
#######################################################
#                                                     #
#                        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  222 ( 1667),  selected  222 , name one
# Molecule2: number of CA atoms  222 ( 1667),  selected  222 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:A  -ch2:D  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   222       1_D - 222_D       4.40     4.40
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   130       1_D - 130_D       1.85     8.48
  LCS_AVERAGE:     54.45

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   102       1_D - 102_D       0.99     9.89
  LONGEST_CONTINUOUS_SEGMENT:   102       2_D - 103_D       1.00     9.90
  LCS_AVERAGE:     42.55

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  222
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     Q     1_A     Q     1_D    102  130  222      6   43  108  119  125  132  138  147  155  169  179  191  204  210  216  218  219  220  221  222 
LCS_GDT     V     2_A     V     2_D    102  130  222     12   89  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     Q     3_A     Q     3_D    102  130  222     42   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     L     4_A     L     4_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     Q     5_A     Q     5_D    102  130  222     14   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     E     6_A     E     6_D    102  130  222     18   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     S     7_A     S     7_D    102  130  222     42   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     G     8_A     G     8_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     P     9_A     P     9_D    102  130  222     27   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     G    10_A     G    10_D    102  130  222     16   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     L    11_A     L    11_D    102  130  222     40   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     L    12_A     L    12_D    102  130  222     29   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     K    13_A     K    13_D    102  130  222     33   98  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     P    14_A     P    14_D    102  130  222     24   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     S    15_A     S    15_D    102  130  222     42   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     E    16_A     E    16_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     T    17_A     T    17_D    102  130  222     27   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     L    18_A     L    18_D    102  130  222      4   48  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     S    19_A     S    19_D    102  130  222     31   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     L    20_A     L    20_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     T    21_A     T    21_D    102  130  222     41   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     C    22_A     C    22_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     E    23_A     E    23_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     V    24_A     V    24_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     S    25_A     S    25_D    102  130  222     43   99  109  119  125  132  138  147  154  164  175  184  201  210  216  218  219  220  221  222 
LCS_GDT     G    26_A     G    26_D    102  130  222     18   89  109  119  125  132  138  147  155  166  178  191  202  210  216  218  219  220  221  222 
LCS_GDT     A    27_A     A    27_D    102  130  222     18   92  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     S    28_A     S    28_D    102  130  222     21   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     I    29_A     I    29_D    102  130  222     24   86  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     S    30_A     S    30_D    102  130  222      7   58  107  117  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     S    31_A     S    31_D    102  130  222      7   25  107  117  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     S    32_A     S    32_D    102  130  222      3    3   33   71  119  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     N    33_A     N    33_D    102  130  222      6   57  106  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     W    34_A     W    34_D    102  130  222     42   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     W    35_A     W    35_D    102  130  222     42   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     N    36_A     N    36_D    102  130  222     24   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     W    37_A     W    37_D    102  130  222     28   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     I    38_A     I    38_D    102  130  222     36   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     R    39_A     R    39_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     Q    40_A     Q    40_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     S    41_A     S    41_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     P    42_A     P    42_D    102  130  222     27   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     G    43_A     G    43_D    102  130  222      3   62  103  119  125  128  134  141  148  156  166  182  191  205  216  218  219  220  221  222 
LCS_GDT     K    44_A     K    44_D    102  130  222      3    4    5   46   88  121  126  129  136  140  148  167  180  187  196  207  217  220  221  222 
LCS_GDT     G    45_A     G    45_D    102  130  222     34   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     L    46_A     L    46_D    102  130  222     34   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     E    47_A     E    47_D    102  130  222     38   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     W    48_A     W    48_D    102  130  222     34   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     I    49_A     I    49_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     G    50_A     G    50_D    102  130  222     41   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     T    51_A     T    51_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     I    52_A     I    52_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     G    53_A     G    53_D    102  130  222     27   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     G    54_A     G    54_D    102  130  222     39   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     N    55_A     N    55_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  191  204  210  216  218  219  220  221  222 
