
#######################################################
#                                                     #
#                        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  249 ( 1930),  selected  230 , name one
# Molecule2: number of CA atoms  230 ( 1795),  selected  230 , 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:   230      15_B - 244_B       1.86     1.86
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   230      15_B - 244_B       1.86     1.86
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    87      30_B - 116_B       0.98     2.38
  LCS_AVERAGE:     25.93

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  230
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     A    15_B     A    15_B     50  230  230      4   59  119  169  188  204  219  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     F    16_B     F    16_B     50  230  230      6   73  130  174  195  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     Y    17_B     Y    17_B     50  230  230     22   73  137  176  195  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     E    18_B     E    18_B     50  230  230      7   63  120  171  191  207  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L    19_B     L    19_B     63  230  230      7   69  137  176  195  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     E    20_B     E    20_B     63  230  230      7   25  111  171  192  209  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     F    21_B     F    21_B     63  230  230     22   72  130  176  195  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     G    22_B     G    22_B     63  230  230     10   71  130  176  195  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     P    23_B     P    23_B     63  230  230     12   67  130  176  195  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     R    24_B     R    24_B     63  230  230     19   71  130  176  195  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     T    25_B     T    25_B     63  230  230     13   53  130  176  195  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     I    26_B     I    26_B     63  230  230     13   53  132  176  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     M    27_B     M    27_B     63  230  230     13   65  130  176  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     T    28_B     T    28_B     63  230  230     13   78  143  176  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L    29_B     L    29_B     74  230  230     21  107  163  180  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     A    30_B     A    30_B     87  230  230     27  110  163  180  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     N    31_B     N    31_B     87  230  230     21  125  163  182  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     F    32_B     F    32_B     87  230  230     56  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     P    33_B     P    33_B     87  230  230     56  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     D    34_B     D    34_B     87  230  230     62  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     D    35_B     D    35_B     87  230  230     66  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     V    36_B     V    36_B     87  230  230     52  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L    37_B     L    37_B     87  230  230     52  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     P    38_B     P    38_B     87  230  230     42  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L    39_B     L    39_B     87  230  230     45  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L    40_B     L    40_B     87  230  230     45  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     Q    41_B     Q    41_B     87  230  230     60  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     M    42_B     M    42_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     E    43_B     E    43_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     S    44_B     S    44_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L    45_B     L    45_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     M    46_B     M    46_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     T    47_B     T    47_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     F    48_B     F    48_B     87  230  230     72  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     E    49_B     E    49_B     87  230  230     67  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     A    50_B     A    50_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     M    51_B     M    51_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     A    52_B     A    52_B     87  230  230     63  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     Y    53_B     Y    53_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L    54_B     L    54_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     R    55_B     R    55_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     C    56_B     C    56_B     87  230  230     65  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     D    57_B     D    57_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     A    58_B     A    58_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L    59_B     L    59_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     V    60_B     V    60_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     E    61_B     E    61_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L    62_B     L    62_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     G    63_B     G    63_B     87  230  230     74  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     C    64_B     C    64_B     87  230  230     74  127  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     Y    65_B     Y    65_B     87  230  230     74  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     D    66_B     D    66_B     87  230  230     32  119  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     G    67_B     G    67_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     