0.662     4.752   57.262   50.476
LGA    P    16_B      P    16_B     2.471     0    0.030   0.359     4.062   62.857   55.578
LGA    F    17_B      F    17_B     1.730     0    0.029   0.086     1.910   72.857   79.957
LGA    S    18_B      S    18_B     1.453     0    0.058   0.661     1.575   79.286   78.571
LGA    T    19_B      T    19_B     1.360     0    0.043   0.125     1.490   81.429   81.429
LGA    L    20_B      L    20_B     1.189     0    0.047   0.077     1.288   83.690   82.560
LGA    V    21_B      V    21_B     0.667     0    0.050   0.057     0.724   90.476   90.476
LGA    I    22_B      I    22_B     0.554     0    0.105   0.298     1.369   88.214   91.726
LGA    L    23_B      L    23_B     0.498     0    0.047   1.049     3.553   95.238   83.750
LGA    R    24_B      R    24_B     0.866     0    0.018   0.597     1.456   90.476   85.541
LGA    H    25_B      H    25_B     0.604     0    0.070   0.136     1.231   95.238   90.571
LGA    G    26_B      G    26_B     0.548     0    0.098   0.098     0.705   95.238   95.238
LGA    E    27_B      E    27_B     1.222     0    0.042   0.097     1.886   81.429   77.619
LGA    S    28_B      S    28_B     1.075     0    0.038   0.114     1.116   81.429   84.444
LGA    L    29_B      L    29_B     1.094     0    0.020   0.922     3.551   83.690   78.929
LGA    S    30_B      S    30_B     0.879     0    0.064   0.076     1.148   85.952   89.048
LGA    N    31_B      N    31_B     1.057     0    0.030   1.191     3.933   81.429   73.512
LGA    L    32_B      L    32_B     1.438     0    0.067   1.368     4.267   77.143   70.595
LGA    N    33_B      N    33_B     1.504     0    0.024   0.808     2.392   75.000   72.976
LGA    R    34_B      R    34_B     1.524     0    0.053   1.288     5.065   77.143   64.892
LGA    T    35_B      T    35_B     0.763     0    0.048   0.073     1.073   85.952   86.599
LGA    Y    36_B      Y    36_B     0.802     0    0.112   0.578     2.800   90.476   76.944
LGA    S    37_B      S    37_B     0.531     0    0.026   0.585     1.368   95.238   92.143
LGA    G    38_B      G    38_B     0.290     0    0.058   0.058     0.388  100.000  100.000
LGA    W    39_B      W    39_B     0.334     0    0.029   0.065     0.708  100.000   94.558
LGA    Y    40_B      Y    40_B     0.392     0    0.037   0.091     1.305   95.238   91.349
LGA    D    41_B      D    41_B     0.588     0    0.014   0.101     1.128   90.476   89.345
LGA    T    42_B      T    42_B     0.777     0    0.019   0.055     0.864   90.476   90.476
LGA    D    43_B      D    43_B     0.823     0    0.034   0.053     1.271   88.214   85.952
LGA    L    44_B      L    44_B     1.100     0    0.015   0.045     1.423   81.429   83.690
LGA    T    45_B      T    45_B     1.675     0    0.044   0.079     1.838   75.000   74.082
LGA    E    46_B      E    46_B     1.405     0    0.035   0.933     4.984   81.429   67.196
LGA    K    47_B      K    47_B     1.376     0    0.032   0.784     3.403   81.429   75.132
LGA    G    48_B      G    48_B     1.505     0    0.030   0.030     1.514   77.143   77.143
LGA    I    49_B      I    49_B     1.333     0    0.037   0.063     1.437   81.429   81.429
LGA    E    50_B      E    50_B     1.131     0    0.025   0.117     1.268   81.429   81.429
LGA    D    51_B      D    51_B     1.320     0    0.047   0.098     1.725   81.429   78.214
LGA    A    52_B      A    52_B     1.280     0    0.034   0.031     1.394   83.690   83.238
LGA    Y    53_B      Y    53_B     0.839     0    0.046   1.402     7.527   90.595   59.802
