
#######################################################
#                                                     #
#                        LGA                          #
#                  ---------------                    #
#                                                     #
#               Local-Global Alignment                #
#        A Method for Finding 3-D Similarities        #
#               in Protein Structures                 #
#                                                     #
#                  ------------ 10/2009               #
#                                                     #
#      Adam Zemla (adamz@llnl.gov)                    #
#      Lawrence Livermore National Laboratory, CA     #
#                                                     #
#######################################################

!!!   License for LGA program has expired  !!!
#   For updated version of the LGA program   #
# please contact Adam Zemla:  adamz@llnl.gov #

# Molecule1: number of CA atoms  250 ( 2011),  selected  239 , name one
# Molecule2: number of CA atoms  239 ( 1927),  selected  239 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:A  -ch2:A  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   193      56_A - 250_A       4.79    65.36
  LCS_AVERAGE:     65.98

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   177      66_A - 242_A       1.97    67.26
  LONGEST_CONTINUOUS_SEGMENT:   177      67_A - 243_A       1.99    67.32
  LCS_AVERAGE:     56.06

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    78      67_A - 144_A       0.79    67.80
  LCS_AVERAGE:     19.63

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  239
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     G     3_A     G     3_A      3    3    9      0    3    3    3    3    3    4    5    6    7    7    7    8    9   10   10   11   11   12   12 
LCS_GDT     S     4_A     S     4_A      3    3    9      0    3    3    3    3    3    4    5    6    7    7    8    8    9   10   10   11   11   12   12 
LCS_GDT     E     5_A     E     5_A      3    3    9      0    3    3    3    3    4    4    6    6    7    7    8    8    9   10   10   11   11   12   12 
LCS_GDT     E     6_A     E     6_A      3    3    9      1    3    3    3    3    4    4    6    6    7    7    8    8    9   10   10   11   11   12   12 
LCS_GDT     E     7_A     E     7_A      3    3    9      3    3    3    3    3    4    4    6    6    7    7    8    8    9   10   10   11   11   12   13 
LCS_GDT     L     8_A     L     8_A      3    3    9      3    3    3    3    3    4    4    6    6    7    7    8    8    9   10   10   11   11   12   13 
LCS_GDT     E     9_A     E     9_A      3    3    9      3    3    3    3    3    4    4    6    6    7    7    8    8    9   10   10   11   11   12   13 
LCS_GDT     R    10_A     R    10_A      3    3    9      3    3    3    3    3    4    4    6    6    7    7    8    8    9   10   10   12   12   13   14 
LCS_GDT     L    11_A     L    11_A      3    3    9      3    3    3    3    3    4    4    5    6    7    7    8    8    9   10   11   12   12   13   14 
LCS_GDT     K    12_A     K    12_A      3    3    9      3    3    3    3    3    4    4    5    6    7    7    8    8    9   10   11   12   12   13   15 
LCS_GDT     A    13_A     A    13_A      3    3    9      0    3    3    3    3    4    4    6    6    7    7    8    8    9   10   11   12   12   14   15 
LCS_GDT     E    14_A     E    14_A      3    3    9      3    3    3    3    3    4    4    6    6    8    8    8    8   10   10   11   13   13   14   15 
LCS_GDT     L    15_A     L    15_A      3    4    9      3    3    3    3    4    4    4    6    6    8    8    8    9   10   10   11   13   13   14   15 
LCS_GDT     D    16_A     D    16_A      3    4    9      3    3    3    3    4    4    4    6    7    8    8    8    9   10   11   11   13   13   14   15 
LCS_GDT     E    17_A     E    17_A      3    4    9      3    3    3    3    4    4    4    6    7    8    8    8    9   10   11   11   13   13   14   15 
LCS_GDT     K    18_A     K    18_A      3    4   10      3    3    3    3    4    4    4    6    7    8    8    8    9   10   11   11   13   13   14   15 
LCS_GDT     R    19_A     R    19_A      3    4   10      0    3    3    3    4    4    4    5    7    8    8    8    9   10   11   11   13   13   14   15 
LCS_GDT     Q    20_A     Q    20_A      3    3   10      1    3    3    3    3    4    4    5    7    8    8    8    9   10   11   11   13   13   14   15 
LCS_GDT     I    21_A     I    21_A      3    3   10      3    3    3    3    3    4    4    6    7    8    8    8    9   10   11   11   13   13   14   15 
LCS_GDT     I    22_A     I    22_A      3    3   10      3    3    3    3    3    4    5    6    8    8    8    9    9   10   11   11   13   13   14   15 
LCS_GDT     A    23_A     A    23_A      3    4   10      3    3    3    3    3    5    6    7    8    8    9    9    9   10   11   11   13   13   14   15 
LCS_GDT     T    24_A     T    24_A      3    4   10      3    3    3    3    3    4    6    7    8    8    9    9    9   10   11   11   13   13   14   15 
LCS_GDT     V    25_A     V    25_A      3    4   10      2    3    3    3    3    5    5    7    8    8    9    9    9   10   11   11   13   13   14   15 
LCS_GDT     K    26_A     K    26_A      3    5   10      0    3    3    4    4    5    6    7    8    8    9    9    9   10   11   11   13   13   14   15 
LCS_GDT     C    27_A     C    27_A      4    5   10      3    4    4    4    5    6    6    7    8    8    9    9    9   10   11   11   12   12   13   14 
LCS_GDT     K    28_A     K    28_A      4    6   10      3    4    4    4    5    6    6    7    8    8    9    9    9   10   11   11   11   12   13   14 
LCS_GDT     P    29_A     P    29_A      4    6   10      3    4    4    5    5    6    6    7    8    8    9    9    9   10   11   11   11   12   13   14 
LCS_GDT     W    30_A     W    30_A      4    6   10      3    4    4    5    5    6    6    7    7    8    9    9    9   10   10   10   11   12   13   13 