LCS_GDT     S    56_A     S    56_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     G    57_A     G    57_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     K    58_A     K    58_D    102  130  222     41   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     I    59_A     I    59_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     A    60_A     A    60_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     S    61_A     S    61_D    102  130  222     42   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     S    62_A     S    62_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     P    63_A     P    63_D    102  130  222     27   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     S    64_A     S    64_D    102  130  222      4   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     L    65_A     L    65_D    102  130  222     42   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     E    66_A     E    66_D    102  130  222      4   62  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     S    67_A     S    67_D    102  130  222      3   74  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     R    68_A     R    68_D    102  130  222     27   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     V    69_A     V    69_D    102  130  222     27   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     I    70_A     I    70_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     M    71_A     M    71_D    102  130  222     28   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     S    72_A     S    72_D    102  130  222     30   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     K    73_A     K    73_D    102  130  222     37   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     D    74_A     D    74_D    102  130  222     43   99  109  119  125  132  138  147  155  169  179  191  204  210  216  218  219  220  221  222 
LCS_GDT     P    75_A     P    75_D    102  130  222     30   98  109  119  125  132  138  147  154  163  175  183  197  207  215  218  219  220  221  222 
LCS_GDT     S    76_A     S    76_D    102  130  222     43   99  109  119  125  132  138  147  154  161  171  181  194  206  215  218  219  220  221  222 
LCS_GDT     K    77_A     K    77_D    102  130  222     43   99  109  119  125  132  138  147  154  164  175  184  197  210  216  218  219  220  221  222 
LCS_GDT     N    78_A     N    78_D    102  130  222     31   99  109  119  125  132  138  147  154  164  175  184  197  210  216  218  219  220  221  222 
LCS_GDT     R    79_A     R    79_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     F    80_A     F    80_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     S    81_A     S    81_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     L    82_A     L    82_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     K    83_A     K    83_D    102  130  222     38   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     M    84_A     M    84_D    102  130  222     19   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     T    85_A     T    85_D    102  130  222     36   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     S    86_A     S    86_D    102  130  222     42   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     V    87_A     V    87_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     T    88_A     T    88_D    102  130  222     42   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     A    89_A     A    89_D    102  130  222     42   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     A    90_A     A    90_D    102  130  222     42   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     D    91_A     D    91_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     T    92_A     T    92_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     A    93_A     A    93_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     I    94_A     I    94_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     Y    95_A     Y    95_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     Y    96_A     Y    96_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     C    97_A     C    97_D    102  130  222     36   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     T    98_A     T    98_D    102  130  222     42   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     R    99_A     R    99_D    102  130  222     41   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     Q   100_A     Q   100_D    102  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     E   101_A     E   101_D    102  130  222     34   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     Q   102_A     Q   102_D    102  130  222     15   71  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     T   103_A     T   103_D    102  130  222      3   39  108  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     L   104_A     L   104_D     72  130  222      3    6   29  113  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     F   105_A     F   105_D      4  130  222      3    3    5    9   18   36  111  141  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     W   106_A     W   106_D      4  130  222      3    3   10   22   71  123  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     V   107_A     V   107_D     19  130  222      6   83  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     K   108_A     K   108_D     19  130  222     42   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     R   109_A     R   109_D     19  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     F   110_A     F   110_D     19  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     D   111_A     D   111_D     19  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     V   112_A     V   112_D     19  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     W   113_A     