
#######################################################
#                                                     #
#                        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       1.21     1.21
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   230      15_B - 244_B       1.21     1.21
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   226      15_B - 240_B       0.99     1.22
  LCS_AVERAGE:     96.96

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    226  230  230     82  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     F    16_B     F    16_B    226  230  230    109  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     Y    17_B     Y    17_B    226  230  230     93  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     E    18_B     E    18_B    226  230  230     82  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L    19_B     L    19_B    226  230  230     25  187  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     E    20_B     E    20_B    226  230  230     15  124  203  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     F    21_B     F    21_B    226  230  230     11   42  165  208  217  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     G    22_B     G    22_B    226  230  230     15  154  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     P    23_B     P    23_B    226  230  230     16  122  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     R    24_B     R    24_B    226  230  230     16  152  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     T    25_B     T    25_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     I    26_B     I    26_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     M    27_B     M    27_B    226  230  230     98  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     T    28_B     T    28_B    226  230  230     15  114  202  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L    29_B     L    29_B    226  230  230      6   15  128  203  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     A    30_B     A    30_B    226  230  230      6   20   94  166  212  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     N    31_B     N    31_B    226  230  230      6   66  173  204  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     F    32_B     F    32_B    226  230  230     14   95  201  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     P    33_B     P    33_B    226  230  230     29  154  207  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     D    34_B     D    34_B    226  230  230     74  187  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     D    35_B     D    35_B    226  230  230     84  187  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     V    36_B     V    36_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L    37_B     L    37_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     P    38_B     P    38_B    226  230  230    119  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L    39_B     L    39_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L    40_B     L    40_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     Q    41_B     Q    41_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     M    42_B     M    42_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     E    43_B     E    43_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     S    44_B     S    44_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L    45_B     L    45_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     M    46_B     M    46_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     T    47_B     T    47_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     F    48_B     F    48_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     E    49_B     E    49_B    226  230  230     90  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     A    50_B     A    50_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     M    51_B     M    51_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     A    52_B     A    52_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     Y    53_B     Y    53_B    226  230  230     84  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L    54_B     L    54_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     R    55_B     R    55_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     C    56_B     C    56_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     D    57_B     D    57_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     A    58_B     A    58_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L    59_B     L    59_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     V    60_B     V    60_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     E    61_B     E    61_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L    62_B     L    62_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     G    63_B     G    63_B    226  230  230    102  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     C    64_B     C    64_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     Y    65_B     Y    65_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     D    66_B     D    66_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     G    67_B     G    67_B    226  230  230    103  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     R    68_B     R    68_B    226  230  230     31   96  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     A    69_B     A    69_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L    70_B     L    70_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     E    71_B     E    71_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     I    72_B     I    