LCS_GDT     K    31_A     K    31_A      4    6   10      3    4    4    5    5    6    6    7    7    7    9    9    9   10   10   11   12   12   13   15 
LCS_GDT     M    32_A     M    32_A      4    6    9      3    4    4    5    5    6    6    7    7    7    8    8    9    9   10   11   12   12   14   15 
LCS_GDT     E    33_A     E    33_A      3    6    9      3    3    4    5    5    6    6    7    7    7    8    8    9    9   10   11   13   13   14   15 
LCS_GDT     K    34_A     K    34_A      3    3    9      3    3    3    3    3    4    4    5    6    7    8    8    9    9   10   12   13   13   14   15 
LCS_GDT     K    35_A     K    35_A      3    3    9      3    3    3    3    3    4    4    5    6    7    7    8    9    9   11   12   13   13   14   15 
LCS_GDT     I    36_A     I    36_A      3    3   10      3    3    3    3    3    4    4    5    6    7    7    8    9   10   11   12   13   13   14   15 
LCS_GDT     E    37_A     E    37_A      3    3   10      1    3    3    3    3    4    4    5    6    7    7    9    9   10   11   12   13   13   14   15 
LCS_GDT     V    38_A     V    38_A      3    3   10      3    3    3    3    3    4    4    5    6    8    8    9    9   10   11   12   13   13   14   15 
LCS_GDT     L    39_A     L    39_A      3    3   10      3    3    3    3    3    4    4    5    6    8    8    9    9   10   11   12   13   13   14   15 
LCS_GDT     K    40_A     K    40_A      3    3   10      3    3    3    3    3    4    4    6    6    8    8    9    9   10   11   12   13   13   14   15 
LCS_GDT     E    41_A     E    41_A      3    3   10      0    3    3    3    3    4    5    6    6    8    8    9    9   10   11   12   13   13   14   15 
LCS_GDT     A    42_A     A    42_A      3    4   10      0    3    3    4    4    4    5    6    6    8    8    9    9   10   11   12   13   13   14   15 
LCS_GDT     K    43_A     K    43_A      3    4   10      3    3    3    4    4    4    5    6    6    8    8    9    9   10   11   12   13   13   14   15 
LCS_GDT     K    44_A     K    44_A      3    4   10      3    3    3    4    4    4    5    6    6    8    8    9    9   10   11   12   13   13   14   15 
LCS_GDT     F    45_A     F    45_A      3    4   10      3    3    3    4    4    4    5    6    6    8    8    9    9   10   11   12   13   13   14   15 
LCS_GDT     V    46_A     V    46_A      3    3    9      0    3    3    3    3    4    4    5    6    6    7    8    9    9    9   10   10   11   12   13 
LCS_GDT     G    54_A     G    54_A      3    3    8      2    3    3    3    3    4    4    4    4    5    6    8    9    9    9    9    9   11   12   12 
LCS_GDT     K    55_A     K    55_A      3    4   12      0    3    3    3    4    4    5    5    5    6    6    8    9   13   17   20   22   24   25   41 
LCS_GDT     G    56_A     G    56_A      4    5  193      3    4    4    4    4    5    7    7    8    8   11   16   17   21   24   34   91  126  143  159 
LCS_GDT     S    57_A     S    57_A      4    5  193      3    4    4    4    4    6    7    7    8    8   11   16   17   21   24   34   38  126  149  164 
LCS_GDT     L    58_A     L    58_A      5    6  193      4    4    5    5    6    6    7    7    8   11   13   25   36   53   72  100  122  137  149  164 
LCS_GDT     V    59_A     V    59_A      5    6  193      4    4    5    5    6    6    7    7    8   11   13   19   19   24   82  117  137  154  166  178 
LCS_GDT     P    60_A     P    60_A      5    6  193      4    4    5    5    6    8    9   14   19   33   40   55   70   93  114  132  146  159  172  180 
LCS_GDT     R    61_A     R    61_A      5    6  193      4    4    5    6    8    8   11   18   26   37   44   58   69   82  114  124  143  153  168  180 
LCS_GDT     G    62_A     G    62_A      5    6  193      3    4    6    7    8    8    9   11   13   17   24   41   50   66   83   94  131  139  159  172 
LCS_GDT     S    63_A     S    63_A      4  134  193      3    4    6    7    8    8    9   11   13   17   61   89  106  130  149  182  186  186  186  186 
LCS_GDT     N    66_A     N    66_A     76  177  193      3    3    6   33  105  149  169  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     K    67_A     K    67_A     78  177  193     27  106  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     Q    68_A     Q    68_A     78  177  193     28  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     T    69_A     T    69_A     78  177  193     33  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     I    70_A     I    70_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     F    71_A     F    71_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     T    72_A     T    72_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     E    73_A     E    73_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     E    74_A     E    74_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     Q    75_A     Q    75_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     L    76_A     L    76_A     78  177  193     54  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     D    77_A     D    77_A     78  177  193     54  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     N    78_A     N    78_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     Y    79_A     Y    79_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     Q    80_A     Q    80_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     D    81_A     D    81_A     78  177  193     31  105  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     C    82_A     C    82_A     78  177  193     42  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     T    83_A     T    83_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     F    84_A     F    84_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     F    85_A     F    85_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     N    86_A     N    86_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     K    87_A     K    87_A     78  177  193     