W   113_D     19  130  222     41   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     G   114_A     G   114_D     19  130  222     22   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     P   115_A     P   115_D     19  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     G   116_A     G   116_D     19  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     I   117_A     I   117_D     19  130  222     43   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     L   118_A     L   118_D     19  130  222     31   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     V   119_A     V   119_D     19  130  222     42   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     S   120_A     S   120_D     19  130  222     34   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     V   121_A     V   121_D     19  130  222     42   99  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     T   122_A     T   122_D     99  130  222     19   89  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     S   123_A     S   123_D    100  130  222     13   65  108  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     A   124_A     A   124_D    100  130  222     13   53  104  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     S   125_A     S   125_D    100  130  222      8   79   96  117  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     T   126_A     T   126_D    100  130  222     66   93   95  110  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     K   127_A     K   127_D    100  130  222     66   93   95   95  115  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     G   128_A     G   128_D    100  130  222     66   93   95   95   97  105  136  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     P   129_A     P   129_D    100  130  222     66   93   95   95   97  105  134  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     S   130_A     S   130_D    100  130  222     66   93   95   95   97  105  113  144  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     V   131_A     V   131_D    100  108  222     66   93   95   95   97  105  110  133  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     F   132_A     F   132_D    100  108  222     66   93   95   95   97  105  110  128  153  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     P   133_A     P   133_D    100  108  222     66   93   95   95   97  105  110  126  151  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     L   134_A     L   134_D    100  108  222     66   93   95   95   97  105  110  127  153  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     A   135_A     A   135_D    100  108  222     66   93   95   95   97  105  110  125  145  166  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     P   136_A     P   136_D    100  108  222     66   93   95   95   97  105  110  125  145  166  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     S   137_A     S   137_D    100  108  222     45   93   95   95   97  105  110  125  145  166  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     S   138_A     S   138_D    100  108  222      3    3   15   56   94   99  100  113  127  151  168  187  201  209  216  218  219  220  221  222 
LCS_GDT     E   139_A     E   139_D    100  108  222     23   93   95   95   97  105  110  125  144  166  179  193  204  210  216  218  219  220  221  222 
LCS_GDT     S   140_A     S   140_D    100  108  222     11   93   95   95   97  105  110  125  145  166  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     T   141_A     T   141_D    100  108  222     23   93   95   95   97  105  110  127  151  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     A   142_A     A   142_D    100  108  222     66   93   95   95   97  105  110  126  151  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     A   143_A     A   143_D    100  108  222     66   93   95   95   97  105  110  129  154  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     L   144_A     L   144_D    100  108  222     66   93   95   95   97  105  110  129  154  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     G   145_A     G   145_D    100  108  222     66   93   95   95   97  105  111  139  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     C   146_A     C   146_D    100  108  222     61   93   95   95   97  105  113  142  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     L   147_A     L   147_D    100  108  222     66   93   95   95   97  105  125  145  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     V   148_A     V   148_D    100  108  222     66   93   95   95   97  105  135  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     K   149_A     K   149_D    100  108  222     66   93   95   95   97  110  137  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     D   150_A     D   150_D    100  108  222     66   93   95   95   97  122  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     Y   151_A     Y   151_D    100  108  222     66   93   95   95  115  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     F   152_A     F   152_D    100  108  222     66   93   95  117  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     P   153_A     P   153_D    100  108  222     66   93  109  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     E   154_A     E   154_D    100  108  222     66   93  108  119  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     P   155_A     P   155_D    100  108  222     66   93   95   95  104  130  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     V   156_A     V   156_D    100  108  222     66   93   95   95   97  115  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     T   157_A     T   157_D    100  108  222     62   93   95   95   97  105  110  134  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     V   158_A     V   158_D    100  108  222     65   93   95   95   97  105  110  139  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     S   159_A     S   159_D    100  108  222     66   93   95   95   97  105  110  125  145  166  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     W   160_A     W   160_D    100  108  222     66   93   95   95   97  105  110  125  145  166  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     N   161_A     N   161_D    100  108  222     66   93   95   95   97  105  110  125  136  166  178  193  204  210  216  218  219  220  221  222 