LGA    A    54_B      A    54_B     0.774     0    0.040   0.039     0.944   90.476   90.476
LGA    A    55_B      A    55_B     0.932     0    0.030   0.072     0.992   90.476   90.476
LGA    G    56_B      G    56_B     0.450     0    0.026   0.026     0.657   97.619   97.619
LGA    R    57_B      R    57_B     0.409     0    0.027   1.626     8.060   92.976   63.593
LGA    L    58_B      L    58_B     1.178     0    0.041   0.763     3.310   83.690   73.512
LGA    L    59_B      L    59_B     0.831     0    0.015   0.328     1.780   88.214   87.143
LGA    K    60_B      K    60_B     0.867     0    0.024   0.645     2.319   85.952   79.894
LGA    S    61_B      S    61_B     1.347     0    0.061   0.072     1.829   77.143   78.571
LGA    H    62_B      H    62_B     1.502     0    0.031   0.133     1.673   77.143   77.143
LGA    G    63_B      G    63_B     1.291     0    0.024   0.024     1.315   81.429   81.429
LGA    F    64_B      F    64_B     0.885     0    0.027   0.152     1.210   90.476   88.009
LGA    H    65_B      H    65_B     0.216     0    0.125   0.134     0.955   97.619   95.238
LGA    F    66_B      F    66_B     0.463     0    0.078   0.113     0.757   95.238   95.671
LGA    D    67_B      D    67_B     0.770     0    0.027   0.097     1.015   90.476   89.345
LGA    V    68_B      V    68_B     0.559     0    0.037   0.052     0.787   90.476   90.476
LGA    C    69_B      C    69_B     0.663     0    0.014   0.757     3.083   90.476   83.730
LGA    F    70_B      F    70_B     0.591     0    0.017   0.104     1.005   90.476   89.654
LGA    S    71_B      S    71_B     0.541     0    0.049   0.115     0.896   95.238   93.651
LGA    S    72_B      S    72_B     0.520     0    0.029   0.083     0.672   90.476   90.476
LGA    Y    73_B      Y    73_B     0.649     0    0.037   0.906     2.694   95.238   82.698
LGA    L    74_B      L    74_B     0.271     0    0.032   0.091     0.455  100.000  100.000
LGA    K    75_B      K    75_B     0.716     0    0.052   0.665     2.654   90.476   79.101
LGA    R    76_B      R    76_B     0.585     0    0.039   0.108     0.644   90.476   94.805
LGA    S    77_B      S    77_B     0.586     0    0.024   0.678     2.427   90.476   86.190
LGA    I    78_B      I    78_B     0.702     0    0.028   0.108     0.908   90.476   90.476
LGA    R    79_B      R    79_B     0.882     0    0.040   0.071     1.317   90.476   85.541
LGA    T    80_B      T    80_B     0.792     0    0.023   0.078     0.965   90.476   90.476
LGA    M    81_B      M    81_B     0.630     0    0.026   0.167     0.965   90.476   90.476
LGA    W    82_B      W    82_B     0.796     0    0.027   0.121     1.840   90.476   82.211
LGA    I    83_B      I    83_B     0.989     0    0.064   0.070     1.535   90.476   84.881
LGA    V    84_B      V    84_B     0.480     0    0.029   0.056     0.745   97.619   95.918
LGA    L    85_B      L    85_B     0.390     0    0.039   0.081     0.621  100.000   96.429
LGA    D    86_B      D    86_B     0.748     0    0.036   0.109     0.948   90.476   90.476
LGA    V    87_B      V    87_B     0.683     0    0.041   0.150     0.881   90.476   90.476
LGA    L    88_B      L    88_B     0.620     0    0.069   0.803     2.624   90.476   85.179
LGA    D    89_B      D    89_B     0.593     0    0.034   0.855     3.023   92.857   82.202
LGA    Q    90_B      Q    90_B     0.447     0    0.064   0.092     0.734  100.000   95.767
LGA    M    91_B      M    91_B     0.435     0    0.019   0.079     0.808  100.000   95.238
LGA    H    92_B      H    92_B     0.513     0    0.014   0.123     0.513   95.238   98.095