47  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     K    88_A     K    88_A     78  177  193     42  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     D    89_A     D    89_A     78  177  193     44  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     I    90_A     I    90_A     78  177  193     43  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     L    91_A     L    91_A     78  177  193     41  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     K    92_A     K    92_A     78  177  193     47  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     L    93_A     L    93_A     78  177  193     44  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     H    94_A     H    94_A     78  177  193     33  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     S    95_A     S    95_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     R    96_A     R    96_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     F    97_A     F    97_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     Y    98_A     Y    98_A     78  177  193     19  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     E    99_A     E    99_A     78  177  193     18  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     L   100_A     L   100_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     A   101_A     A   101_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     P   102_A     P   102_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     N   103_A     N   103_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     L   104_A     L   104_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     V   105_A     V   105_A     78  177  193     42  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     P   106_A     P   106_A     78  177  193     24  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     M   107_A     M   107_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     D   108_A     D   108_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     Y   109_A     Y   109_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     R   110_A     R   110_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     K   111_A     K   111_A     78  177  193     27  104  129  145  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     S   112_A     S   112_A     78  177  193     42  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     P   113_A     P   113_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     I   114_A     I   114_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     V   115_A     V   115_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     H   116_A     H   116_A     78  177  193     28  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     V   117_A     V   117_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     P   118_A     P   118_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     M   119_A     M   119_A     78  177  193     50  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     S   120_A     S   120_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     L   121_A     L   121_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     I   122_A     I   122_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     I   123_A     I   123_A     78  177  193     43  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     Q   124_A     Q   124_A     78  177  193     42  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     M   125_A     M   125_A     78  177  193     32  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     P   126_A     P   126_A     78  177  193     34  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     E   127_A     E   127_A     78  177  193     34  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     L   128_A     L   128_A     78  177  193     36  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     R   129_A     R   129_A     78  177  193     43  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     E   130_A     E   130_A     78  177  193     34  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     N   131_A     N   131_A     78  177  193     26  102  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     P   132_A     P   132_A     78  177  193     26  102  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     F   133_A     F   133_A     78  177  193     45  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     K   134_A     K   134_A     78  177  193     42  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     E   135_A     E   135_A     78  177  193     21  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     R   136_A     R   136_A     78  177  193     44  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     I   137_A     I   137_A     78  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     V   138_A     V   138_A     78  177  193     25  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     A   139_A     A   139_A     78  177  193     23  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     A   140_A     A   140_A     78  177  193     47  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     F   141_A     F   141_A     78  177  193     38  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     S   142_A     S   142_A     78  177  193     16   95  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     E   143_A     E   143_A     78  177  193      3    5   57  130  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     D   144_A     D   144_A     78  177  193      3   41  101  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     G   145_A     G   145_A      3  177  193      3    3    3    6   12   26   48  155  165  177  179  183  185  185  185  185  186  186  186  186 