LCS_GDT     S   162_A     S   162_D    100  108  222     66   93   95   95   97  105  110  125  135  147  172  187  203  210  216  218  219  220  221  222 
LCS_GDT     G   163_A     G   163_D    100  108  222     66   93   95   95   97  105  110  125  135  147  172  187  204  210  216  218  219  220  221  222 
LCS_GDT     S   164_A     S   164_D    100  108  222     66   93   95   95   97  105  110  125  135  147  172  187  203  210  216  218  219  220  221  222 
LCS_GDT     L   165_A     L   165_D    100  108  222     61   93   95   95   97  105  110  125  145  166  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     T   166_A     T   166_D    100  108  222     61   93   95   95   97  105  110  125  146  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     S   167_A     S   167_D    100  108  222     66   93   95   95   97  105  110  133  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     G   168_A     G   168_D    100  108  222     66   93   95   95   97  105  125  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     V   169_A     V   169_D    100  108  222     66   93   95   95   97  105  127  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     H   170_A     H   170_D    100  108  222     66   93   95   95   97  125  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     T   171_A     T   171_D    100  108  222     66   93   95   95  100  128  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     F   172_A     F   172_D    100  108  222     66   93   95   95  115  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     P   173_A     P   173_D    100  108  222     66   93   95  112  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     A   174_A     A   174_D    100  108  222     66   93   95   99  125  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     V   175_A     V   175_D    100  108  222     66   93   95   95   97  120  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     L   176_A     L   176_D    100  108  222     66   93   95   95   97  105  135  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     Q   177_A     Q   177_D    100  108  222     66   93   95   95   97  105  110  137  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     S   178_A     S   178_D    100  108  222     32   93   95   95   97  104  110  118  131  147  170  191  204  210  216  218  219  220  221  222 
LCS_GDT     S   179_A     S   179_D    100  108  222     32   93   95   95   97  105  110  125  148  168  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     G   180_A     G   180_D    100  108  222     64   93   95   95   97  104  110  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     L   181_A     L   181_D    100  108  222     66   93   95   95  115  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     Y   182_A     Y   182_D    100  108  222     66   93   95   95  120  132  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     S   183_A     S   183_D    100  108  222     66   93   95   95   97  128  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     L   184_A     L   184_D    100  108  222     66   93   95   95  105  129  138  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     S   185_A     S   185_D    100  108  222     66   93   95   95   97  110  137  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     S   186_A     S   186_D    100  108  222     66   93   95   95   97  105  134  147  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     V   187_A     V   187_D    100  108  222     66   93   95   95   97  105  125  146  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     V   188_A     V   188_D    100  108  222     66   93   95   95   97  105  117  143  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     T   189_A     T   189_D    100  108  222     66   93   95   95   97  105  111  139  155  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     V   190_A     V   190_D    100  108  222     66   93   95   95   97  105  110  127  151  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     P   191_A     P   191_D    100  108  222     66   93   95   95   97  105  110  126  146  167  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     S   192_A     S   192_D    100  108  222     65   93   95   95   97  105  110  125  145  166  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     S   193_A     S   193_D    100  108  222     66   93   95   95   97  105  110  125  144  166  178  193  204  210  216  218  219  220  221  222 
LCS_GDT     S   194_A     S   194_D    100  108  222      7   93   95   95   97  105  110  125  136  166  178  189  204  210  216  218  219  220  221  222 
LCS_GDT     L   195_A     L   195_D    100  108  222     66   93   95   95   97  105  110  125  143  166  178  193  204  210  216  218  219  220  221  222 
LCS_GDT     G   196_A     G   196_D    100  108  222     45   93   95   95   97  105  110  125  135  148  171  187  202  210  216  218  219  220  221  222 
LCS_GDT     T   197_A     T   197_D    100  108  222     65   93   95   95   97  105  110  122  133  144  161  178  192  207  214  218  219  220  221  222 
LCS_GDT     Q   198_A     Q   198_D    100  108  222     21   93   95   95   97  105  110  125  135  151  172  187  202  210  216  218  219  220  221  222 
LCS_GDT     T   199_A     T   199_D    100  108  222     50   93   95   95   97  105  110  125  136  166  178  189  204  210  216  218  219  220  221  222 
LCS_GDT     Y   200_A     Y   200_D    100  108  222     66   93   95   95   97  105  110  125  145  166  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     V   201_A     V   201_D    100  108  222     66   93   95   95   97  105  110  125  144  166  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     C   202_A     C   202_D    100  108  222     66   93   95   95   97  105  110  125  145  168  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     N   203_A     N   203_D    100  108  222     66   93   95   95   97  105  110  125  145  166  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     V   204_A     V   204_D    100  108  222     66   93   95   95   97  105  110  125  145  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     N   205_A     N   205_D    100  108  222     65   93   95   95   97  105  110  125  136  166  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     H   206_A     H   206_D    100  108  222     66   93   95   95   97  105  110  125  145  169  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     K   207_A     K   207_D    100  108  222     65   93   95   95   97  105  110  122  133  154  175  188  204  210  216  218  219  220  221  222 