72_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     A    73_B     A    73_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     R    74_B     R    74_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L    75_B     L    75_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L    76_B     L    76_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     N    77_B     N    77_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     A    78_B     A    78_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     R    79_B     R    79_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     Y    80_B     Y    80_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L    81_B     L    81_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     G    82_B     G    82_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     V    83_B     V    83_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     D    84_B     D    84_B    226  230  230     98  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L    85_B     L    85_B    226  230  230     63  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     D    86_B     D    86_B    226  230  230     53  187  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     Q    87_B     Q    87_B    226  230  230     63  186  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     R    88_B     R    88_B    226  230  230     71  187  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     A    89_B     A    89_B    226  230  230     66  187  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     I    90_B     I    90_B    226  230  230     95  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     E    91_B     E    91_B    226  230  230    115  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     T    92_B     T    92_B    226  230  230     33  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L    93_B     L    93_B    226  230  230     74  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     R    94_B     R    94_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     T    95_B     T    95_B    226  230  230     45  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     R    96_B     R    96_B    226  230  230     45  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     I    97_B     I    97_B    226  230  230    102  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     E    98_B     E    98_B    226  230  230     45  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     R    99_B     R    99_B    226  230  230     33   93  208  216  218  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     E   100_B     E   100_B    226  230  230     33   93  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     G   101_B     G   101_B    226  230  230     45  170  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     M   102_B     M   102_B    226  230  230     33  176  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     S   103_B     S   103_B    226  230  230     47  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     D   104_B     D   104_B    226  230  230     45  176  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     R   105_B     R   105_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     A   106_B     A   106_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     D   107_B     D   107_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     T   108_B     T   108_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     V   109_B     V   109_B    226  230  230    117  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     V   110_B     V   110_B    226  230  230     88  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     D   111_B     D   111_B    226  230  230     46  187  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     D   112_B     D   112_B    226  230  230     80  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     I   113_B     I   113_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L   114_B     L   114_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     N   115_B     N   115_B    226  230  230     65  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     H   116_B     H   116_B    226  230  230    115  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     T   117_B     T   117_B    226  230  230    115  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     R   118_B     R   118_B    226  230  230    109  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     R   119_B     R   119_B    226  230  230     41  187  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     G   120_B     G   120_B    226  230  230     21  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     A   121_B     A   121_B    226  230  230    114  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     S   122_B     S   122_B    226  230  230    102  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     V   123_B     V   123_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     G   124_B     G   124_B    226  230  230    119  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     S   125_B     S   125_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     R   126_B     R   126_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     A   127_B     A   127_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L   128_B     L   128_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     Y   129_B     Y   129_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L   130_B     L   130_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L   131_B     L   131_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     P   132_B     P   132_B    226  230  230     84  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     F   133_B     F   