R    68_B     R    68_B     87  230  230     29  126  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     A    69_B     A    69_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L    70_B     L    70_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     E    71_B     E    71_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     I    72_B     I    72_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     A    73_B     A    73_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     R    74_B     R    74_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L    75_B     L    75_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L    76_B     L    76_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     N    77_B     N    77_B     87  230  230     74  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     A    78_B     A    78_B     87  230  230     74  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     R    79_B     R    79_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     Y    80_B     Y    80_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L    81_B     L    81_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     G    82_B     G    82_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     V    83_B     V    83_B     87  230  230     67  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     D    84_B     D    84_B     87  230  230     26  117  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L    85_B     L    85_B     87  230  230      7   67  128  180  195  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     D    86_B     D    86_B     87  230  230     28   65  138  180  195  206  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     Q    87_B     Q    87_B     87  230  230     28   77  146  183  195  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     R    88_B     R    88_B     87  230  230     28   65  126  175  195  206  219  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     A    89_B     A    89_B     87  230  230     28   80  153  183  195  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     I    90_B     I    90_B     87  230  230     28  106  162  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     E    91_B     E    91_B     87  230  230     28   87  154  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     T    92_B     T    92_B     87  230  230     28   68  149  183  195  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L    93_B     L    93_B     87  230  230     28  107  162  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     R    94_B     R    94_B     87  230  230     31  117  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     T    95_B     T    95_B     87  230  230     28   93  161  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     R    96_B     R    96_B     87  230  230     28   98  161  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     I    97_B     I    97_B     87  230  230     28  117  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     E    98_B     E    98_B     87  230  230     28  117  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     R    99_B     R    99_B     87  230  230     28   93  155  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     E   100_B     E   100_B     87  230  230     28  109  161  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     G   101_B     G   101_B     87  230  230     29  117  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     M   102_B     M   102_B     87  230  230     20  100  161  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     S   103_B     S   103_B     87  230  230     20  112  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     D   104_B     D   104_B     87  230  230     22  113  163  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     R   105_B     R   105_B     87  230  230     29  118  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     A   106_B     A   106_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     D   107_B     D   107_B     87  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     T   108_B     T   108_B     87  230  230     74  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     V   109_B     V   109_B     87  230  230     74  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     V   110_B     V   110_B     87  230  230     28  107  162  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     D   111_B     D   111_B     87  230  230     28  107  162  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     D   112_B     D   112_B     87  230  230     27  107  161  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     I   113_B     I   113_B     87  230  230     27  117  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L   114_B     L   114_B     87  230  230     31  115  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     N   115_B     N   115_B     87  230  230      6   35  128  183  195  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     H   116_B     H   116_B     87  230  230     20  117  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     T   117_B     T   117_B     79  230  230      3    7   14   43   62  106  176  219  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     R   118_B     R   118_B      4  230  230      3   14   19   42  134  162  200  219  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     R   119_B     R   119_B      4  230  230      3   20   52  118  170  193  211  223  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     G   120_B     G   120_B      4  230  230      3    3   32   43  150  179  210  223  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     A   121_B     A   121_B     24  230  230     13   80  140  175  195  209  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     S   122_B     S   122_B     28  230  230      4   24   77  166  195  209  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     V   123_B     V   123_B     28  230  230     56  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     G   124_B     G   124_B     28  230  230     62  