LCS_GDT     P   208_A     P   208_D    100  108  222     52   93   95   95   97  102  110  120  135  158  176  190  204  210  216  218  219  220  221  222 
LCS_GDT     S   209_A     S   209_D    100  108  222     58   93   95   95   97  105  110  125  139  166  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     N   210_A     N   210_D    100  108  222     59   93   95   95   97  105  110  122  133  149  172  187  203  210  216  218  219  220  221  222 
LCS_GDT     T   211_A     T   211_D    100  108  222     65   93   95   95   97  105  110  125  136  166  178  193  204  210  216  218  219  220  221  222 
LCS_GDT     K   212_A     K   212_D    100  108  222     59   93   95   95   97  105  110  124  135  158  178  190  204  210  216  218  219  220  221  222 
LCS_GDT     V   213_A     V   213_D    100  108  222     65   93   95   95   97  105  110  125  144  166  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     D   214_A     D   214_D    100  108  222     66   93   95   95   97  105  110  125  144  166  178  193  204  210  216  218  219  220  221  222 
LCS_GDT     K   215_A     K   215_D    100  108  222     66   93   95   95   97  105  110  125  145  166  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     R   216_A     R   216_D    100  108  222     66   93   95   95   97  105  110  125  144  166  178  193  204  210  216  218  219  220  221  222 
LCS_GDT     V   217_A     V   217_D    100  108  222     61   93   95   95   97  105  110  125  145  166  181  193  204  210  216  218  219  220  221  222 
LCS_GDT     E   218_A     E   218_D    100  108  222     66   93   95   95   97  105  110  125  144  166  178  193  204  210  216  218  219  220  221  222 
LCS_GDT     I   219_A     I   219_D    100  108  222     66   93   95   95   97  105  110  125  136  166  178  190  204  210  216  218  219  220  221  222 
LCS_GDT     K   220_A     K   220_D    100  108  222      3   92   95   95   97  105  110  125  136  166  178  189  204  210  216  218  219  220  221  222 
LCS_GDT     A   221_A     A   221_D    100  108  222      3   14   62   87   97   99  102  109  114  131  140  151  162  178  191  206  213  219  221  222 
LCS_GDT     A   222_A     A   222_D    100  108  222      8   29   62   95   97   99  102  106  114  123  135  151  159  175  186  199  212  218  220  222 
LCS_AVERAGE  LCS_A:  65.67  (  42.55   54.45  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     66     99    109    119    125    132    138    147    155    169    181    193    204    210    216    218    219    220    221    222 
GDT PERCENT_AT  29.73  44.59  49.10  53.60  56.31  59.46  62.16  66.22  69.82  76.13  81.53  86.94  91.89  94.59  97.30  98.20  98.65  99.10  99.55 100.00
GDT RMS_LOCAL    0.30   0.60   0.70   0.91   1.09   1.52   1.78   2.19   2.64   3.12   3.50   3.72   3.93   4.04   4.18   4.22   4.25   4.29   4.34   4.40
GDT RMS_ALL_AT  12.18   9.86   9.76   9.55   9.29   8.25   7.73   6.84   5.68   4.92   4.48   4.44   4.42   4.42   4.41   4.41   4.41   4.41   4.40   4.40

# Checking swapping
#   possible swapping detected:  E    16_A      E    16_D
#   possible swapping detected:  E    66_A      E    66_D
#   possible swapping detected:  F   105_A      F   105_D
#   possible swapping detected:  F   152_A      F   152_D
#   possible swapping detected:  F   172_A      F   172_D
#   possible swapping detected:  E   218_A      E   218_D

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    Q     1_A      Q     1_D     2.082     0    0.605   1.169     8.064   65.119   36.349
LGA    V     2_A      V     2_D     1.921     0    0.048   0.972     3.044   70.833   69.660
LGA    Q     3_A      Q     3_D     1.832     0    0.087   0.474     1.997   72.857   72.857
LGA    L     4_A      L     4_D     1.900     0    0.046   0.098     2.109   68.810   74.048
LGA    Q     5_A      Q     5_D     2.438     0    0.049   0.624     3.408   64.762   60.582
LGA    E     6_A      E     6_D     2.245     0    0.069   0.396     3.126   62.857   63.175
LGA    S     7_A      S     7_D     1.721     0    0.113   0.647     2.909   75.000   71.667
LGA    G     8_A      G     8_D     1.954     0    0.048   0.048     2.749   64.881   64.881
LGA    P     9_A      P     9_D     2.628     0    0.177   0.261     3.073   57.262   57.211
LGA    G    10_A      G    10_D     2.535     0    0.421   0.421     3.337   59.167   59.167
LGA    L    11_A      L    11_D     1.396     0    0.074   0.137     1.669   79.286   84.940
LGA    L    12_A      L    12_D     1.241     0    0.050   0.133     1.906   81.429   78.214
LGA    K    13_A      K    13_D     1.161     0    0.097   1.167     5.398   81.429   65.926
LGA    P    14_A      P    14_D     1.187     0    0.051   0.394     1.546   79.286   78.980
LGA    S    15_A      S    15_D     1.213     0    0.119   0.595     3.178   79.286   74.762
LGA    E    16_A      E    16_D     1.354     0    0.144   1.008     2.561   75.119   73.122
LGA    T    17_A      T    17_D     1.532     0    0.133   0.159     1.707   75.000   77.755
LGA    L    18_A      L    18_D     2.335     0    0.041   1.088     4.843   70.952   61.905
LGA    S    19_A      S    19_D     1.411     0    0.079   0.666     1.896   77.143   75.714
LGA    L    20_A      L    20_D     1.141     0    0.037   0.068     1.543   83.690   81.488
LGA    T    21_A      T    21_D     1.129     0    0.020   0.953     2.923   81.429   76.735
LGA    C    22_A      C    22_D     1.219     0    0.052   0.059     1.436   81.429   82.937
LGA    E    23_A      E    23_D     1.960     0    0.038   0.533     2.337   72.857   76.825
LGA    V    24_A      V    24_D     1.715     0    0.031   0.083     2.101   70.833   74.150
LGA    S    25_A      S    25_D     2.382     0    0.253   0.696     4.208   64.762   58.889
LGA    G    26_A      G    26_D     2.073     0    0.081   0.081     2.198   66.786   66.786
LGA    A    27_A      A    27_D     1.485     0    0.043   0.043     1.622   77.143   78.000