133_B    226  230  230     47  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     N   134_B     N   134_B    226  230  230    117  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L   135_B     L   135_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L   136_B     L   136_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     G   137_B     G   137_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     N   138_B     N   138_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     F   139_B     F   139_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     R   140_B     R   140_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     E   141_B     E   141_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     P   142_B     P   142_B    226  230  230     92  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     K   143_B     K   143_B    226  230  230     92  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     R   144_B     R   144_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L   145_B     L   145_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L   146_B     L   146_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     D   147_B     D   147_B    226  230  230    109  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     S   148_B     S   148_B    226  230  230    102  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L   149_B     L   149_B    226  230  230    102  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     A   150_B     A   150_B    226  230  230      7  104  200  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     E   151_B     E   151_B    226  230  230     10   41  116  194  214  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     R   152_B     R   152_B    226  230  230      3   39  129  199  218  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     S   153_B     S   153_B    226  230  230      3    4    5   14  101  126  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     V   154_B     V   154_B    226  230  230      0    5   78  152  217  224  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     A   155_B     A   155_B    226  230  230     84  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     A   156_B     A   156_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     V   157_B     V   157_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     V   158_B     V   158_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     S   159_B     S   159_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     V   160_B     V   160_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     F   161_B     F   161_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     G   162_B     G   162_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     D   163_B     D   163_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     S   164_B     S   164_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     A   165_B     A   165_B    226  230  230    118  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     E   166_B     E   166_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     A   167_B     A   167_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     T   168_B     T   168_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     R   169_B     R   169_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     V   170_B     V   170_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     R   171_B     R   171_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     Q   172_B     Q   172_B    226  230  230    113  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     S   173_B     S   173_B    226  230  230    113  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     Y   174_B     Y   174_B    226  230  230    116  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     Y   175_B     Y   175_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     R   176_B     R   176_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     R   177_B     R   177_B    226  230  230    114  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     C   178_B     C   178_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     G   179_B     G   179_B    226  230  230    117  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     V   180_B     V   180_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     Q   181_B     Q   181_B    226  230  230     66  175  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     G   182_B     G   182_B    226  230  230    102  186  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L   183_B     L   183_B    226  230  230    103  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     E   184_B     E   184_B    226  230  230    103  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L   185_B     L   185_B    226  230  230    115  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     H   186_B     H   186_B    226  230  230    114  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     T   187_B     T   187_B    226  230  230    109  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     R   188_B     R   188_B    226  230  230    109  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     D   189_B     D   189_B    226  230  230     47  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     D   190_B     D   190_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     G   191_B     G   191_B    226  230  230    112  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     T   192_B     T   192_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     V   193_B     V   193_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     F   194_B     F   194_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     T   195_B     T   