LGA    I    93_B      I    93_B     0.702     0    0.075   1.238     3.014   90.476   79.881
LGA    Q    94_B      Q    94_B     0.803     0    0.063   0.754     1.841   90.476   86.614
LGA    T    95_B      T    95_B     0.511     0    0.057   1.162     2.807   92.857   84.558
LGA    I    96_B      I    96_B     0.320     0    0.028   0.632     2.473  100.000   95.595
LGA    S    97_B      S    97_B     0.442     0    0.017   0.040     0.908  100.000   96.825
LGA    N    98_B      N    98_B     0.205     0    0.058   1.143     4.526  100.000   78.214
LGA    W    99_B      W    99_B     0.184     0    0.038   0.169     0.765  100.000   97.959
LGA    R   100_B      R   100_B     0.204     0    0.039   0.129     0.628  100.000   98.268
LGA    L   101_B      L   101_B     0.444     0    0.026   0.158     0.737   95.238   96.429
LGA    N   102_B      N   102_B     0.319     0    0.027   0.084     0.655   97.619   98.810
LGA    E   103_B      E   103_B     0.507     0    0.033   0.085     0.899   92.857   92.593
LGA    C   104_B      C   104_B     0.989     0    0.009   0.743     1.381   90.476   87.460
LGA    H   105_B      H   105_B     1.125     0    0.036   0.142     1.250   81.429   81.429
LGA    F   106_B      F   106_B     1.177     0    0.049   0.297     1.431   81.429   81.429
LGA    G   107_B      G   107_B     1.286     0    0.043   0.043     1.304   83.690   83.690
LGA    L   108_B      L   108_B     0.703     0    0.081   0.093     0.968   90.476   92.857
LGA    L   109_B      L   109_B     0.639     0    0.033   0.156     1.201   90.476   89.345
LGA    T   110_B      T   110_B     0.559     0    0.025   0.057     0.960   95.238   93.197
LGA    G   111_B      G   111_B     0.265     0    0.135   0.135     0.265  100.000  100.000
LGA    M   112_B      M   112_B     0.279     0    0.023   0.097     0.978  100.000   95.238
LGA    N   113_B      N   113_B     0.575     0    0.029   0.053     1.586   95.238   87.262
LGA    K   114_B      K   114_B     0.871     4    0.024   0.050     1.217   90.476   49.259
LGA    E   115_B      E   115_B     1.406     4    0.048   0.052     1.912   81.429   44.286
LGA    Q   116_B      Q   116_B     1.419     0    0.022   0.146     1.599   79.286   79.524
LGA    I   117_B      I   117_B     0.880     0    0.019   0.633     1.796   88.214   87.143
LGA    C   118_B      C   118_B     0.597     0    0.044   0.041     1.198   85.952   87.460
LGA    T   119_B      T   119_B     2.386     0    0.025   0.089     3.433   61.190   58.435
LGA    T   120_B      T   120_B     3.027     0    0.053   1.021     5.353   51.786   52.109
LGA    L   121_B      L   121_B     2.628     0    0.665   0.982     6.066   67.143   57.381
LGA    T   122_B      T   122_B     3.680     0    0.106   1.124     6.098   48.452   39.184
LGA    E   123_B      E   123_B     3.463     0    0.030   0.684     6.144   50.119   36.561
LGA    E   124_B      E   124_B     3.085     0    0.080   1.137     6.339   55.476   41.481
LGA    E   125_B      E   125_B     2.191     0    0.014   0.395     3.984   68.810   63.386
LGA    L   126_B      L   126_B     1.334     0    0.023   0.177     2.179   79.286   74.048
LGA    N   127_B      N   127_B     1.256     0    0.023   0.308     1.572   81.429   80.357
LGA    I   128_B      I   128_B     2.079     0    0.116   0.170     3.176   66.786   60.179
LGA    W   129_B      W   129_B     2.015     0    0.028   0.975     7.871   64.881   39.456
LGA    K   130_B      K   130_B     2.039     0    0.016   1.030     3.889   66.786   62.540