LGA    S    28_A      S    28_D     1.651     0    0.082   0.732     3.986   75.000   69.365
LGA    I    29_A      I    29_D     2.102     0    0.069   1.474     5.274   64.762   57.500
LGA    S    30_A      S    30_D     2.578     0    0.480   0.405     4.013   54.048   52.698
LGA    S    31_A      S    31_D     2.410     0    0.501   0.692     3.351   61.071   58.571
LGA    S    32_A      S    32_D     2.807     0    0.356   0.704     5.048   63.214   51.746
LGA    N    33_A      N    33_D     2.590     0    0.565   0.740     8.774   73.214   42.381
LGA    W    34_A      W    34_D     0.705     0    0.078   0.261     3.005   90.595   74.218
LGA    W    35_A      W    35_D     0.674     0    0.057   0.133     0.885   90.476   92.517
LGA    N    36_A      N    36_D     0.969     0    0.044   0.067     1.209   85.952   87.083
LGA    W    37_A      W    37_D     0.859     0    0.032   0.085     0.898   90.476   90.476
LGA    I    38_A      I    38_D     0.935     0    0.056   0.107     1.148   90.476   87.083
LGA    R    39_A      R    39_D     1.252     0    0.033   0.252     1.491   81.429   81.429
LGA    Q    40_A      Q    40_D     1.820     0    0.066   0.151     2.458   68.810   67.460
LGA    S    41_A      S    41_D     2.367     0    0.149   0.656     3.792   59.167   57.460
LGA    P    42_A      P    42_D     2.188     0    0.686   0.579     2.188   66.786   68.231
LGA    G    43_A      G    43_D     4.321     0    0.168   0.168     6.197   29.405   29.405
LGA    K    44_A      K    44_D     6.490     0    0.683   1.087    15.790   30.952   14.074
LGA    G    45_A      G    45_D     2.057     0    0.195   0.195     3.694   57.500   57.500
LGA    L    46_A      L    46_D     1.490     0    0.072   0.134     1.704   75.000   78.214
LGA    E    47_A      E    47_D     1.398     0    0.109   0.321     1.607   79.286   79.524
LGA    W    48_A      W    48_D     0.958     0    0.028   0.123     1.430   88.214   84.014
LGA    I    49_A      I    49_D     0.877     0    0.040   0.165     0.928   90.476   90.476
LGA    G    50_A      G    50_D     0.952     0    0.023   0.023     0.952   90.476   90.476
LGA    T    51_A      T    51_D     0.778     0    0.027   0.087     1.099   88.214   89.252
LGA    I    52_A      I    52_D     0.897     0    0.038   1.115     2.541   85.952   77.619
LGA    G    53_A      G    53_D     1.860     0    0.097   0.097     2.185   68.810   68.810
LGA    G    54_A      G    54_D     2.082     0    0.080   0.080     2.625   64.881   64.881
LGA    N    55_A      N    55_D     2.089     0    0.030   1.419     6.933   68.810   52.024
LGA    S    56_A      S    56_D     1.946     0    0.111   0.128     2.102   75.000   72.937
LGA    G    57_A      G    57_D     1.567     0    0.062   0.062     1.799   75.000   75.000
LGA    K    58_A      K    58_D     1.499     0    0.110   0.457     2.242   81.548   74.921
LGA    I    59_A      I    59_D     1.440     0    0.027   0.144     2.282   79.286   75.060
LGA    A    60_A      A    60_D     1.421     0    0.037   0.048     1.768   81.429   79.714
LGA    S    61_A      S    61_D     0.990     0    0.079   0.664     2.860   83.690   78.889
LGA    S    62_A      S    62_D     1.289     0    0.059   0.620     2.112   77.143   75.794
LGA    P    63_A      P    63_D     2.461     0    0.018   0.352     2.799   60.952   67.551
LGA    S    64_A      S    64_D     2.748     0    0.094   0.598     3.019   60.952   58.492
LGA    L    65_A      L    65_D     1.692     0    0.251   0.964     2.611   66.905   69.107
LGA    E    66_A      E    66_D     2.158     0    0.629   1.282     5.997   56.548   47.037
LGA    S    67_A      S    67_D     1.732     0    0.316   0.308     2.304   75.000   71.587
LGA    R    68_A      R    68_D     1.791     0    0.388   0.998     2.702   77.143   74.589
LGA    V    69_A      V    69_D     1.230     0    0.049   0.156     2.100   79.286   76.599
LGA    I    70_A      I    70_D     1.018     0    0.084   1.532     3.181   88.214   74.881
LGA    M    71_A      M    71_D     1.208     0    0.103   0.825     3.273   79.286   73.274
LGA    S    72_A      S    72_D     1.450     0    0.041   0.075     1.669   81.429   80.000
LGA    K    73_A      K    73_D     1.491     0    0.105   0.824     4.121   75.119   70.847
LGA    D    74_A      D    74_D     2.228     0    0.105   0.933     5.071   64.881   56.310
LGA    P    75_A      P    75_D     2.963     0    0.070   0.161     3.486   53.571   54.082
LGA    S    76_A      S    76_D     2.861     0    0.151   0.667     3.237   55.357   58.492
LGA    K    77_A      K    77_D     2.628     0    0.163   1.246     7.432   57.143   47.778
LGA    N    78_A      N    78_D     2.883     0    0.055   0.913     4.476   59.048   52.917
LGA    R    79_A      R    79_D     1.766     0    0.047   1.707    10.705   72.976   44.935
LGA    F    80_A      F    80_D     0.953     0    0.051   0.097     1.135   85.952   90.563
LGA    S    81_A      S    81_D     0.704     0    0.030   0.043     0.821   95.238   93.651
LGA    L    82_A      L    82_D     0.310     0    0.062   1.112     4.346  100.000   87.560
LGA    K    83_A      K    83_D     0.715     0    0.027   0.638     4.734   90.476   78.095
LGA    M    84_A      M    84_D     1.553     0    0.047   0.195     4.412   77.143   62.202
LGA    T    85_A      T    85_D     1.178     0    0.038   0.975     3.012   81.429   75.714
LGA    S    86_A      S    86_D     1.334     0    0.031   0.085     1.392   81.429   81.429
LGA    V    87_A      V    87_D     1.404     0    0.029   0.929     2.581   81.429   75.578
LGA    T    88_A      T    88_D     1.347     0    0.094   1.150     3.372   81.429   74.558
LGA    A    89_A      A    89_D     1.830     0    0.038   0.039     2.049   70.833   71.238
LGA    A    90_A      A    90_D     1.920     0    0.040   0.050     1.925   72.857   72.857
LGA    D    91_A      D    91_D     1.412     0    0.028   0.201     1.629   79.286   79.286
LGA    T    92_A      T    92_D     1.795     0    0.065   1.071     2.882   72.857   69.456
LGA    A    93_A      A    93_D     1.809     0    0.014   0.037     1.809   72.857   72.857
LGA    I    94_A      I    94_D     1.792     0    0.037   1.151     2.861   72.857   67.917
LGA    Y    95_A      Y    95_D     1.207     0    0.084   0.100     1.423   81.429   81.429
LGA    Y    96_A      Y    96_D     1.164     0    0.000   0.173     3.135   81.429   70.556