195_B    226  230  230    102  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     G   196_B     G   196_B    226  230  230     43  186  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     S   197_B     S   197_B    226  230  230      4  170  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     D   198_B     D   198_B    226  230  230     38  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     G   199_B     G   199_B    226  230  230     30  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     F   200_B     F   200_B    226  230  230    102  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     Y   201_B     Y   201_B    226  230  230    114  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     S   202_B     S   202_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     R   203_B     R   203_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     S   204_B     S   204_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     Y   205_B     Y   205_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     S   206_B     S   206_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     R   207_B     R   207_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     A   208_B     A   208_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     C   209_B     C   209_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L   210_B     L   210_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     H   211_B     H   211_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     A   212_B     A   212_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L   213_B     L   213_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L   214_B     L   214_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     A   215_B     A   215_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     E   216_B     E   216_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     C   217_B     C   217_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     G   218_B     G   218_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L   219_B     L   219_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     T   220_B     T   220_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     V   221_B     V   221_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     V   222_B     V   222_B    226  230  230    103  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     R   223_B     R   223_B    226  230  230    103  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     S   224_B     S   224_B    226  230  230     88  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     A   225_B     A   225_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     S   226_B     S   226_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     N   227_B     N   227_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L   228_B     L   228_B    226  230  230    116  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     F   229_B     F   229_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     A   230_B     A   230_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     H   231_B     H   231_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     C   232_B     C   232_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     V   233_B     V   233_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     T   234_B     T   234_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     V   235_B     V   235_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     L   236_B     L   236_B    226  230  230    122  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     P   237_B     P   237_B    226  230  230    109  188  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     E   238_B     E   238_B    226  230  230     58  187  209  216  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     G   239_B     G   239_B    226  230  230      4   10   66  197  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     A   240_B     A   240_B    226  230  230      4   37   80  201  219  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     D   241_B     D   241_B    209  230  230      3    4    8   10   56   88  113  190  224  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     Q   242_B     Q   242_B      3  230  230      3    3    3   72  137  222  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     G   243_B     G   243_B      3  230  230      3    3   86  176  215  225  228  228  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_GDT     F   244_B     F   244_B      3  230  230      0    3    3    3    4   30   39  209  228  229  230  230  230  230  230  230  230  230  230  230 
LCS_AVERAGE  LCS_A:  98.99  (  96.96  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    122    188    209    216    219    225    228    228    228    229    230    230    230    230    230    230    230    230    230    230 
GDT PERCENT_AT  53.04  81.74  90.87  93.91  95.22  97.83  99.13  99.13  99.13  99.57 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00
GDT RMS_LOCAL    0.35   0.53   0.65   0.71   0.81   0.95   1.06   1.06   1.06   1.14   1.21   1.21   1.21   1.21   1.21   1.21   1.21   1.21   1.21   1.21
GDT RMS_ALL_AT   1.26   1.24   1.24   1.24   1.23   1.22   1.21   1.21   1.21   1.21   1.21   1.21   1.21   1.21   1.21   1.21   1.21   1.21   1.21   1.21