LGA    K   131_B      K   131_B     2.202     0    0.028   1.164     6.253   62.976   54.815
LGA    D   132_B      D   132_B     2.807     0    0.169   0.789     5.093   62.857   49.524
LGA    T   133_B      T   133_B     2.106     0    0.236   0.252     3.651   72.976   62.177
LGA    C   134_B      C   134_B     1.988     0    0.017   0.103     3.743   70.833   63.968
LGA    L   135_B      L   135_B     2.184     0    0.027   0.092     3.804   70.952   61.429
LGA    Q   136_B      Q   136_B     0.512     0    0.080   1.129     2.940   85.952   77.989
LGA    P   137_B      P   137_B     1.354     0    0.045   0.109     1.421   81.429   84.014
LGA    P   138_B      P   138_B     1.660     0    0.050   0.282     1.916   77.143   75.306
LGA    P   139_B      P   139_B     1.637     0    0.115   0.174     2.122   79.405   75.442
LGA    C   140_B      C   140_B     1.508     0    0.116   0.799     2.500   70.833   73.095
LGA    A   141_B      A   141_B     2.835     0    0.102   0.134     3.849   64.881   60.571
LGA    P   142_B      P   142_B     2.707     0    0.304   0.333     4.102   59.048   51.429
LGA    G   143_B      G   143_B     2.542     0    0.679   0.679     2.790   65.119   65.119
LGA    Q   144_B      Q   144_B     2.428     0    0.617   0.672     9.971   63.571   34.762
LGA    E   145_B      E   145_B     1.623     0    0.027   0.572     7.436   77.381   49.947
LGA    N   146_B      N   146_B     1.289     0    0.197   1.167     6.525   81.548   57.143
LGA    P   147_B      P   147_B     1.621     0    0.106   0.390     1.654   75.000   75.306
LGA    S   148_B      S   148_B     2.509     0    0.041   0.130     3.611   64.881   57.698
LGA    D   149_B      D   149_B     1.283     0    0.027   1.233     4.046   83.690   68.155
LGA    D   150_B      D   150_B     0.639     0    0.038   0.195     1.230   90.476   89.345
LGA    P   151_B      P   151_B     1.277     0    0.091   0.318     1.642   81.429   78.980
LGA    K   152_B      K   152_B     1.123     0    0.027   0.684     2.872   81.429   75.979
LGA    Y   153_B      Y   153_B     1.125     0    0.023   0.078     1.242   81.429   86.706
LGA    K   154_B      K   154_B     1.185     0    0.059   1.032     5.500   81.429   66.667
LGA    D   155_B      D   155_B     1.739     0    0.063   0.070     2.086   70.833   70.833
LGA    L   156_B      L   156_B     1.661     0    0.026   1.112     4.235   75.000   70.655
LGA    D   157_B      D   157_B     1.542     0    0.182   0.950     2.449   75.000   76.131
LGA    P   158_B      P   158_B     2.833     0    0.020   0.120     3.865   59.048   54.286
LGA    R   159_B      R   159_B     2.732     0    0.052   0.874     4.959   60.952   47.056
LGA    V   160_B      V   160_B     1.186     0    0.114   0.899     1.764   81.548   81.565
LGA    I   161_B      I   161_B     0.524     0    0.127   0.135     1.271   92.857   90.536
LGA    P   162_B      P   162_B     0.756     0    0.042   0.193     1.051   90.476   89.184
LGA    N   163_B      N   163_B     0.879     0    0.476   0.779     3.515   86.429   72.083
LGA    G   164_B      G   164_B     0.847     0    0.265   0.265     1.381   88.214   88.214
LGA    E   165_B      E   165_B     0.658     0    0.044   0.407     1.086   90.476   89.471
LGA    S   166_B      S   166_B     0.835     0    0.026   0.119     0.973   90.476   90.476
LGA    I   167_B      I   167_B     0.927     0    0.011   0.073     1.973   90.476   84.881
LGA    D   168_B      D   168_B     0.941     0    0.071   0.134     1.816   90.476   82.738
LGA    M   169_B      M   169_B     0.666     0    0.027   0.778     3.274   90.476   81.250