LGA    C    97_A      C    97_D     1.071     0    0.074   0.145     1.299   83.690   82.937
LGA    T    98_A      T    98_D     1.066     0    0.049   1.146     3.380   81.429   72.449
LGA    R    99_A      R    99_D     1.022     0    0.096   0.515     2.217   79.286   78.355
LGA    Q   100_A      Q   100_D     0.529     0    0.042   1.164     3.712   92.857   82.328
LGA    E   101_A      E   101_D     0.419     0    0.131   0.598     2.074   97.619   84.921
LGA    Q   102_A      Q   102_D     1.282     0    0.215   1.031     5.050   83.690   68.148
LGA    T   103_A      T   103_D     1.345     0    0.508   1.234     4.470   79.524   68.163
LGA    L   104_A      L   104_D     2.165     0    0.212   1.007     4.502   57.381   51.369
LGA    F   105_A      F   105_D     5.095     0    0.641   1.040     8.162   30.595   19.004
LGA    W   106_A      W   106_D     3.577     0    0.098   0.978     4.808   56.548   51.429
LGA    V   107_A      V   107_D     1.431     0    0.480   0.984     5.601   83.690   61.565
LGA    K   108_A      K   108_D     0.811     0    0.134   0.696     1.801   90.476   82.593
LGA    R   109_A      R   109_D     0.293     0    0.049   1.153     7.046   95.238   62.684
LGA    F   110_A      F   110_D     1.001     0    0.037   0.198     1.176   88.214   83.896
LGA    D   111_A      D   111_D     0.856     0    0.024   0.949     2.933   85.952   76.548
LGA    V   112_A      V   112_D     1.659     0    0.039   1.091     3.489   72.857   67.347
LGA    W   113_A      W   113_D     1.670     0    0.048   0.129     1.976   72.857   75.918
LGA    G   114_A      G   114_D     1.985     0    0.039   0.039     1.985   72.857   72.857
LGA    P   115_A      P   115_D     2.348     0    0.707   0.847     5.308   51.429   54.966
LGA    G   116_A      G   116_D     1.999     0    0.163   0.163     2.417   68.810   68.810
LGA    I   117_A      I   117_D     1.929     0    0.050   0.561     3.592   72.857   69.226
LGA    L   118_A      L   118_D     2.164     0    0.123   0.212     2.592   62.857   62.857
LGA    V   119_A      V   119_D     1.439     0    0.058   0.152     1.596   75.000   77.755
LGA    S   120_A      S   120_D     1.580     0    0.039   0.108     1.651   75.000   75.714
LGA    V   121_A      V   121_D     1.595     0    0.020   1.054     3.627   77.143   72.313
LGA    T   122_A      T   122_D     1.163     0    0.084   0.193     1.566   83.690   81.497
LGA    S   123_A      S   123_D     1.577     0    0.065   0.161     2.335   75.000   71.587
LGA    A   124_A      A   124_D     1.805     0    0.035   0.063     2.074   77.143   74.667
LGA    S   125_A      S   125_D     1.546     0    0.047   0.740     3.901   75.000   69.365
LGA    T   126_A      T   126_D     2.265     0    0.100   0.149     3.396   66.786   60.612
LGA    K   127_A      K   127_D     2.953     0    0.070   1.028     7.865   53.571   44.233
LGA    G   128_A      G   128_D     4.778     0    0.003   0.003     4.973   32.857   32.857
LGA    P   129_A      P   129_D     5.492     0    0.054   0.184     6.769   20.714   21.701
LGA    S   130_A      S   130_D     7.119     0    0.101   0.093     7.396   12.619   11.746
LGA    V   131_A      V   131_D     8.157     0    0.018   0.070     9.330    4.048    4.422
LGA    F   132_A      F   132_D     9.563     0    0.049   0.078     9.865    1.310    1.385
LGA    P   133_A      P   133_D    10.494     0    0.000   0.435    11.254    0.000    0.000
LGA    L   134_A      L   134_D    10.553     0    0.024   0.924    11.275    0.000    1.488
LGA    A   135_A      A   135_D    12.948     0    0.048   0.082    14.042    0.000    0.000
LGA    P   136_A      P   136_D    13.043     0    0.134   0.319    13.533    0.000    0.000
LGA    S   137_A      S   137_D    14.519     0    0.452   0.804    17.993    0.000    0.000
LGA    S   138_A      S   138_D    16.871     0    0.641   0.621    17.408    0.000    0.000
LGA    E   139_A      E   139_D    15.936     0    0.215   1.146    17.922    0.000    0.000
LGA    S   140_A      S   140_D    15.127     0    0.459   0.927    17.142    0.000    0.000
LGA    T   141_A      T   141_D    12.090     0    0.160   1.214    12.798    0.000    0.000
LGA    A   142_A      A   142_D    12.154     0    0.049   0.060    12.679    0.000    0.000
LGA    A   143_A      A   143_D    10.706     0    0.095   0.102    11.335    0.000    0.000
LGA    L   144_A      L   144_D    10.319     0    0.068   0.783    12.922    0.833    0.417
LGA    G   145_A      G   145_D     8.814     0    0.031   0.031     9.596    1.667    1.667
LGA    C   146_A      C   146_D     7.991     0    0.046   0.911     9.052    7.262    6.270
LGA    L   147_A      L   147_D     7.014     0    0.012   0.137     7.735   10.833   10.952
LGA    V   148_A      V   148_D     5.623     0    0.095   0.208     6.092   25.476   25.102
LGA    K   149_A      K   149_D     5.417     0    0.075   0.691     8.832   25.000   16.032
LGA    D   150_A      D   150_D     4.348     0    0.049   0.851     5.301   37.262   40.833
LGA    Y   151_A      Y   151_D     2.759     0    0.054   0.114     3.077   63.214   64.365
LGA    F   152_A      F   152_D     0.913     0    0.048   0.074     2.807   75.238   74.113
LGA    P   153_A      P   153_D     1.935     0    0.045   0.131     3.175   66.786   61.633
LGA    E   154_A      E   154_D     2.120     0    0.071   1.042     4.467   61.190   59.365
LGA    P   155_A      P   155_D     3.242     0    0.105   0.252     4.264   45.119   43.469
LGA    V   156_A      V   156_D     3.770     0    0.074   1.171     4.483   46.667   43.469
LGA    T   157_A      T   157_D     5.232     0    0.048   0.059     7.152   23.095   19.524
LGA    V   158_A      V   158_D     6.059     0    0.030   1.152     6.667   18.452   19.116
LGA    S   159_A      S   159_D     7.978     0    0.044   0.663     8.767    5.476    5.794
LGA    W   160_A      W   160_D     9.467     0    0.000   0.047    10.287    1.071    2.687
LGA    N   161_A      N   161_D    11.627     0    0.034   0.406    12.682    0.000    0.000
LGA    S   162_A      S   162_D    11.550     0    0.000   0.717    12.459    0.000    0.000
LGA    G   163_A      G   163_D    10.362     0    0.036   0.036    10.706    0.000    0.000
LGA    S   164_A      S   164_D    11.643     0    0.058   0.663    12.641    0.000    0.000