# Checking swapping
#   possible swapping detected:  F    16_B      F    16_B
#   possible swapping detected:  E    18_B      E    18_B
#   possible swapping detected:  E    20_B      E    20_B
#   possible swapping detected:  F    21_B      F    21_B
#   possible swapping detected:  F    32_B      F    32_B
#   possible swapping detected:  E    43_B      E    43_B
#   possible swapping detected:  F    48_B      F    48_B
#   possible swapping detected:  E    49_B      E    49_B
#   possible swapping detected:  Y    53_B      Y    53_B
#   possible swapping detected:  E    61_B      E    61_B
#   possible swapping detected:  Y    80_B      Y    80_B
#   possible swapping detected:  D    84_B      D    84_B
#   possible swapping detected:  E    91_B      E    91_B
#   possible swapping detected:  E    98_B      E    98_B
#   possible swapping detected:  E   100_B      E   100_B
#   possible swapping detected:  D   112_B      D   112_B
#   possible swapping detected:  F   133_B      F   133_B
#   possible swapping detected:  E   141_B      E   141_B
#   possible swapping detected:  Y   174_B      Y   174_B
#   possible swapping detected:  D   189_B      D   189_B
#   possible swapping detected:  D   190_B      D   190_B
#   possible swapping detected:  F   200_B      F   200_B
#   possible swapping detected:  Y   201_B      Y   201_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     0.782     0    0.123   0.126     1.362   88.214   86.857
LGA    F    16_B      F    16_B     0.514     0    0.018   0.158     0.934   95.238   92.208
LGA    Y    17_B      Y    17_B     0.600     0    0.079   0.155     0.958   90.476   94.444
LGA    E    18_B      E    18_B     0.844     0    0.024   0.157     1.365   88.214   86.455
LGA    L    19_B      L    19_B     1.194     0    0.067   0.192     1.948   83.690   78.274
LGA    E    20_B      E    20_B     1.812     0    0.191   0.260     2.989   66.905   63.175
LGA    F    21_B      F    21_B     2.601     0    0.267   0.413     5.368   69.048   46.277
LGA    G    22_B      G    22_B     1.450     0    0.047   0.047     1.839   79.286   79.286
LGA    P    23_B      P    23_B     1.505     0    0.017   0.025     1.757   77.143   75.306
LGA    R    24_B      R    24_B     1.407     0    0.130   0.939     7.306   79.286   56.667
LGA    T    25_B      T    25_B     0.463     0    0.109   0.732     2.665  100.000   85.102
LGA    I    26_B      I    26_B     0.431     0    0.034   0.592     1.855   97.619   93.036
LGA    M    27_B      M    27_B     0.570     0    0.047   0.088     1.448   90.595   88.274
LGA    T    28_B      T    28_B     1.711     0    0.045   0.945     2.890   70.952   69.524
LGA    L    29_B      L    29_B     2.818     0    0.024   0.764     3.627   53.571   53.690
LGA    A    30_B      A    30_B     3.423     0    0.082   0.078     3.765   50.000   48.667
LGA    N    31_B      N    31_B     2.630     0    0.050   0.187     2.797   60.952   61.905
LGA    F    32_B      F    32_B     1.870     0    0.022   0.596     2.658   68.810   67.056
LGA    P    33_B      P    33_B     1.476     0    0.069   0.103     1.580   81.548   79.048
LGA    D    34_B      D    34_B     1.076     0    0.072   0.331     2.199   88.333   82.798
LGA    D    35_B      D    35_B     0.906     0    0.071   0.219     2.642   90.476   76.726
LGA    V    36_B      V    36_B     0.337     0    0.103   1.239     2.540   97.619   86.122
LGA    L    37_B      L    37_B     0.561     0    0.032   1.360     3.455   92.857   81.190
LGA    P    38_B      P    38_B     0.560     0    0.082   0.105     0.795   90.476   90.476
LGA    L    39_B      L    39_B     0.528     0    0.022   0.100     0.825   92.857   91.667
LGA    L    40_B      L    40_B     0.525     0    0.016   0.171     0.826   92.857   92.857
LGA    Q    41_B      Q    41_B     0.459     0    0.021   0.642     2.313   97.619   87.831
LGA    M    42_B      M    42_B     0.066     0    0.020   0.103     0.612  100.000   97.619
LGA    E    43_B      E    43_B     0.389     0    0.052   0.203     0.600   97.619   97.884
LGA    S    44_B      S    44_B     0.437     0    0.040   0.040     0.633   97.619   95.238
LGA    L    45_B      L    45_B     0.370     0    0.057   0.087     1.067  100.000   94.107
LGA    M    46_B      M    46_B     0.353     0    0.019   0.581     1.579  100.000   94.226
LGA    T    47_B      T    47_B     0.386     0    0.013   0.059     0.689  100.000   97.279
LGA    F    48_B      F    48_B     0.346     0    0.020   0.390     1.108   97.619   94.848
LGA    E    49_B      E    49_B     0.594     0    0.048   0.149     2.663   97.619   83.175
LGA    A    50_B      A    50_B     0.469     0    0.019   0.018     0.577   97.619   96.190
LGA    M    51_B      M    51_B     0.526     0    0.027   0.611     1.418   97.619   92.917
LGA    A    52_B      A    52_B     0.332     0    0.022   0.024     0.540   97.619   98.095
LGA    Y    53_B      Y    53_B     0.625     0    0.020   0.109     2.379   92.857   82.460
LGA    L    54_B      L    54_B     0.383     0    0.041   0.073     0.909  100.000   95.238
LGA    R    55_B      R    55_B     0.327     0    0.027   1.331     6.943  100.000   71.688
LGA    C    56_B      C    56_B     0.404     0    0.057   0.132     0.640   97.619   98.413
LGA    D    57_B      D    57_B     0.313     0    0.050   0.285     0.790  100.000   98.810
LGA    A    58_B      A    58_B     0.433     0    0.026   0.030     0.514  100.000   98.095
LGA    L    59_B      L    59_B     0.388     0    0.024   0.044     0.490  100.000  100.000
LGA    V    60_B      V    60_B     0.527     0    0.075   0.085     0.712   92.857   91.837
LGA    E    61_B      E    61_B     0.440     0    0.028   0.094     0.636  100.000   96.825
LGA    L    62_B      L    62_B     0.342     0    0.026   0.065     0.661   97.619   98.810
LGA    G    63_B      G    63_B     0.565     0    0.024   0.024     0.649   92.857   92.857
LGA    C    64_B      C    64_B     0.427     0    0.063   0.062     0.553   97.619   98.413
LGA    Y    65_B      Y    65_B     0.364     0    0.082   0.127     1.183   97.619   93.690
LGA    D    66_B      D    66_B     0.635     0    0.089   0.109     0.696   90.476   90.476