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     S   125_B     S   125_B     28  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     R   126_B     R   126_B     28  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     A   127_B     A   127_B     28  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L   128_B     L   128_B     28  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     Y   129_B     Y   129_B     28  230  230     72  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L   130_B     L   130_B     28  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L   131_B     L   131_B     28  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     P   132_B     P   132_B     28  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     F   133_B     F   133_B     28  230  230     33  127  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     N   134_B     N   134_B     28  230  230     36  121  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L   135_B     L   135_B     28  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L   136_B     L   136_B     28  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     G   137_B     G   137_B     28  230  230     72  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     N   138_B     N   138_B     28  230  230     72  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     F   139_B     F   139_B     28  230  230     33  127  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     R   140_B     R   140_B     28  230  230     17  104  158  182  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     E   141_B     E   141_B     28  230  230     59  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     P   142_B     P   142_B     28  230  230     46  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     K   143_B     K   143_B     28  230  230     41  121  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     R   144_B     R   144_B     28  230  230     50  125  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L   145_B     L   145_B     28  230  230     47  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L   146_B     L   146_B     28  230  230     46  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     D   147_B     D   147_B     28  230  230     46  125  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     S   148_B     S   148_B     28  230  230     44  121  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L   149_B     L   149_B     28  230  230     34  111  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     A   150_B     A   150_B     28  230  230      5   50  109  176  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     E   151_B     E   151_B     25  230  230      5    9   56  147  192  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     R   152_B     R   152_B     24  230  230      5   25   66  176  195  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     S   153_B     S   153_B     28  230  230      3    4    4   57   97  205  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     V   154_B     V   154_B     28  230  230      4   56  127  177  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     A   155_B     A   155_B     28  230  230     74  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     A   156_B     A   156_B     28  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     V   157_B     V   157_B     28  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     V   158_B     V   158_B     28  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     S   159_B     S   159_B     28  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     V   160_B     V   160_B     28  230  230     74  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     F   161_B     F   161_B     28  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     G   162_B     G   162_B     28  230  230     74  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     D   163_B     D   163_B     28  230  230     58  127  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     S   164_B     S   164_B     28  230  230     60  127  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     A   165_B     A   165_B     28  230  230     53  125  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     E   166_B     E   166_B     28  230  230     25  127  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     A   167_B     A   167_B     28  230  230     25  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     T   168_B     T   168_B     28  230  230     25  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     R   169_B     R   169_B     28  230  230     25  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     V   170_B     V   170_B     28  230  230     25  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     R   171_B     R   171_B     28  230  230     24  127  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     Q   172_B     Q   172_B     28  230  230     21  112  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     S   173_B     S   173_B     28  230  230     25  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     Y   174_B     Y   174_B     28  230  230     30  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     Y   175_B     Y   175_B     28  230  230     25  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     R   176_B     R   176_B     28  230  230     25  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     R   177_B     R   177_B     28  230  230     25  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     C   178_B     C   178_B     28  230  230     25  128  164  182  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     G   179_B     G   179_B     28  230  230     24  111  163  182  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     V   180_B     V   180_B     43  230  230     27  125  163  182  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     Q   181_B     Q   181_B     43  230  230      9   22   45  111  192  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     G   182_B     G   182_B     56  230  230      5   73  143  177  