LCS_GDT     E   146_A     E   146_A      3  177  193      3   20   81  142  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     G   147_A     G   147_A      4  177  193      3    4    8   43   54  123  169  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     N   148_A     N   148_A     33  177  193     34  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     L   149_A     L   149_A     33  177  193     45  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     T   150_A     T   150_A     33  177  193     52  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     F   151_A     F   151_A     33  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     N   152_A     N   152_A     33  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     D   153_A     D   153_A     33  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     F   154_A     F   154_A     33  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     V   155_A     V   155_A     33  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     D   156_A     D   156_A     33  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     M   157_A     M   157_A     33  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     F   158_A     F   158_A     33  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     S   159_A     S   159_A     33  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     V   160_A     V   160_A     33  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     L   161_A     L   161_A     33  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     C   162_A     C   162_A     33  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     E   163_A     E   163_A     33  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     S   164_A     S   164_A     33  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     A   165_A     A   165_A     33  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     P   166_A     P   166_A     33  177  193     43  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     R   167_A     R   167_A     33  177  193     35  106  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     E   168_A     E   168_A     33  177  193     31  106  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     L   169_A     L   169_A     33  177  193     34  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     K   170_A     K   170_A     39  177  193     13  106  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     A   171_A     A   171_A     62  177  193     15  106  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     N   172_A     N   172_A     62  177  193     15  106  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     Y   173_A     Y   173_A     62  177  193     14  106  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     A   174_A     A   174_A     62  177  193     21  106  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     F   175_A     F   175_A     62  177  193     33  106  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     K   176_A     K   176_A     62  177  193     17   91  128  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     I   177_A     I   177_A     62  177  193     37  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     Y   178_A     Y   178_A     62  177  193     42  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     D   179_A     D   179_A     62  177  193     24  103  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     F   180_A     F   180_A     62  177  193     11   43   97  140  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     N   181_A     N   181_A     62  177  193     11   26   67  116  157  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     T   182_A     T   182_A     62  177  193     11   43   80  119  157  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     D   183_A     D   183_A     62  177  193     17   51  104  140  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     N   184_A     N   184_A     62  177  193     17   79  127  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     F   185_A     F   185_A     62  177  193     36  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     I   186_A     I   186_A     62  177  193     43  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     C   187_A     C   187_A     62  177  193     19   82  111  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     K   188_A     K   188_A     62  177  193     17   51  108  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     E   189_A     E   189_A     62  177  193     17   54  111  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     D   190_A     D   190_A     62  177  193     23   94  123  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     L   191_A     L   191_A     62  177  193     22   82  119  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     E   192_A     E   192_A     62  177  193     19   51  109  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     L   193_A     L   193_A     62  177  193     19   58  114  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     T   194_A     T   194_A     62  177  193     19   69  119  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     L   195_A     L   195_A     62  177  193     19   51   99  145  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     A   196_A     A   196_A     62  177  193     19   51   99  143  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     R   197_A     R   197_A     62  177  193     19   51  103  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     L   198_A     L   198_A     62  177  193     19   51   96  138  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     T   199_A     T   199_A     62  177  193     18   51   89  127  160  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     K   200_A     K   200_A     62  177  193     16   51   85  115  156  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     S   201_A     S   201_A     62  177  193     16   51   85  115  152  169  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     E   202_A     E   202_A     62  177  193     18   51   86  116  152  169  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     L   203_A     L   203_A     62  177  193     19   51   94  132  160  