LGA    M   170_B      M   170_B     0.478     0    0.034   0.258     1.123   97.619   95.298
LGA    W   171_B      W   171_B     0.519     0    0.046   1.574     7.487   90.476   65.340
LGA    E   172_B      E   172_B     0.634     0    0.037   0.920     3.570   90.476   77.884
LGA    R   173_B      R   173_B     0.611     0    0.012   0.115     0.643   90.476   91.342
LGA    A   174_B      A   174_B     0.532     0    0.040   0.044     0.657   90.476   92.381
LGA    K   175_B      K   175_B     0.865     0    0.040   0.562     3.269   90.476   78.466
LGA    P   176_B      P   176_B     0.733     0    0.087   0.149     0.881   90.476   91.837
LGA    Y   177_B      Y   177_B     0.671     0    0.023   0.067     0.769   90.476   90.476
LGA    F   178_B      F   178_B     0.796     0    0.033   0.087     0.995   90.476   90.476
LGA    I   179_B      I   179_B     0.912     0    0.036   0.056     1.051   90.476   87.083
LGA    D   180_B      D   180_B     0.811     0    0.022   0.436     1.517   90.476   88.274
LGA    Q   181_B      Q   181_B     1.095     0    0.013   0.234     1.493   83.690   82.434
LGA    I   182_B      I   182_B     1.138     0    0.025   0.284     1.467   81.429   82.560
LGA    V   183_B      V   183_B     0.998     0    0.046   0.128     1.170   88.214   87.891
LGA    P   184_B      P   184_B     1.065     0    0.046   0.047     1.130   81.429   84.014
LGA    R   185_B      R   185_B     1.269     0    0.017   0.961     4.503   81.429   68.268
LGA    L   186_B      L   186_B     1.412     0    0.021   0.110     1.500   81.429   81.429
LGA    M   187_B      M   187_B     1.183     0    0.013   0.843     4.372   81.429   69.226
LGA    E   188_B      E   188_B     1.443     0    0.049   1.179     3.901   77.143   68.042
LGA    G   189_B      G   189_B     1.727     0    0.070   0.070     1.727   72.857   72.857
LGA    K   190_B      K   190_B     1.833     0    0.115   1.111     3.658   70.833   67.778
LGA    K   191_B      K   191_B     1.163     0    0.031   0.313     2.667   85.952   78.836
LGA    V   192_B      V   192_B     0.501     0    0.028   0.106     0.749   90.476   93.197
LGA    L   193_B      L   193_B     0.515     0    0.022   0.047     0.676   95.238   92.857
LGA    I   194_B      I   194_B     0.438     0    0.065   0.077     0.932  100.000   95.238
LGA    V   195_B      V   195_B     0.546     0    0.031   0.058     0.913   92.857   91.837
LGA    A   196_B      A   196_B     1.322     0    0.182   0.269     2.381   88.214   83.524
LGA    H   197_B      H   197_B     0.650     0    0.032   0.121     0.865   90.476   94.286
LGA    G   198_B      G   198_B     1.045     0    0.042   0.042     1.272   83.690   83.690
LGA    N   199_B      N   199_B     1.467     0    0.084   1.013     2.438   77.143   75.119
LGA    V   200_B      V   200_B     1.601     0    0.076   1.029     2.658   70.833   69.456
LGA    M   201_B      M   201_B     1.808     0    0.103   1.108     6.941   72.857   55.298
LGA    R   202_B      R   202_B     2.366     0    0.030   1.158     6.109   64.762   53.247
LGA    A   203_B      A   203_B     2.655     0    0.024   0.051     2.866   60.952   60.190
LGA    M   204_B      M   204_B     1.727     0    0.062   0.086     2.069   75.119   73.988
LGA    K   205_B      K   205_B     1.317     0    0.021   0.806     4.815   81.429   65.397
LGA    K   206_B      K   206_B     1.971     0    0.025   0.713     3.418   72.857   64.233
LGA    Y   207_B      Y   207_B     1.699     0    0.026   0.147     3.276   77.143   67.103