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L   183_B     L   183_B     57  230  230     52  121  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     E   184_B     E   184_B     57  230  230     74  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L   185_B     L   185_B     57  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     H   186_B     H   186_B     57  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     T   187_B     T   187_B     57  230  230     19  118  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     R   188_B     R   188_B     57  230  230     43  112  157  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     D   189_B     D   189_B     57  230  230     18   81  134  169  195  209  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     D   190_B     D   190_B     57  230  230     35  106  157  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     G   191_B     G   191_B     57  230  230     52  127  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     T   192_B     T   192_B     57  230  230     47  122  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     V   193_B     V   193_B     57  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     F   194_B     F   194_B     57  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     T   195_B     T   195_B     57  230  230     69  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     G   196_B     G   196_B     57  230  230     32  114  163  182  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     S   197_B     S   197_B     57  230  230      6   46  139  175  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     D   198_B     D   198_B     57  230  230      6   87  156  178  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     G   199_B     G   199_B     57  230  230      7  100  156  179  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     F   200_B     F   200_B     57  230  230     34  128  164  182  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     Y   201_B     Y   201_B     57  230  230     46  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     S   202_B     S   202_B     57  230  230     74  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     R   203_B     R   203_B     57  230  230     69  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     S   204_B     S   204_B     57  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     Y   205_B     Y   205_B     57  230  230     60  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     S   206_B     S   206_B     57  230  230     61  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     R   207_B     R   207_B     57  230  230     53  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     A   208_B     A   208_B     57  230  230     72  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     C   209_B     C   209_B     57  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L   210_B     L   210_B     57  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     H   211_B     H   211_B     57  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     A   212_B     A   212_B     57  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L   213_B     L   213_B     57  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L   214_B     L   214_B     57  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     A   215_B     A   215_B     57  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     E   216_B     E   216_B     57  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     C   217_B     C   217_B     57  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     G   218_B     G   218_B     57  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L   219_B     L   219_B     57  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     T   220_B     T   220_B     57  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     V   221_B     V   221_B     57  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     V   222_B     V   222_B     57  230  230     74  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     R   223_B     R   223_B     57  230  230     74  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     S   224_B     S   224_B     57  230  230     11   80  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     A   225_B     A   225_B     57  230  230     31  125  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     S   226_B     S   226_B     57  230  230     22  121  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     N   227_B     N   227_B     57  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L   228_B     L   228_B     57  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     F   229_B     F   229_B     57  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     A   230_B     A   230_B     57  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     H   231_B     H   231_B     57  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     C   232_B     C   232_B     57  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     V   233_B     V   233_B     57  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     T   234_B     T   234_B     57  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     V   235_B     V   235_B     57  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     L   236_B     L   236_B     57  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     P   237_B     P   237_B     57  230  230     75  128  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     E   238_B     E   238_B     57  230  230     48  126  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     G   239_B     G   239_B     57  230  230     49  126  164  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     A   240_B     A   240_B     51  230  230      5   67  154  183  196  211  220  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     D   241_B     D   241_B     43  230  230      5   13   64  126  189  203  219  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     Q   242_B     Q   242_B     12  230  230      5   13   46  110  163  192  213  224  227  228  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     G   243_B     G   243_B     11  230  230      5   13   25   47   60   97  189  212  223  227  229  229  230  230  230  230  230  230  230  230 