LGA    G    67_B      G    67_B     0.553     0    0.065   0.065     0.780   90.476   90.476
LGA    R    68_B      R    68_B     1.507     0    0.130   1.403     7.993   75.119   47.532
LGA    A    69_B      A    69_B     0.504     0    0.132   0.143     0.745   90.476   92.381
LGA    L    70_B      L    70_B     0.500     0    0.017   0.038     0.771   92.857   94.048
LGA    E    71_B      E    71_B     0.417     0    0.079   1.072     4.858  100.000   76.085
LGA    I    72_B      I    72_B     0.456     0    0.013   0.051     0.654  100.000   96.429
LGA    A    73_B      A    73_B     0.478     0    0.064   0.074     0.621   97.619   96.190
LGA    R    74_B      R    74_B     0.459     0    0.024   0.844     3.948  100.000   81.558
LGA    L    75_B      L    75_B     0.409     0    0.115   0.101     0.740   97.619   95.238
LGA    L    76_B      L    76_B     0.434     0    0.040   0.054     0.598  100.000   96.429
LGA    N    77_B      N    77_B     0.442     0    0.028   0.883     3.260  100.000   84.762
LGA    A    78_B      A    78_B     0.482     0    0.035   0.036     0.598   95.238   94.286
LGA    R    79_B      R    79_B     0.632     0    0.041   0.671     1.854   92.857   88.095
LGA    Y    80_B      Y    80_B     0.556     0    0.025   0.119     0.679   90.476   93.651
LGA    L    81_B      L    81_B     0.552     0    0.015   0.114     0.675   92.857   91.667
LGA    G    82_B      G    82_B     0.475     0    0.030   0.030     0.587   95.238   95.238
LGA    V    83_B      V    83_B     0.564     0    0.020   0.049     0.613   92.857   91.837
LGA    D    84_B      D    84_B     0.649     0    0.036   0.067     0.827   90.476   90.476
LGA    L    85_B      L    85_B     0.945     0    0.023   0.056     1.255   85.952   83.690
LGA    D    86_B      D    86_B     1.111     0    0.102   0.261     1.758   90.595   84.940
LGA    Q    87_B      Q    87_B     1.068     0    0.055   1.317     6.151   85.952   63.757
LGA    R    88_B      R    88_B     1.035     0    0.036   0.195     2.704   85.952   74.762
LGA    A    89_B      A    89_B     1.034     0    0.059   0.072     1.192   85.952   85.048
LGA    I    90_B      I    90_B     0.616     0    0.070   0.098     0.858   95.238   92.857
LGA    E    91_B      E    91_B     0.429     0    0.031   1.003     4.259   95.238   79.524
LGA    T    92_B      T    92_B     0.953     0    0.024   0.027     1.372   90.476   86.599
LGA    L    93_B      L    93_B     0.700     0    0.021   0.038     0.766   90.476   90.476
LGA    R    94_B      R    94_B     0.557     0    0.018   0.219     1.632   90.476   89.827
LGA    T    95_B      T    95_B     1.002     0    0.017   0.029     1.314   83.690   84.014
LGA    R    96_B      R    96_B     1.161     0    0.022   0.332     1.269   81.429   81.429
LGA    I    97_B      I    97_B     0.975     0    0.044   0.060     1.459   85.952   89.405
LGA    E    98_B      E    98_B     1.293     0    0.028   0.918     4.463   77.143   67.619
LGA    R    99_B      R    99_B     1.829     0    0.016   1.445     8.801   70.833   47.489
LGA    E   100_B      E   100_B     1.585     0    0.025   0.212     1.682   72.857   73.810
LGA    G   101_B      G   101_B     1.690     0    0.132   0.132     1.690   77.143   77.143
LGA    M   102_B      M   102_B     1.480     0    0.061   0.645     2.009   79.286   79.405
LGA    S   103_B      S   103_B     1.397     0    0.095   0.117     1.734   79.286   77.143
LGA    D   104_B      D   104_B     1.757     0    0.067   0.181     2.125   75.000   71.905
LGA    R   105_B      R   105_B     0.578     0    0.207   0.856     3.874   88.214   69.957
LGA    A   106_B      A   106_B     0.678     0    0.105   0.128     1.416   88.214   88.667
LGA    D   107_B      D   107_B     0.673     0    0.054   0.087     1.359   92.857   88.274
LGA    T   108_B      T   108_B     0.448     0    0.065   0.103     0.664   92.857   95.918
LGA    V   109_B      V   109_B     0.613     0    0.045   1.087     2.733   95.238   85.918
LGA    V   110_B      V   110_B     0.795     0    0.151   0.160     1.926   83.810   85.374
LGA    D   111_B      D   111_B     1.054     0    0.049   0.084     2.118   90.595   81.786
LGA    D   112_B      D   112_B     0.871     0    0.048   0.614     1.936   90.476   86.012
LGA    I   113_B      I   113_B     0.309     0    0.020   1.260     2.663  100.000   83.690
LGA    L   114_B      L   114_B     0.310     0    0.055   0.360     1.274  100.000   95.298
LGA    N   115_B      N   115_B     0.783     0    0.032   0.324     1.898   90.476   86.012
LGA    H   116_B      H   116_B     0.420     0    0.019   0.176     0.723   95.238   95.238
LGA    T   117_B      T   117_B     0.399     0    0.032   0.848     1.984  100.000   92.245
LGA    R   118_B      R   118_B     0.691     0    0.106   1.272     3.969   92.857   79.957
LGA    R   119_B      R   119_B     1.235     0    0.095   1.075     4.109   79.286   68.009
LGA    G   120_B      G   120_B     1.034     0    0.051   0.051     1.140   83.690   83.690
LGA    A   121_B      A   121_B     0.951     0    0.034   0.034     1.219   90.476   88.667
LGA    S   122_B      S   122_B     0.900     0    0.106   0.724     2.927   88.214   81.905
LGA    V   123_B      V   123_B     0.620     0    0.027   0.094     0.930   90.476   90.476
LGA    G   124_B      G   124_B     0.709     0    0.034   0.034     0.766   90.476   90.476
LGA    S   125_B      S   125_B     0.665     0    0.126   0.452     1.930   90.476   87.540
LGA    R   126_B      R   126_B     0.536     0    0.097   0.164     1.535   95.238   88.961
LGA    A   127_B      A   127_B     0.488     0    0.029   0.034     0.670   92.857   94.286
LGA    L   128_B      L   128_B     0.603     0    0.020   0.577     1.362   90.476   88.214
LGA    Y   129_B      Y   129_B     0.559     0    0.054   0.151     0.916   90.476   94.444