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     D   204_A     D   204_A     62  177  193     19   51   94  133  162  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     E   205_A     E   205_A     62  177  193     19   51   99  140  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     E   206_A     E   206_A     62  177  193     19   51   99  141  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     E   207_A     E   207_A     62  177  193     19   51   99  141  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     V   208_A     V   208_A     62  177  193     19   51  100  143  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     V   209_A     V   209_A     62  177  193     19   51  111  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     L   210_A     L   210_A     62  177  193     19   68  114  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     V   211_A     V   211_A     62  177  193     19   56  110  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     C   212_A     C   212_A     62  177  193     16   51  110  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     D   213_A     D   213_A     62  177  193     12   77  122  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     K   214_A     K   214_A     62  177  193     18   96  122  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     V   215_A     V   215_A     62  177  193     21   72  119  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     I   216_A     I   216_A     62  177  193     11   51  116  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     E   217_A     E   217_A     62  177  193     11   98  128  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     E   218_A     E   218_A     62  177  193     21   98  126  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     A   219_A     A   219_A     62  177  193     21   79  121  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     D   220_A     D   220_A     62  177  193     34  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     L   221_A     L   221_A     62  177  193     12  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     D   222_A     D   222_A     62  177  193     12  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     G   223_A     G   223_A     62  177  193     18  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     D   224_A     D   224_A     62  177  193     29  103  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     G   225_A     G   225_A     62  177  193     35   97  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     K   226_A     K   226_A     62  177  193     47  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     L   227_A     L   227_A     62  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     G   228_A     G   228_A     62  177  193     54  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     F   229_A     F   229_A     62  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     A   230_A     A   230_A     62  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     D   231_A     D   231_A     62  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     F   232_A     F   232_A     62  177  193     49  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     E   233_A     E   233_A     62  177  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     D   234_A     D   234_A     53  177  193     33  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     M   235_A     M   235_A     17  177  193      5   96  127  137  162  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     I   236_A     I   236_A     17  177  193      9  106  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     A   237_A     A   237_A     12  177  193      4    8  118  140  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     K   238_A     K   238_A     12  177  193      4   13   69  111  133  146  163  175  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     A   239_A     A   239_A     12  177  193      5   19   42  115  133  139  155  170  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     P   240_A     P   240_A      7  177  193      3    5   17   24   63   92  137  141  162  174  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     D   241_A     D   241_A      7  177  193      5   20   39   73   93  134  150  159  169  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     F   242_A     F   242_A      7  177  193      5    5   22   44   75   92  116  140  157  169  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     L   243_A     L   243_A      7  177  193      5    6   22   42   64   92  115  129  153  168  180  184  185  185  185  185  186  186  186  186 
LCS_GDT     S   244_A     S   244_A      7   24  193      5   11   30   51   75   91  116  141  159  170  177  184  185  185  185  185  186  186  186  186 
LCS_GDT     T   245_A     T   245_A      6   24  193      3    6   22   51   69   85  129  145  162  171  178  184  185  185  185  185  186  186  186  186 
LCS_GDT     F   246_A     F   246_A      6   24  193      3   11   60  101  138  156  172  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     H   247_A     H   247_A      6   24  193     54  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     I   248_A     I   248_A      6   24  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     R   249_A     R   249_A      6   24  193     43  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_GDT     I   250_A     I   250_A      5   24  193     56  107  129  146  163  170  173  176  178  178  181  184  185  185  185  185  186  186  186  186 
LCS_AVERAGE  LCS_A:  47.22  (  19.63   56.06   65.98 )

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     56    107    129    146    163    170    173    176    178    178    181    184    185    185    185    185    186    186    186    186 
GDT PERCENT_AT  23.43  44.77  53.97  61.09  68.20  71.13  72.38  73.64  74.48  74.48  75.73  76.99  77.41  77.41  77.41  77.41  77.82  77.82  77.82  77.82