LCS_GDT     F   244_B     F   244_B      4  230  230      0    4    4    6   12   22   33   72   95  140  207  211  230  230  230  230  230  230  230  230 
LCS_AVERAGE  LCS_A:  75.31  (  25.93  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     75    128    164    183    196    211    220    224    227    228    229    229    230    230    230    230    230    230    230    230 
GDT PERCENT_AT  32.61  55.65  71.30  79.57  85.22  91.74  95.65  97.39  98.70  99.13  99.57  99.57 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00
GDT RMS_LOCAL    0.34   0.62   0.82   1.00   1.14   1.36   1.50   1.59   1.68   1.70   1.75   1.75   1.86   1.86   1.86   1.86   1.86   1.86   1.86   1.86
GDT RMS_ALL_AT   1.92   1.87   1.89   1.96   1.88   1.87   1.87   1.86   1.87   1.86   1.86   1.86   1.86   1.86   1.86   1.86   1.86   1.86   1.86   1.86

# Checking swapping
#   possible swapping detected:  Y    17_B      Y    17_B
#   possible swapping detected:  E    43_B      E    43_B
#   possible swapping detected:  F    48_B      F    48_B
#   possible swapping detected:  Y    53_B      Y    53_B
#   possible swapping detected:  E    71_B      E    71_B
#   possible swapping detected:  D    84_B      D    84_B
#   possible swapping detected:  E    98_B      E    98_B
#   possible swapping detected:  Y   129_B      Y   129_B
#   possible swapping detected:  F   133_B      F   133_B
#   possible swapping detected:  F   139_B      F   139_B
#   possible swapping detected:  E   151_B      E   151_B
#   possible swapping detected:  F   161_B      F   161_B
#   possible swapping detected:  Y   175_B      Y   175_B
#   possible swapping detected:  D   189_B      D   189_B
#   possible swapping detected:  D   190_B      D   190_B
#   possible swapping detected:  F   194_B      F   194_B
#   possible swapping detected:  Y   201_B      Y   201_B
#   possible swapping detected:  Y   205_B      Y   205_B
#   possible swapping detected:  E   216_B      E   216_B
#   possible swapping detected:  F   229_B      F   229_B
#   possible swapping detected:  E   238_B      E   238_B
#   possible swapping detected:  D   241_B      D   241_B

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    A    15_B      A    15_B     3.997     0    0.101   0.103     4.204   43.333   42.095
LGA    F    16_B      F    16_B     3.123     0    0.040   0.121     3.324   50.000   57.316
LGA    Y    17_B      Y    17_B     2.980     0    0.184   0.511     3.956   51.905   59.683
LGA    E    18_B      E    18_B     3.760     0    0.099   0.453     4.488   43.452   41.323
LGA    L    19_B      L    19_B     3.017     0    0.035   1.386     5.691   50.000   43.393
LGA    E    20_B      E    20_B     3.521     0    0.602   0.555     4.716   42.024   42.063
LGA    F    21_B      F    21_B     3.320     0    0.212   0.183     3.956   48.333   46.970
LGA    G    22_B      G    22_B     3.084     0    0.142   0.142     3.329   50.000   50.000
LGA    P    23_B      P    23_B     2.874     0    0.069   0.316     3.784   53.571   53.129
LGA    R    24_B      R    24_B     2.904     0    0.032   0.821     4.550   57.143   52.857
LGA    T    25_B      T    25_B     2.865     0    0.036   0.083     3.442   59.048   56.190
LGA    I    26_B      I    26_B     2.394     0    0.040   0.689     4.789   64.762   56.845
LGA    M    27_B      M    27_B     2.428     0    0.109   0.830     3.128   64.762   62.202
LGA    T    28_B      T    28_B     2.403     0    0.025   0.056     2.899   66.786   62.653
LGA    L    29_B      L    29_B     1.750     0    0.061   1.045     3.994   70.833   65.179
LGA    A    30_B      A    30_B     1.797     0    0.042   0.046     2.042   77.143   74.667
LGA    N    31_B      N    31_B     1.302     0    0.038   0.189     1.923   83.690   80.417
LGA    F    32_B      F    32_B     0.737     0    0.081   0.477     1.818   88.214   84.805
LGA    P    33_B      P    33_B     0.684     0    0.068   0.079     0.921   90.476   90.476
LGA    D    34_B      D    34_B     0.568     0    0.081   0.249     1.119   92.857   89.405
LGA    D    35_B      D    35_B     0.461     0    0.052   0.237     0.736   92.857   95.238
LGA    V    36_B      V    36_B     0.872     0    0.059   0.142     1.410   88.214   86.599
LGA    L    37_B      L    37_B     0.895     0    0.037   0.264     1.720   90.476   86.012
LGA    P    38_B      P    38_B     0.880     0    0.106   0.126     1.037   90.476   89.184
LGA    L    39_B      L    39_B     0.942     0    0.082   0.927     4.606   90.476   71.905
LGA    L    40_B      L    40_B     0.868     0    0.076   1.100     5.018   90.476   73.929
LGA    Q    41_B      Q    41_B     0.521     0    0.027   0.745     2.424   95.238   86.772
LGA    M    42_B      M    42_B     0.097     0    0.018   0.101     0.968  100.000   97.619
LGA    E    43_B      E    43_B     0.385     0    0.034   0.184     0.557   97.619   97.884
LGA    S    44_B      S    44_B     0.316     0    0.031   0.052     0.565  100.000   98.413
LGA    L    45_B      L    45_B     0.281     0    0.033   0.073     0.783  100.000   97.619
LGA    M    46_B      M    46_B     0.467     0    0.032   0.615     1.593   97.619   93.036
LGA    T    47_B      T    47_B     0.429     0    0.020   0.075     0.760  100.000   95.918
LGA    F    48_B      F    48_B     0.445     0    0.014   1.172     4.959   97.619   73.983
LGA    E    49_B      E    49_B     0.599     0    0.036   0.686     2.676   95.238   83.016
LGA    A    50_B      A    50_B     0.436     0    0.027   0.027     0.635  100.000   98.095
LGA    M    51_B      M    51_B     0.673     0    0.021   0.227     1.502   90.476   88.274
LGA    A    52_B      A    52_B     0.874     0    0.091   0.098     1.223   88.214   88.667
LGA    Y    53_B      Y    53_B     0.307     0    0.100   1.303     8.704   97.619   59.206
LGA    L    54_B      L    54_B     0.405     0    0.045   0.061     0.692   97.619   94.048
LGA    R    55_B      R    55_B     0.661     0    0.036   1.115     3.983   92.857   78.701