LGA    L   165_A      L   165_D     9.777     0    0.027   1.135    11.301    1.190    1.012
LGA    T   166_A      T   166_D     7.781     0    0.052   0.049     8.520    7.262    6.259
LGA    S   167_A      S   167_D     7.796     0    0.065   0.666     9.276    5.952    4.683
LGA    G   168_A      G   168_D     6.828     0    0.060   0.060     6.944   13.333   13.333
LGA    V   169_A      V   169_D     6.270     0    0.093   1.118     6.865   21.667   18.639
LGA    H   170_A      H   170_D     4.303     0    0.068   0.075     5.162   32.976   35.048
LGA    T   171_A      T   171_D     3.749     0    0.014   0.951     5.676   52.143   48.299
LGA    F   172_A      F   172_D     2.896     0    0.058   0.253     5.199   59.167   44.242
LGA    P   173_A      P   173_D     1.307     0    0.446   0.498     2.981   71.071   70.680
LGA    A   174_A      A   174_D     1.759     0    0.135   0.180     3.140   63.214   66.857
LGA    V   175_A      V   175_D     3.869     0    0.161   1.112     4.939   46.786   40.204
LGA    L   176_A      L   176_D     4.220     0    0.041   1.010     6.201   30.476   26.131
LGA    Q   177_A      Q   177_D     5.810     0    0.061   0.483     6.745   22.857   22.275
LGA    S   178_A      S   178_D     7.766     0    0.028   0.637    10.504    8.571    6.190
LGA    S   179_A      S   179_D     6.719     0    0.038   0.059     7.099   17.738   17.619
LGA    G   180_A      G   180_D     4.634     0    0.087   0.087     5.343   39.524   39.524
LGA    L   181_A      L   181_D     2.809     0    0.000   0.108     3.805   48.452   51.250
LGA    Y   182_A      Y   182_D     2.423     0    0.045   0.124     3.583   59.167   65.992
LGA    S   183_A      S   183_D     3.967     0    0.121   0.203     5.125   46.667   40.714
LGA    L   184_A      L   184_D     3.657     0    0.098   1.318     4.770   38.810   42.976
LGA    S   185_A      S   185_D     5.536     0    0.072   0.621     6.077   27.619   24.127
LGA    S   186_A      S   186_D     5.919     0    0.035   0.560     7.245   16.548   16.746
LGA    V   187_A      V   187_D     7.131     0    0.025   0.064     7.295   12.619   12.517
LGA    V   188_A      V   188_D     8.031     0    0.033   0.083     9.451    4.048    3.333
LGA    T   189_A      T   189_D     9.212     0    0.052   0.051     9.799    1.310    2.517
LGA    V   190_A      V   190_D    11.166     0    0.014   1.330    13.887    0.000    0.068
LGA    P   191_A      P   191_D    12.811     0    0.058   0.373    13.960    0.000    0.000
LGA    S   192_A      S   192_D    14.584     0    0.030   0.630    15.988    0.000    0.000
LGA    S   193_A      S   193_D    16.195     0    0.539   0.884    16.738    0.000    0.000
LGA    S   194_A      S   194_D    16.261     0    0.043   0.087    16.314    0.000    0.000
LGA    L   195_A      L   195_D    15.827     0    0.000   0.705    16.529    0.000    0.000
LGA    G   196_A      G   196_D    17.958     0    0.165   0.165    18.244    0.000    0.000
LGA    T   197_A      T   197_D    18.420     0    0.207   1.257    19.578    0.000    0.000
LGA    Q   198_A      Q   198_D    16.070     0    0.147   0.971    16.848    0.000    0.000
LGA    T   199_A      T   199_D    14.887     0    0.023   1.168    17.195    0.000    0.000
LGA    Y   200_A      Y   200_D    12.539     0    0.115   0.178    13.479    0.000    0.000
LGA    V   201_A      V   201_D    11.836     0    0.020   1.095    12.480    0.000    0.000
LGA    C   202_A      C   202_D     9.513     0    0.049   0.168    10.394    0.595    1.111
LGA    N   203_A      N   203_D     9.286     0    0.064   0.076    10.613    2.619    1.369
LGA    V   204_A      V   204_D     7.474     0    0.000   0.161     8.432    6.667    9.116
LGA    N   205_A      N   205_D     7.597     0    0.104   0.146     9.027   11.905    7.440
LGA    H   206_A      H   206_D     5.851     0    0.045   1.121     6.675   16.310   28.857
LGA    K   207_A      K   207_D     7.300     0    0.035   0.277     8.130   10.119    8.519
LGA    P   208_A      P   208_D     6.399     0    0.035   0.061     6.994   14.286   18.707
LGA    S   209_A      S   209_D     6.647     0    0.085   0.072     7.747   11.905   13.651
LGA    N   210_A      N   210_D     8.798     0    0.037   0.935    13.027    3.571    1.964
LGA    T   211_A      T   211_D     8.672     0    0.000   0.072     8.805    3.810    4.558
LGA    K   212_A      K   212_D     9.574     0    0.028   1.365    10.568    0.595    1.323
LGA    V   213_A      V   213_D     9.691     0    0.022   0.057     9.921    0.952    1.224
LGA    D   214_A      D   214_D    11.129     0    0.076   0.088    12.636    0.000    0.000
LGA    K   215_A      K   215_D    11.397     0    0.056   1.173    11.823    0.000    0.053
LGA    R   216_A      R   216_D    13.096     0    0.046   1.057    20.008    0.000    0.000
LGA    V   217_A      V   217_D    12.558     0    0.054   1.023    13.539    0.000    0.000
LGA    E   218_A      E   218_D    14.649     0    0.056   0.930    15.849    0.000    0.000
LGA    I   219_A      I   219_D    15.996     0    0.055   0.637    19.341    0.000    0.000
LGA    K   220_A      K   220_D    16.143     0    0.117   1.156    18.693    0.000    0.847
LGA    A   221_A      A   221_D    20.570     0    0.385   0.413    21.597    0.000    0.000
LGA    A   222_A      A   222_D    21.601     0    0.488   0.516    22.829    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      222     888    888  100.00    1667   1667  100.00               222
SUMMARY(RMSD_GDC):     4.403          4.434                  4.633           48.768   46.133

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  222  222    4.0    147    2.19    65.653    63.688     6.426

LGA_LOCAL      RMSD:   2.188  Number of atoms:  147  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   6.842  Number of assigned atoms:  222 
Std_ASGN_ATOMS RMSD:   4.403  Standard rmsd on all 222 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.038303 * X  +   0.119322 * Y  +   0.992117 * Z  + -119.394119
  Y_new =   0.569603 * X  +   0.813144 * Y  +  -0.119788 * Z  + -242.831085
  Z_new =  -0.821027 * X  +   0.569701 * Y  +  -0.036821 * Z  + -11.821253 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  1.503653  0.963207  1.635338   [DEG:   86.1530   55.1877   93.6980 ]
ZXZ:  1.450638  1.607625 -0.964184   [DEG:   83.1155   92.1101  -55.2437 ]
 
# END of job