GDT RMS_LOCAL    0.33   0.60   0.77   1.13   1.36   1.48   1.56   1.66   1.75   1.75   1.92   2.11   2.15   2.15   2.15   2.15   2.40   2.40   2.40   2.40
GDT RMS_ALL_AT  67.91  67.78  67.68  67.63  67.50  67.41  67.37  67.31  67.29  67.29  67.28  67.28  67.27  67.27  67.27  67.27  67.11  67.11  67.11  67.11

# Checking swapping
#   possible swapping detected:  E     5_A      E     5_A
#   possible swapping detected:  E     7_A      E     7_A
#   possible swapping detected:  E    14_A      E    14_A
#   possible swapping detected:  E    37_A      E    37_A
#   possible swapping detected:  Y    98_A      Y    98_A
#   possible swapping detected:  E    99_A      E    99_A
#   possible swapping detected:  Y   109_A      Y   109_A
#   possible swapping detected:  E   130_A      E   130_A
#   possible swapping detected:  F   133_A      F   133_A
#   possible swapping detected:  F   141_A      F   141_A
#   possible swapping detected:  E   143_A      E   143_A
#   possible swapping detected:  E   189_A      E   189_A
#   possible swapping detected:  E   192_A      E   192_A
#   possible swapping detected:  E   202_A      E   202_A
#   possible swapping detected:  E   218_A      E   218_A
#   possible swapping detected:  D   241_A      D   241_A
#   possible swapping detected:  F   246_A      F   246_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    G     3_A      G     3_A   222.044     0    0.408   0.408   223.831    0.000    0.000
LGA    S     4_A      S     4_A   214.766     0    0.629   0.609   217.404    0.000    0.000
LGA    E     5_A      E     5_A   212.393     0    0.612   1.127   214.241    0.000    0.000
LGA    E     6_A      E     6_A   210.160     0    0.616   1.176   211.222    0.000    0.000
LGA    E     7_A      E     7_A   204.900     0    0.606   1.115   206.871    0.000    0.000
LGA    L     8_A      L     8_A   198.390     0    0.618   1.152   200.824    0.000    0.000
LGA    E     9_A      E     9_A   198.607     0    0.645   0.764   205.072    0.000    0.000
LGA    R    10_A      R    10_A   196.202     6    0.648   0.608   196.910    0.000    0.000
LGA    L    11_A      L    11_A   191.717     0    0.608   0.582   194.315    0.000    0.000
LGA    K    12_A      K    12_A   187.449     0    0.618   1.512   189.012    0.000    0.000
LGA    A    13_A      A    13_A   187.720     0    0.634   0.612   190.039    0.000    0.000
LGA    E    14_A      E    14_A   183.044     0    0.633   0.981   184.593    0.000    0.000
LGA    L    15_A      L    15_A   178.517     0    0.605   1.088   180.368    0.000    0.000
LGA    D    16_A      D    16_A   175.794     0    0.537   0.925   176.981    0.000    0.000
LGA    E    17_A      E    17_A   177.025     0    0.584   0.819   184.840    0.000    0.000
LGA    K    18_A      K    18_A   171.041     0    0.632   0.903   176.284    0.000    0.000
LGA    R    19_A      R    19_A   165.456     0    0.619   1.168   167.710    0.000    0.000
LGA    Q    20_A      Q    20_A   165.209     0    0.598   1.327   167.210    0.000    0.000
LGA    I    21_A      I    21_A   161.954     0    0.614   0.843   163.228    0.000    0.000
LGA    I    22_A      I    22_A   155.082     0    0.637   0.693   157.494    0.000    0.000
LGA    A    23_A      A    23_A   151.622     0    0.673   0.604   153.179    0.000    0.000
LGA    T    24_A      T    24_A   151.211     0    0.692   1.414   152.520    0.000    0.000
LGA    V    25_A      V    25_A   147.415     0    0.639   0.815   148.458    0.000    0.000
LGA    K    26_A      K    26_A   143.534     0    0.648   1.133   144.776    0.000    0.000
LGA    C    27_A      C    27_A   143.016     0    0.642   0.555   144.138    0.000    0.000
LGA    K    28_A      K    28_A   142.986     0    0.048   1.343   145.721    0.000    0.000
LGA    P    29_A      P    29_A   140.613     0    0.460   0.594   143.378    0.000    0.000
LGA    W    30_A      W    30_A   137.367     0    0.066   0.762   142.146    0.000    0.000
LGA    K    31_A      K    31_A   133.081     0    0.099   1.298   136.119    0.000    0.000
LGA    M    32_A      M    32_A   126.281     0    0.639   1.056   128.465    0.000    0.000
LGA    E    33_A      E    33_A   125.235     0    0.632   0.897   130.144    0.000    0.000
LGA    K    34_A      K    34_A   124.766     0    0.634   1.327   129.284    0.000    0.000
LGA    K    35_A      K    35_A   121.947     0    0.610   1.019   125.081    0.000    0.000
LGA    I    36_A      I    36_A   115.043     0    0.635   0.877   117.584    0.000    0.000
LGA    E    37_A      E    37_A   115.423     0    0.604   1.132   119.056    0.000    0.000
LGA    V    38_A      V    38_A   113.564     0    0.610   0.897   114.421    0.000    0.000
LGA    L    39_A      L    39_A   108.490     0    0.612   1.268   110.207    0.000    0.000
LGA    K    40_A      K    40_A   103.059     0    0.602   1.428   105.288    0.000    0.000
LGA    E    41_A      E    41_A   103.522     0    0.671   0.854   106.424    0.000    0.000
LGA    A    42_A      A    42_A    99.969     0    0.667   0.620   101.324    0.000    0.000
LGA    K    43_A      K    43_A    93.458     0    0.671   1.299    95.570    0.000    0.000
LGA    K    44_A      K    44_A    90.722     0    0.056   0.667    92.930    0.000    0.000
LGA    F    45_A      F    45_A    86.293     0    0.520   0.516    87.455    0.000    0.000
LGA    V    46_A      V    46_A    84.118     0    0.589   0.600    88.261    0.000    0.000
LGA    G    54_A      G    54_A    39.708     0    0.087   0.087    41.870    0.000    0.000
LGA    K    55_A      K    55_A    34.930     0    0.510   0.956    38.561    0.000    0.000
LGA    G    56_A      G    56_A    29.516     0    0.655   0.655    30.931    0.000    0.000
LGA    S    57_A      S    57_A    26.269     0    0.094   0.615    29.221    0.000    0.000
LGA    L    58_A      L    58_A    27.708     0    0.640   1.430    29.970    0.000    0.000
LGA    V    59_A      V    59_A    23.587     0    0.112   1.056    25.032    0.000    0.000
LGA    P    60_A      P    60_A    23.831     0    0.097   0.109    23.831    0.000    0.000