LGA    C    56_B      C    56_B     0.914     0    0.099   0.158     1.310   88.214   87.460
LGA    D    57_B      D    57_B     0.417     0    0.050   0.169     0.553   97.619   98.810
LGA    A    58_B      A    58_B     0.508     0    0.053   0.067     0.799   92.857   92.381
LGA    L    59_B      L    59_B     0.166     0    0.028   0.049     0.394  100.000  100.000
LGA    V    60_B      V    60_B     0.287     0    0.177   0.180     0.808   97.619   98.639
LGA    E    61_B      E    61_B     0.409     0    0.074   0.145     0.707   97.619   97.884
LGA    L    62_B      L    62_B     0.441     0    0.030   0.095     0.537   95.238   97.619
LGA    G    63_B      G    63_B     0.779     0    0.054   0.054     0.779   90.476   90.476
LGA    C    64_B      C    64_B     0.897     0    0.048   0.085     0.938   90.476   90.476
LGA    Y    65_B      Y    65_B     0.761     0    0.075   1.264     9.033   90.476   52.183
LGA    D    66_B      D    66_B     1.119     0    0.149   0.173     2.580   88.214   78.571
LGA    G    67_B      G    67_B     0.452     0    0.211   0.211     0.850   95.238   95.238
LGA    R    68_B      R    68_B     1.180     0    0.117   0.588     3.383   79.524   68.225
LGA    A    69_B      A    69_B     0.341     0    0.123   0.123     0.496  100.000  100.000
LGA    L    70_B      L    70_B     0.386     0    0.035   0.091     0.782   97.619   95.238
LGA    E    71_B      E    71_B     0.451     0    0.018   0.591     2.437  100.000   87.037
LGA    I    72_B      I    72_B     0.422     0    0.040   0.067     0.592   97.619   98.810
LGA    A    73_B      A    73_B     0.369     0    0.051   0.059     0.409  100.000  100.000
LGA    R    74_B      R    74_B     0.362     0    0.059   0.679     3.673  100.000   82.987
LGA    L    75_B      L    75_B     0.469     0    0.102   0.112     0.768   92.857   96.429
LGA    L    76_B      L    76_B     0.452     0    0.070   0.150     1.108   97.619   94.107
LGA    N    77_B      N    77_B     0.353     0    0.039   0.060     0.532  100.000   98.810
LGA    A    78_B      A    78_B     0.530     0    0.042   0.051     0.595   92.857   92.381
LGA    R    79_B      R    79_B     0.505     0    0.128   1.305     6.309   90.595   63.896
LGA    Y    80_B      Y    80_B     0.272     0    0.080   0.182     0.791   97.619   96.032
LGA    L    81_B      L    81_B     0.218     0    0.037   0.177     0.617  100.000   98.810
LGA    G    82_B      G    82_B     0.369     0    0.041   0.041     0.857   95.238   95.238
LGA    V    83_B      V    83_B     0.837     0    0.038   0.054     1.108   88.214   87.891
LGA    D    84_B      D    84_B     1.643     0    0.088   0.119     3.041   67.262   72.202
LGA    L    85_B      L    85_B     2.948     0    0.069   0.419     4.528   53.810   51.369
LGA    D    86_B      D    86_B     3.231     0    0.099   0.649     4.379   57.262   52.917
LGA    Q    87_B      Q    87_B     2.992     0    0.084   1.140     5.281   53.571   49.312
LGA    R    88_B      R    88_B     3.442     0    0.051   0.679     5.430   50.000   38.831
LGA    A    89_B      A    89_B     2.760     0    0.020   0.029     3.022   57.262   57.238
LGA    I    90_B      I    90_B     2.198     0    0.060   0.124     2.498   66.786   69.881
LGA    E    91_B      E    91_B     2.583     0    0.023   0.315     3.553   57.143   54.021
LGA    T    92_B      T    92_B     2.889     0    0.019   0.047     3.206   57.143   54.082
LGA    L    93_B      L    93_B     2.137     0    0.025   0.080     2.409   64.762   70.952
LGA    R    94_B      R    94_B     1.846     0    0.032   0.252     2.574   68.810   68.485
LGA    T    95_B      T    95_B     2.421     0    0.047   0.090     2.644   64.762   62.585
LGA    R    96_B      R    96_B     2.347     0    0.033   0.359     2.403   64.762   67.706
LGA    I    97_B      I    97_B     1.762     0    0.033   0.060     1.956   72.857   77.143
LGA    E    98_B      E    98_B     1.814     0    0.026   1.142     5.483   68.810   55.397
LGA    R    99_B      R    99_B     2.586     0    0.022   0.167     3.925   59.048   52.727
LGA    E   100_B      E   100_B     2.298     0    0.022   0.068     2.481   64.762   65.661
LGA    G   101_B      G   101_B     1.875     0    0.186   0.186     1.994   72.857   72.857
LGA    M   102_B      M   102_B     1.849     0    0.092   0.669     1.982   75.000   79.524
LGA    S   103_B      S   103_B     1.398     0    0.066   0.664     1.737   81.548   81.587
LGA    D   104_B      D   104_B     1.663     0    0.130   0.992     4.126   70.833   61.548
LGA    R   105_B      R   105_B     1.325     0    0.315   1.362     5.334   77.262   65.887
LGA    A   106_B      A   106_B     0.499     0    0.048   0.047     0.711   92.857   92.381
LGA    D   107_B      D   107_B     0.460     0    0.042   0.043     0.611   95.238   94.048
LGA    T   108_B      T   108_B     0.677     0    0.083   0.130     0.901   90.476   90.476
LGA    V   109_B      V   109_B     0.868     0    0.062   1.025     2.376   85.952   80.544
LGA    V   110_B      V   110_B     2.003     0    0.196   0.187     2.878   64.881   63.741
LGA    D   111_B      D   111_B     2.082     0    0.034   0.114     2.602   68.810   65.833
LGA    D   112_B      D   112_B     2.287     0    0.095   0.422     2.692   64.762   65.893
LGA    I   113_B      I   113_B     1.714     0    0.139   0.197     2.057   70.833   77.262
LGA    L   114_B      L   114_B     1.730     0    0.113   0.469     2.444   68.810   77.619
LGA    N   115_B      N   115_B     2.833     0    0.208   0.407     4.548   64.881   51.071
LGA    H   116_B      H   116_B     1.661     0    0.600   1.084     2.891   70.833   70.619
LGA    T   117_B      T   117_B     5.076     0    0.478   0.410     7.567   36.071   25.986
LGA    R   118_B      R   118_B     5.379     0    0.300   0.267     8.335   26.310   18.528
LGA    R   119_B      R   119_B     4.844     0    0.507   1.274    14.506   38.810   15.801
LGA    G   120_B      G   120_B     4.765     0    0.436   0.436     5.896   30.357   30.357
LGA    A   121_B      A   121_B     2.990     0    0.670   0.625     4.337   52.262   50.476
LGA    S   122_B      S   122_B     3.046     0    0.512   0.519     5.026   57.381   48.810