LGA    L   208_B      L   208_B     0.734     0    0.048   0.123     1.095   90.595   91.726
LGA    Q   209_B      Q   209_B     0.641     0    0.069   0.372     1.420   90.476   90.529
LGA    K   210_B      K   210_B     1.184     0    0.095   0.175     2.043   77.381   83.651
LGA    M   211_B      M   211_B     1.884     3    0.119   0.144     2.291   72.857   44.524
LGA    L   222_B      L   222_B     4.859     0    0.023   1.196     5.718   27.619   33.750
LGA    S   223_B      S   223_B     4.086     0    0.099   0.136     4.336   40.238   42.381
LGA    N   224_B      N   224_B     3.873     3    0.605   0.584     4.305   54.762   32.024
LGA    G   225_B      G   225_B     4.170     0    0.041   0.041     4.750   40.476   40.476
LGA    S   226_B      S   226_B     2.927     0    0.092   0.668     3.280   61.190   58.651
LGA    A   227_B      A   227_B     2.233     0    0.099   0.128     2.626   64.881   66.476
LGA    L   228_B      L   228_B     1.579     0    0.055   1.369     3.165   79.405   73.333
LGA    V   229_B      V   229_B     1.026     0    0.062   0.117     1.267   81.429   84.014
LGA    F   230_B      F   230_B     1.182     0    0.026   0.133     1.343   81.429   83.074
LGA    K   231_B      K   231_B     1.363     0    0.101   0.883     3.172   81.429   77.989
LGA    F   232_B      F   232_B     1.476     0    0.055   0.415     2.250   81.429   76.061
LGA    D   233_B      D   233_B     2.171     0    0.026   0.114     3.076   68.810   62.083
LGA    N   234_B      N   234_B     2.259     0    0.092   0.498     4.348   60.952   55.655
LGA    K   235_B      K   235_B     3.079     0    0.032   1.248     7.292   51.786   39.630
LGA    F   236_B      F   236_B     2.636     0    0.039   1.142     4.722   55.357   54.545
LGA    N   237_B      N   237_B     3.024     0    0.057   0.261     4.764   59.405   48.452
LGA    L   238_B      L   238_B     2.139     0    0.112   0.871     4.271   70.952   64.464
LGA    L   239_B      L   239_B     2.276     0    0.026   0.091     3.157   62.857   59.107
LGA    E   240_B      E   240_B     2.322     0    0.220   0.736     2.875   64.762   70.423
LGA    T   241_B      T   241_B     1.699     0    0.105   1.116     3.770   70.833   66.327
LGA    E   242_B      E   242_B     2.018     0    0.047   0.106     2.018   70.833   71.958
LGA    I   243_B      I   243_B     2.435     0    0.099   1.080     5.818   64.762   55.417
LGA    I   244_B      I   244_B     2.182     0    0.050   1.361     4.056   62.857   62.440
LGA    S   245_B      S   245_B     2.623     0    0.142   0.497     3.047   64.881   59.921
LGA    E   246_B      E   246_B     2.510     4    0.547   0.569     3.199   62.976   33.545

# 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):     1.830          1.805                  2.360           80.431   75.670

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  258  226    4.0    222    1.53    84.513    92.055    13.587

LGA_LOCAL      RMSD:   1.534  Number of atoms:  222  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   1.848  Number of assigned atoms:  226 
Std_ASGN_ATOMS RMSD:   1.830  Standard rmsd on all 226 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.507416 * X  +   0.218671 * Y  +  -0.833494 * Z  +  73.672043
  Y_new =  -0.076563 * X  +  -0.974881 * Y  +  -0.209155 * Z  +   6.178617
  Z_new =  -0.858293 * X  +  -0.042313 * Y  +   0.511412 * Z  +   1.769316 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -2.991834  1.031934 -0.082550   [DEG: -171.4195   59.1255   -4.7298 ]
ZXZ: -1.324936  1.033969 -1.620056   [DEG:  -75.9132   59.2421  -92.8224 ]
 
# END of job