LGA    L   130_B      L   130_B     0.518     0    0.043   0.040     0.562   92.857   96.429
LGA    L   131_B      L   131_B     0.469     0    0.084   0.084     0.856   95.238   97.619
LGA    P   132_B      P   132_B     0.744     0    0.059   0.129     1.052   92.857   90.544
LGA    F   133_B      F   133_B     0.799     0    0.259   0.245     3.536   92.857   69.697
LGA    N   134_B      N   134_B     0.597     0    0.180   0.347     1.440   92.857   89.405
LGA    L   135_B      L   135_B     0.497     0    0.047   0.147     0.689   97.619   97.619
LGA    L   136_B      L   136_B     0.427     0    0.023   0.052     0.447  100.000  100.000
LGA    G   137_B      G   137_B     0.380     0    0.050   0.050     0.557   97.619   97.619
LGA    N   138_B      N   138_B     0.239     0    0.190   0.724     2.314   95.357   89.762
LGA    F   139_B      F   139_B     0.260     0    0.022   0.157     0.532   97.619   97.403
LGA    R   140_B      R   140_B     0.337     0    0.046   0.997     2.550  100.000   91.169
LGA    E   141_B      E   141_B     0.395     0    0.055   0.361     1.085  100.000   96.878
LGA    P   142_B      P   142_B     0.563     0    0.053   0.071     0.641   92.857   91.837
LGA    K   143_B      K   143_B     0.551     0    0.071   0.166     1.289   90.476   89.471
LGA    R   144_B      R   144_B     0.343     0    0.075   1.254     5.282  100.000   80.130
LGA    L   145_B      L   145_B     0.149     0    0.025   0.146     0.615  100.000   97.619
LGA    L   146_B      L   146_B     0.165     0    0.072   0.180     0.445  100.000  100.000
LGA    D   147_B      D   147_B     0.429     0    0.072   0.183     1.025  100.000   94.107
LGA    S   148_B      S   148_B     0.507     0    0.031   0.142     0.542   90.476   93.651
LGA    L   149_B      L   149_B     0.487     0    0.053   0.180     1.225   90.714   90.655
LGA    A   150_B      A   150_B     1.929     0    0.034   0.049     2.649   66.905   64.952
LGA    E   151_B      E   151_B     3.547     0    0.105   0.643     8.452   46.786   31.905
LGA    R   152_B      R   152_B     3.164     0    0.072   0.954     4.920   45.119   43.203
LGA    S   153_B      S   153_B     4.552     0    0.516   0.810     7.083   55.238   40.714
LGA    V   154_B      V   154_B     3.102     0    0.666   0.583     6.959   48.571   36.463
LGA    A   155_B      A   155_B     0.912     0    0.117   0.161     1.138   88.214   86.857
LGA    A   156_B      A   156_B     0.454     0    0.046   0.056     0.665   97.619   96.190
LGA    V   157_B      V   157_B     0.460     0    0.020   0.049     0.470  100.000  100.000
LGA    V   158_B      V   158_B     0.503     0    0.092   0.115     0.758   95.238   93.197
LGA    S   159_B      S   159_B     0.242     0    0.086   0.156     0.600   97.619   98.413
LGA    V   160_B      V   160_B     0.313     0    0.038   1.108     2.728  100.000   90.000
LGA    F   161_B      F   161_B     0.449     0    0.067   0.137     1.021  100.000   94.848
LGA    G   162_B      G   162_B     0.527     0    0.032   0.032     0.581   90.476   90.476
LGA    D   163_B      D   163_B     0.518     0    0.044   1.214     4.497   97.619   80.952
LGA    S   164_B      S   164_B     0.362     0    0.044   0.068     0.401  100.000  100.000
LGA    A   165_B      A   165_B     0.513     0    0.017   0.024     0.560   95.238   94.286
LGA    E   166_B      E   166_B     0.405     0    0.050   0.622     2.858   97.619   92.116
LGA    A   167_B      A   167_B     0.421     0    0.031   0.029     0.550   97.619   98.095
LGA    T   168_B      T   168_B     0.387     0    0.026   0.071     0.509   97.619   98.639
LGA    R   169_B      R   169_B     0.491     0    0.024   0.815     2.810   97.619   82.900
LGA    V   170_B      V   170_B     0.454     0    0.038   0.049     0.533   97.619   98.639
LGA    R   171_B      R   171_B     0.483     0    0.019   0.112     0.579   95.238   97.403
LGA    Q   172_B      Q   172_B     0.597     0    0.058   0.881     2.963   92.857   86.825
LGA    S   173_B      S   173_B     0.580     0    0.026   0.058     0.633   90.476   92.063
LGA    Y   174_B      Y   174_B     0.546     0    0.048   0.137     0.671   95.238   92.063
LGA    Y   175_B      Y   175_B     0.359     0    0.030   0.088     0.822  100.000   95.238
LGA    R   176_B      R   176_B     0.448     0    0.024   0.193     1.147   97.619   93.117
LGA    R   177_B      R   177_B     0.535     0    0.015   0.952     3.088   92.857   86.840
LGA    C   178_B      C   178_B     0.351     0    0.214   0.199     1.118   95.357   95.317
LGA    G   179_B      G   179_B     0.561     0    0.193   0.193     0.608   92.857   92.857
LGA    V   180_B      V   180_B     0.561     0    0.079   0.078     1.128   90.595   91.905
LGA    Q   181_B      Q   181_B     1.559     0    0.065   0.487     4.160   79.286   67.354
LGA    G   182_B      G   182_B     0.970     0    0.085   0.085     1.240   88.214   88.214
LGA    L   183_B      L   183_B     0.730     0    0.049   0.118     0.995   90.476   91.667
LGA    E   184_B      E   184_B     0.653     0    0.032   0.059     0.855   90.476   90.476
LGA    L   185_B      L   185_B     0.534     0    0.020   0.999     2.736   90.476   84.107
LGA    H   186_B      H   186_B     0.551     0    0.037   0.075     0.665   92.857   91.429
LGA    T   187_B      T   187_B     0.744     0    0.020   0.040     1.130   90.476   87.891
LGA    R   188_B      R   188_B     0.803     0    0.048   0.419     1.565   85.952   87.229
LGA    D   189_B      D   189_B     1.335     0    0.095   0.276     2.616   79.286   72.083
LGA    D   190_B      D   190_B     0.416     0    0.294   1.248     3.474   92.976   84.405
LGA    G   191_B      G   191_B     0.526     0    0.044   0.044     0.561   95.238   95.238