LGA    V   123_B      V   123_B     0.996     0    0.200   0.295     1.600   86.071   88.027
LGA    G   124_B      G   124_B     0.822     0    0.067   0.067     0.822   90.476   90.476
LGA    S   125_B      S   125_B     0.460     0    0.139   0.228     0.896   92.857   95.238
LGA    R   126_B      R   126_B     0.617     0    0.083   0.093     1.456   90.476   87.186
LGA    A   127_B      A   127_B     0.517     0    0.053   0.068     0.882   92.857   94.286
LGA    L   128_B      L   128_B     0.504     0    0.018   0.568     1.422   97.619   92.917
LGA    Y   129_B      Y   129_B     0.553     0    0.067   0.133     0.921   92.857   91.270
LGA    L   130_B      L   130_B     0.287     0    0.036   0.065     0.351  100.000  100.000
LGA    L   131_B      L   131_B     0.179     0    0.015   0.092     0.704  100.000   96.429
LGA    P   132_B      P   132_B     0.335     0    0.060   0.125     0.819   97.619   95.918
LGA    F   133_B      F   133_B     1.027     0    0.549   1.099     4.009   78.214   68.225
LGA    N   134_B      N   134_B     1.261     0    0.152   1.240     3.976   81.429   74.643
LGA    L   135_B      L   135_B     0.726     0    0.041   0.106     1.039   90.476   89.345
LGA    L   136_B      L   136_B     0.418     0    0.070   0.148     0.915   95.238   95.238
LGA    G   137_B      G   137_B     0.934     0    0.153   0.153     0.937   90.476   90.476
LGA    N   138_B      N   138_B     0.670     0    0.134   0.902     2.451   90.476   85.060
LGA    F   139_B      F   139_B     1.276     0    0.098   0.152     1.685   77.143   82.338
LGA    R   140_B      R   140_B     2.055     0    0.042   1.655     9.978   70.833   41.472
LGA    E   141_B      E   141_B     0.915     0    0.050   0.222     2.559   88.214   77.090
LGA    P   142_B      P   142_B     0.726     0    0.084   0.368     2.087   90.476   85.510
LGA    K   143_B      K   143_B     1.143     0    0.070   1.150     4.143   83.690   75.714
LGA    R   144_B      R   144_B     0.942     0    0.056   1.589     6.486   88.214   64.675
LGA    L   145_B      L   145_B     0.809     0    0.036   0.119     0.848   90.476   91.667
LGA    L   146_B      L   146_B     0.812     0    0.017   0.155     0.970   90.476   90.476
LGA    D   147_B      D   147_B     1.031     0    0.045   0.222     1.540   83.690   81.488
LGA    S   148_B      S   148_B     1.084     0    0.105   0.605     2.151   81.429   78.651
LGA    L   149_B      L   149_B     1.217     0    0.105   1.354     3.311   77.143   72.202
LGA    A   150_B      A   150_B     2.507     0    0.059   0.065     3.167   59.048   57.238
LGA    E   151_B      E   151_B     3.424     0    0.225   0.636     7.938   50.000   34.550
LGA    R   152_B      R   152_B     3.061     0    0.654   1.107     8.786   44.167   34.545
LGA    S   153_B      S   153_B     3.707     0    0.399   0.739     7.186   57.619   42.937
LGA    V   154_B      V   154_B     2.267     0    0.690   0.654     5.991   66.905   49.524
LGA    A   155_B      A   155_B     0.657     0    0.043   0.052     0.952   92.857   92.381
LGA    A   156_B      A   156_B     0.324     0    0.053   0.050     0.407  100.000  100.000
LGA    V   157_B      V   157_B     0.279     0    0.022   0.084     0.332  100.000  100.000
LGA    V   158_B      V   158_B     0.364     0    0.084   0.105     0.617  100.000   98.639
LGA    S   159_B      S   159_B     0.464     0    0.073   0.573     1.967  100.000   95.476
LGA    V   160_B      V   160_B     0.735     0    0.075   1.091     2.570   90.476   80.952
LGA    F   161_B      F   161_B     0.550     0    0.024   0.289     2.162   90.476   85.801
LGA    G   162_B      G   162_B     0.921     0    0.037   0.037     1.055   85.952   85.952
LGA    D   163_B      D   163_B     1.286     0    0.088   1.195     3.368   81.429   74.286
LGA    S   164_B      S   164_B     1.439     0    0.030   0.039     1.439   81.429   81.429
LGA    A   165_B      A   165_B     1.564     0    0.021   0.023     1.754   75.000   74.571
LGA    E   166_B      E   166_B     1.332     0    0.023   1.231     4.103   81.429   69.577
LGA    A   167_B      A   167_B     1.155     0    0.088   0.093     1.433   81.429   81.429
LGA    T   168_B      T   168_B     1.174     0    0.042   1.065     2.831   83.690   78.027
LGA    R   169_B      R   169_B     1.126     0    0.026   1.204     6.692   81.429   57.879
LGA    V   170_B      V   170_B     1.001     0    0.026   0.058     1.086   81.429   85.306
LGA    R   171_B      R   171_B     1.221     0    0.051   1.119     8.409   81.429   53.117
LGA    Q   172_B      Q   172_B     1.485     0    0.030   0.363     2.568   81.429   73.122
LGA    S   173_B      S   173_B     1.107     0    0.017   0.702     2.290   81.429   78.651
LGA    Y   174_B      Y   174_B     0.960     0    0.026   0.253     1.411   88.214   83.690
LGA    Y   175_B      Y   175_B     1.099     0    0.076   0.186     2.065   81.429   77.897
LGA    R   176_B      R   176_B     1.205     0    0.021   0.173     1.968   81.429   78.312
LGA    R   177_B      R   177_B     1.047     0    0.026   1.083     3.124   81.429   79.394
LGA    C   178_B      C   178_B     1.168     0    0.215   0.221     1.492   81.429   81.429
LGA    G   179_B      G   179_B     1.666     0    0.239   0.239     1.666   83.929   83.929
LGA    V   180_B      V   180_B     1.250     0    0.106   0.141     2.679   71.190   75.578
LGA    Q   181_B      Q   181_B     3.597     0    0.125   0.466     8.350   53.690   33.651
LGA    G   182_B      G   182_B     2.370     0    0.139   0.139     2.987   66.905   66.905
LGA    L   183_B      L   183_B     1.124     0    0.049   1.354     3.129   81.548   76.548
LGA    E   184_B      E   184_B     0.684     0    0.034   0.834     2.693   90.476   77.354
LGA    L   185_B      L   185_B     1.014     0    0.037   0.917     3.619   88.214   75.952
LGA    H   186_B      H   186_B     0.855     0    0.066   1.449     7.046   85.952   57.000
LGA    T   187_B      T   187_B     1.700     0    0.027   0.085     2.488   77.143   72.993
LGA    R   188_B      R   188_B     2.186     0    0.055   1.295     6.210   62.976   56.537