LGA    R    61_A      R    61_A    23.712     0    0.559   1.500    33.227    0.000    0.000
LGA    G    62_A      G    62_A    22.166     0    0.086   0.086    23.258    0.000    0.000
LGA    S    63_A      S    63_A    15.205     0    0.075   0.100    17.939    0.000    0.000
LGA    N    66_A      N    66_A     5.694     0    0.402   0.872     9.958   40.119   21.786
LGA    K    67_A      K    67_A     2.078     0    0.669   1.523     9.624   62.976   33.492
LGA    Q    68_A      Q    68_A     1.207     0    0.060   0.985     2.365   81.429   76.720
LGA    T    69_A      T    69_A     0.989     0    0.076   1.197     3.427   88.214   77.347
LGA    I    70_A      I    70_A     0.646     0    0.043   1.104     3.588   90.476   77.321
LGA    F    71_A      F    71_A     1.075     0    0.052   0.114     1.396   83.690   83.896
LGA    T    72_A      T    72_A     1.438     0    0.059   0.087     1.832   77.143   76.531
LGA    E    73_A      E    73_A     2.109     0    0.028   1.402     6.983   66.786   47.884
LGA    E    74_A      E    74_A     2.138     0    0.033   0.968     2.296   68.810   69.312
LGA    Q    75_A      Q    75_A     1.773     0    0.021   0.152     1.844   72.857   75.714
LGA    L    76_A      L    76_A     1.818     0    0.036   1.352     3.303   72.857   70.060
LGA    D    77_A      D    77_A     2.067     0    0.030   0.886     4.499   66.786   56.190
LGA    N    78_A      N    78_A     1.840     0    0.051   1.246     5.428   72.857   61.310
LGA    Y    79_A      Y    79_A     1.350     0    0.035   0.315     1.476   81.429   83.690
LGA    Q    80_A      Q    80_A     1.838     0    0.049   0.876     3.442   70.833   65.079
LGA    D    81_A      D    81_A     2.258     0    0.125   0.247     3.727   68.810   58.631
LGA    C    82_A      C    82_A     1.557     0    0.278   0.267     2.652   79.405   74.603
LGA    T    83_A      T    83_A     1.162     0    0.038   0.097     1.655   79.286   82.789
LGA    F    84_A      F    84_A     1.460     0    0.150   0.268     2.330   75.119   79.134
LGA    F    85_A      F    85_A     1.188     0    0.037   0.182     1.304   81.429   83.074
LGA    N    86_A      N    86_A     1.137     0    0.041   0.854     4.815   81.429   64.167
LGA    K    87_A      K    87_A     0.946     0    0.029   0.116     1.884   88.214   84.497
LGA    K    88_A      K    88_A     1.062     0    0.036   1.205     5.528   81.429   67.989
LGA    D    89_A      D    89_A     0.934     0    0.027   0.093     1.033   88.214   88.214
LGA    I    90_A      I    90_A     0.718     0    0.021   0.675     3.052   90.476   86.607
LGA    L    91_A      L    91_A     0.772     0    0.045   0.216     1.304   90.476   89.345
LGA    K    92_A      K    92_A     0.887     0    0.025   0.775     3.151   90.476   75.767
LGA    L    93_A      L    93_A     0.654     0    0.036   0.737     1.997   90.476   89.524
LGA    H    94_A      H    94_A     0.872     0    0.033   1.140     2.846   90.476   81.905
LGA    S    95_A      S    95_A     1.049     0    0.019   0.202     1.616   83.690   81.508
LGA    R    96_A      R    96_A     0.906     0    0.023   0.931     1.999   90.476   84.848
LGA    F    97_A      F    97_A     0.746     0    0.028   0.229     0.787   90.476   90.476
LGA    Y    98_A      Y    98_A     0.929     0    0.038   0.264     1.166   85.952   86.706
LGA    E    99_A      E    99_A     1.275     0    0.019   0.257     2.128   81.429   78.624
LGA    L   100_A      L   100_A     1.183     0    0.139   0.155     2.021   77.262   85.060
LGA    A   101_A      A   101_A     1.193     0    0.183   0.185     1.246   83.690   83.238
LGA    P   102_A      P   102_A     0.825     0    0.058   0.154     1.571   90.476   84.150
LGA    N   103_A      N   103_A     0.773     0    0.216   0.773     1.776   88.214   87.202
LGA    L   104_A      L   104_A     0.840     0    0.034   0.868     4.181   90.476   75.476
LGA    V   105_A      V   105_A     0.450     0    0.046   1.034     2.364   95.238   87.211
LGA    P   106_A      P   106_A     0.808     0    0.045   0.273     1.310   90.476   87.891
LGA    M   107_A      M   107_A     0.538     0    0.125   0.986     3.416   90.476   83.155
LGA    D   108_A      D   108_A     0.692     0    0.020   0.115     0.862   90.476   90.476
LGA    Y   109_A      Y   109_A     0.624     0    0.116   0.297     1.462   85.952   92.937
LGA    R   110_A      R   110_A     1.536     0    0.021   0.165     2.213   72.976   72.944
LGA    K   111_A      K   111_A     2.205     0    0.200   0.574     7.246   70.833   48.307
LGA    S   112_A      S   112_A     1.607     0    0.035   0.633     3.446   72.857   69.048
LGA    P   113_A      P   113_A     1.454     0    0.040   0.090     1.509   83.690   81.497
LGA    I   114_A      I   114_A     1.007     0    0.585   1.727     5.302   69.762   59.821
LGA    V   115_A      V   115_A     0.715     0    0.067   0.099     1.089   92.857   90.544
LGA    H   116_A      H   116_A     1.152     0    0.063   1.146     3.784   81.429   73.619
LGA    V   117_A      V   117_A     1.089     0    0.046   0.077     1.097   83.690   82.721
LGA    P   118_A      P   118_A     1.157     0    0.076   0.244     1.930   83.690   82.789
LGA    M   119_A      M   119_A     0.965     0    0.043   0.149     1.131   85.952   87.083
LGA    S   120_A      S   120_A     1.401     0    0.035   0.113     1.762   81.429   78.571
LGA    L   121_A      L   121_A     1.283     0    0.031   1.001     3.204   81.429   75.357
LGA    I   122_A      I   122_A     0.952     0    0.022   0.156     1.326   90.476   87.083
LGA    I   123_A      I   123_A     0.670     0    0.132   1.261     3.436   88.214   79.881
LGA    Q   124_A      Q   124_A     0.794     0    0.084   1.142     6.594   88.214   63.280
LGA    M   125_A      M   125_A     0.845     0    0.045   0.803     1.821   90.476   83.810
LGA    P   126_A      P   126_A     0.762     0    0.036   0.360     1.853   90.476   87.959
LGA    E   127_A      E   127_A     0.635     0    0.185   0.310     1.383   88.214   86.455