LGA    T   192_B      T   192_B     0.481     0    0.061   0.980     2.521   95.238   87.279
LGA    V   193_B      V   193_B     0.309     0    0.023   0.122     0.563  100.000   98.639
LGA    F   194_B      F   194_B     0.436     0    0.034   0.152     0.674   95.238   96.537
LGA    T   195_B      T   195_B     0.651     0    0.028   0.081     0.790   90.476   91.837
LGA    G   196_B      G   196_B     1.035     0    0.105   0.105     1.035   88.214   88.214
LGA    S   197_B      S   197_B     1.393     0    0.688   0.802     3.677   71.905   72.302
LGA    D   198_B      D   198_B     1.178     0    0.225   0.236     3.180   85.952   71.726
LGA    G   199_B      G   199_B     0.992     0    0.041   0.041     1.284   88.214   88.214
LGA    F   200_B      F   200_B     0.686     0    0.055   0.086     0.876   90.476   90.476
LGA    Y   201_B      Y   201_B     0.478     0    0.039   0.052     0.588   97.619   99.206
LGA    S   202_B      S   202_B     0.347     0    0.038   0.054     0.611   97.619   95.238
LGA    R   203_B      R   203_B     0.472     0    0.068   0.748     2.040  100.000   88.398
LGA    S   204_B      S   204_B     0.228     0    0.045   0.093     0.355  100.000  100.000
LGA    Y   205_B      Y   205_B     0.101     0    0.064   0.243     1.421  100.000   92.222
LGA    S   206_B      S   206_B     0.197     0    0.027   0.114     0.458  100.000  100.000
LGA    R   207_B      R   207_B     0.416     0    0.029   1.226     5.117  100.000   81.039
LGA    A   208_B      A   208_B     0.210     0    0.027   0.025     0.226  100.000  100.000
LGA    C   209_B      C   209_B     0.187     0    0.051   0.083     0.478  100.000  100.000
LGA    L   210_B      L   210_B     0.209     0    0.041   0.080     0.380  100.000  100.000
LGA    H   211_B      H   211_B     0.258     0    0.024   0.615     1.934  100.000   93.619
LGA    A   212_B      A   212_B     0.204     0    0.016   0.018     0.312  100.000  100.000
LGA    L   213_B      L   213_B     0.188     0    0.015   0.039     0.369  100.000  100.000
LGA    L   214_B      L   214_B     0.246     0    0.068   0.068     0.546   97.619   98.810
LGA    A   215_B      A   215_B     0.338     0    0.018   0.021     0.390  100.000  100.000
LGA    E   216_B      E   216_B     0.143     0    0.036   0.675     2.949  100.000   88.148
LGA    C   217_B      C   217_B     0.254     0    0.093   0.090     0.358  100.000  100.000
LGA    G   218_B      G   218_B     0.507     0    0.097   0.097     0.507   97.619   97.619
LGA    L   219_B      L   219_B     0.508     0    0.031   0.069     0.533   92.857   96.429
LGA    T   220_B      T   220_B     0.508     0    0.032   0.134     0.661   92.857   93.197
LGA    V   221_B      V   221_B     0.607     0    0.108   0.120     0.705   90.476   90.476
LGA    V   222_B      V   222_B     0.818     0    0.154   1.104     3.331   88.214   80.884
LGA    R   223_B      R   223_B     0.872     0    0.030   1.026     8.112   90.476   54.719
LGA    S   224_B      S   224_B     0.830     0    0.144   0.548     2.166   83.810   81.746
LGA    A   225_B      A   225_B     0.514     0    0.035   0.054     0.598   95.238   94.286
LGA    S   226_B      S   226_B     0.494     0    0.119   0.152     1.045   92.976   95.317
LGA    N   227_B      N   227_B     0.305     0    0.028   0.055     0.443  100.000  100.000
LGA    L   228_B      L   228_B     0.600     0    0.080   0.077     1.100   92.857   90.536
LGA    F   229_B      F   229_B     0.483     0    0.100   0.109     0.902   95.238   98.268
LGA    A   230_B      A   230_B     0.506     0    0.063   0.062     0.605   95.238   94.286
LGA    H   231_B      H   231_B     0.471     0    0.035   0.073     0.633  100.000   96.190
LGA    C   232_B      C   232_B     0.369     0    0.030   0.058     0.413  100.000  100.000
LGA    V   233_B      V   233_B     0.520     0    0.024   0.062     0.573   92.857   93.197
LGA    T   234_B      T   234_B     0.472     0    0.020   0.047     0.606   95.238   93.197
LGA    V   235_B      V   235_B     0.627     0    0.050   0.053     0.685   90.476   90.476
LGA    L   236_B      L   236_B     0.588     0    0.070   0.119     1.249   92.857   89.405
LGA    P   237_B      P   237_B     0.426     0    0.049   0.323     1.867   95.238   90.680
LGA    E   238_B      E   238_B     0.974     0    0.110   0.256     1.623   81.667   85.556
LGA    G   239_B      G   239_B     3.101     0    0.058   0.058     4.301   50.476   50.476
LGA    A   240_B      A   240_B     3.016     0    0.724   0.662     3.521   51.905   54.476
LGA    D   241_B      D   241_B     6.527     0    0.652   1.191    11.994   20.595   10.476
LGA    Q   242_B      Q   242_B     4.253     0    0.297   1.029     5.402   40.238   33.016
LGA    G   243_B      G   243_B     3.719     0    0.691   0.691     3.908   46.786   46.786
LGA    F   244_B      F   244_B     6.462     0    0.286   0.350    11.219   13.929    5.974

# 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):     1.210          1.201                  1.787           89.840   85.870

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  249  230    4.0    228    1.06    93.696    96.846    19.734

LGA_LOCAL      RMSD:   1.055  Number of atoms:  228  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   1.213  Number of assigned atoms:  230 
Std_ASGN_ATOMS RMSD:   1.210  Standard rmsd on all 230 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.581114 * X  +   0.489857 * Y  +  -0.649882 * Z  +   8.340395
  Y_new =   0.513498 * X  +  -0.398821 * Y  +  -0.759778 * Z  +  20.936113
  Z_new =  -0.631369 * X  +  -0.775230 * Y  +  -0.019780 * Z  + -18.369894 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  2.417888  0.683317 -1.596306   [DEG:  138.5348   39.1512  -91.4616 ]
ZXZ: -0.707596  1.590577 -2.458116   [DEG:  -40.5423   91.1334 -140.8397 ]
 
# END of job