LGA    D   189_B      D   189_B     3.260     0    0.051   0.301     4.589   53.571   45.417
LGA    D   190_B      D   190_B     2.147     0    0.221   0.238     2.507   64.881   64.821
LGA    G   191_B      G   191_B     1.380     0    0.037   0.037     1.658   77.143   77.143
LGA    T   192_B      T   192_B     1.645     0    0.113   1.067     2.834   72.976   68.435
LGA    V   193_B      V   193_B     0.904     0    0.037   0.114     1.259   88.214   87.891
LGA    F   194_B      F   194_B     0.711     0    0.047   0.411     2.362   90.476   82.468
LGA    T   195_B      T   195_B     0.258     0    0.106   1.076     3.126  100.000   86.463
LGA    G   196_B      G   196_B     1.398     0    0.026   0.026     1.779   77.143   77.143
LGA    S   197_B      S   197_B     2.631     0    0.020   0.060     3.094   59.048   57.222
LGA    D   198_B      D   198_B     2.099     0    0.141   1.252     3.965   64.762   63.095
LGA    G   199_B      G   199_B     1.823     0    0.043   0.043     1.897   77.143   77.143
LGA    F   200_B      F   200_B     1.078     0    0.050   0.120     1.622   79.286   79.091
LGA    Y   201_B      Y   201_B     0.925     0    0.049   1.366     9.274   90.476   53.571
LGA    S   202_B      S   202_B     0.360     0    0.052   0.067     0.716   92.857   95.238
LGA    R   203_B      R   203_B     1.037     0    0.085   1.383     7.128   88.214   68.182
LGA    S   204_B      S   204_B     0.766     0    0.219   0.573     2.720   90.476   84.921
LGA    Y   205_B      Y   205_B     1.126     0    0.056   0.325     2.012   81.429   76.468
LGA    S   206_B      S   206_B     1.067     0    0.042   0.073     1.102   81.429   84.444
LGA    R   207_B      R   207_B     1.118     0    0.025   1.243     4.533   85.952   75.455
LGA    A   208_B      A   208_B     0.613     0    0.052   0.055     0.745   92.857   92.381
LGA    C   209_B      C   209_B     0.670     0    0.035   0.033     1.250   90.476   88.968
LGA    L   210_B      L   210_B     0.577     0    0.055   0.155     1.222   95.238   90.595
LGA    H   211_B      H   211_B     0.386     0    0.025   1.100     2.450  100.000   90.095
LGA    A   212_B      A   212_B     0.583     0    0.017   0.021     0.782   92.857   92.381
LGA    L   213_B      L   213_B     0.792     0    0.031   1.405     3.014   90.476   80.119
LGA    L   214_B      L   214_B     0.522     0    0.081   0.096     0.603   95.238   96.429
LGA    A   215_B      A   215_B     0.572     0    0.026   0.031     0.693   90.476   90.476
LGA    E   216_B      E   216_B     0.670     0    0.020   0.232     0.944   90.476   90.476
LGA    C   217_B      C   217_B     0.445     0    0.034   0.733     3.315   97.619   88.492
LGA    G   218_B      G   218_B     0.683     0    0.164   0.164     0.707   90.476   90.476
LGA    L   219_B      L   219_B     0.350     0    0.109   0.163     0.850   97.619   95.238
LGA    T   220_B      T   220_B     0.392     0    0.033   0.170     0.883  100.000   98.639
LGA    V   221_B      V   221_B     0.440     0    0.033   0.068     0.685   95.238   93.197
LGA    V   222_B      V   222_B     0.652     0    0.153   1.116     2.842   88.214   80.748
LGA    R   223_B      R   223_B     0.674     0    0.036   0.749     4.719   92.857   73.117
LGA    S   224_B      S   224_B     1.535     0    0.239   0.579     2.616   71.071   70.317
LGA    A   225_B      A   225_B     0.878     0    0.045   0.055     0.889   90.476   90.476
LGA    S   226_B      S   226_B     1.133     0    0.175   0.645     3.042   77.262   73.413
LGA    N   227_B      N   227_B     0.588     0    0.073   0.872     3.609   92.857   78.393
LGA    L   228_B      L   228_B     0.481     0    0.053   0.120     0.910  100.000   95.238
LGA    F   229_B      F   229_B     0.498     0    0.157   0.139     1.365   97.619   88.961
LGA    A   230_B      A   230_B     0.560     0    0.048   0.056     1.026   97.619   94.381
LGA    H   231_B      H   231_B     0.388     0    0.053   0.954     3.078  100.000   87.714
LGA    C   232_B      C   232_B     0.346     0    0.027   0.057     0.453  100.000  100.000
LGA    V   233_B      V   233_B     0.373     0    0.056   1.099     2.235  100.000   89.932
LGA    T   234_B      T   234_B     0.315     0    0.042   0.059     0.495  100.000  100.000
LGA    V   235_B      V   235_B     0.528     0    0.059   0.096     0.528   95.238   94.558
LGA    L   236_B      L   236_B     0.432     0    0.080   0.101     1.064  100.000   94.107
LGA    P   237_B      P   237_B     0.495     0    0.051   0.084     1.128   92.976   93.265
LGA    E   238_B      E   238_B     1.113     0    0.626   0.837     4.312   68.452   66.772
LGA    G   239_B      G   239_B     1.062     0    0.039   0.039     2.159   77.381   77.381
LGA    A   240_B      A   240_B     2.341     0    0.047   0.064     2.783   62.976   63.333
LGA    D   241_B      D   241_B     3.941     0    0.043   0.527     6.575   43.452   33.274
LGA    Q   242_B      Q   242_B     4.759     0    0.067   1.319     7.465   27.857   28.148
LGA    G   243_B      G   243_B     6.587     0    0.673   0.673     7.901   12.262   12.262
LGA    F   244_B      F   244_B     9.579     0    0.310   1.350    13.242    0.833    0.303

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      230     920    920  100.00    1795   1795  100.00               230
SUMMARY(RMSD_GDC):     1.859          1.910                  2.562           80.517   75.957

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  249  230    4.0    224    1.59    83.152    90.927    13.281

LGA_LOCAL      RMSD:   1.587  Number of atoms:  224  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   1.865  Number of assigned atoms:  230 
Std_ASGN_ATOMS RMSD:   1.859  Standard rmsd on all 230 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.794027 * X  +  -0.574612 * Y  +   0.198350 * Z  +  11.978847
  Y_new =   0.487809 * X  +  -0.407611 * Y  +   0.771943 * Z  +  49.796112
  Z_new =  -0.362718 * X  +   0.709700 * Y  +   0.603955 * Z  + -16.335939 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  2.590690  0.371183  0.865721   [DEG:  148.4356   21.2672   49.6022 ]
ZXZ:  2.890085  0.922342 -0.472478   [DEG:  165.5897   52.8463  -27.0710 ]
 
# END of job