LGA    L   128_A      L   128_A     0.675     0    0.049   0.774     2.094   90.476   83.929
LGA    R   129_A      R   129_A     1.103     0    0.062   0.960     5.795   83.690   61.342
LGA    E   130_A      E   130_A     0.888     0    0.201   1.219     5.889   88.214   63.175
LGA    N   131_A      N   131_A     0.848     0    0.032   0.414     1.849   90.476   87.143
LGA    P   132_A      P   132_A     0.504     0    0.113   0.194     1.082   90.476   89.184
LGA    F   133_A      F   133_A     1.051     0    0.118   0.328     1.262   88.214   88.874
LGA    K   134_A      K   134_A     0.870     0    0.030   0.217     1.031   88.214   89.471
LGA    E   135_A      E   135_A     1.196     0    0.022   0.919     5.450   81.429   66.614
LGA    R   136_A      R   136_A     1.142     0    0.018   1.106     3.421   85.952   74.156
LGA    I   137_A      I   137_A     0.701     0    0.025   0.610     1.562   90.476   89.464
LGA    V   138_A      V   138_A     0.782     0    0.033   0.143     1.128   90.476   89.184
LGA    A   139_A      A   139_A     1.138     0    0.044   0.050     1.355   85.952   85.048
LGA    A   140_A      A   140_A     0.772     0    0.126   0.125     0.954   90.476   90.476
LGA    F   141_A      F   141_A     1.325     0    0.188   0.208     1.385   81.429   81.429
LGA    S   142_A      S   142_A     1.879     0    0.077   0.619     1.913   72.857   72.857
LGA    E   143_A      E   143_A     2.658     0    0.623   0.997     3.741   57.500   55.820
LGA    D   144_A      D   144_A     2.045     0    0.128   0.398     5.310   62.976   48.214
LGA    G   145_A      G   145_A     6.151     0    0.645   0.645     6.151   26.548   26.548
LGA    E   146_A      E   146_A     2.154     0    0.661   0.593     4.023   50.595   55.767
LGA    G   147_A      G   147_A     4.106     0    0.091   0.091     4.106   46.905   46.905
LGA    N   148_A      N   148_A     0.931     0    0.222   0.271     3.053   79.405   73.452
LGA    L   149_A      L   149_A     1.184     0    0.038   1.389     3.696   83.690   77.798
LGA    T   150_A      T   150_A     1.053     0    0.031   1.008     2.638   85.952   79.320
LGA    F   151_A      F   151_A     0.431     0    0.042   0.078     1.176   97.619   90.606
LGA    N   152_A      N   152_A     0.546     0    0.019   0.166     1.388   95.238   91.726
LGA    D   153_A      D   153_A     0.497     0    0.033   0.116     0.978   97.619   94.048
LGA    F   154_A      F   154_A     0.220     0    0.052   0.192     1.089  100.000   93.160
LGA    V   155_A      V   155_A     0.138     0    0.026   0.144     0.725  100.000   98.639
LGA    D   156_A      D   156_A     0.097     0    0.027   0.228     0.780  100.000   98.810
LGA    M   157_A      M   157_A     0.381     0    0.013   0.641     1.682  100.000   91.905
LGA    F   158_A      F   158_A     0.400     0    0.022   0.117     0.774   97.619   93.074
LGA    S   159_A      S   159_A     0.452     0    0.037   0.079     0.760   95.238   96.825
LGA    V   160_A      V   160_A     0.669     0    0.023   0.102     1.098   90.595   91.905
LGA    L   161_A      L   161_A     1.074     0    0.052   0.212     1.538   81.548   80.417
LGA    C   162_A      C   162_A     1.227     0    0.023   0.860     2.437   81.429   78.651
LGA    E   163_A      E   163_A     1.600     0    0.048   0.880     6.318   75.000   53.439
LGA    S   164_A      S   164_A     1.535     0    0.060   0.059     1.992   79.286   77.143
LGA    A   165_A      A   165_A     1.199     0    0.047   0.060     1.820   79.286   79.714
LGA    P   166_A      P   166_A     1.621     0    0.049   0.163     1.621   77.143   76.531
LGA    R   167_A      R   167_A     1.982     0    0.045   1.518     8.973   72.857   43.074
LGA    E   168_A      E   168_A     1.580     0    0.053   0.771     2.364   77.143   74.815
LGA    L   169_A      L   169_A     0.914     0    0.022   0.196     1.255   83.690   89.464
LGA    K   170_A      K   170_A     1.721     0    0.033   0.562     2.908   75.000   69.418
LGA    A   171_A      A   171_A     1.818     0    0.057   0.057     1.818   72.857   72.857
LGA    N   172_A      N   172_A     1.518     0    0.024   0.950     2.778   72.857   73.036
LGA    Y   173_A      Y   173_A     1.801     0    0.020   0.137     2.044   70.833   75.754
LGA    A   174_A      A   174_A     2.058     0    0.046   0.051     2.058   66.786   66.381
LGA    F   175_A      F   175_A     1.936     0    0.019   0.187     2.028   72.857   72.121
LGA    K   176_A      K   176_A     2.127     0    0.036   0.668     2.607   68.810   67.566
LGA    I   177_A      I   177_A     1.675     0    0.062   0.220     3.053   77.143   71.250
LGA    Y   178_A      Y   178_A     1.019     0    0.114   0.486     1.556   85.952   86.746
LGA    D   179_A      D   179_A     1.368     0    0.033   0.140     2.338   75.119   76.131
LGA    F   180_A      F   180_A     2.267     0    0.076   0.211     3.621   59.524   68.831
LGA    N   181_A      N   181_A     3.223     0    0.097   0.447     3.941   50.119   52.976
LGA    T   182_A      T   182_A     3.260     0    0.129   1.181     5.893   48.571   46.259
LGA    D   183_A      D   183_A     2.432     0    0.064   0.077     2.432   64.762   65.774
LGA    N   184_A      N   184_A     2.062     0    0.024   0.140     3.570   68.810   60.417
LGA    F   185_A      F   185_A     0.957     0    0.031   0.251     1.528   88.214   83.160
LGA    I   186_A      I   186_A     0.269     0    0.049   0.671     2.885   97.619   89.881
LGA    C   187_A      C   187_A     1.522     0    0.047   0.668     1.947   79.405   77.222
LGA    K   188_A      K   188_A     1.909     0    0.038   1.154     6.618   72.857   55.661
LGA    E   189_A      E   189_A     1.587     0    0.023   0.833     4.879   77.143   59.630
LGA    D   190_A      D   190_A     0.784     0    0.025   0.087     1.024   88.214   89.345
LGA    L   191_A      L   191_A     1.077     0    0.053   0.166     1.965   83.690   79.345
LGA    E   192_A      E   192_A     1.661     0    0.028   0.621     2.867   75.000   66.825
LGA    L   193_A      L   193_A     1.319     0    0.022   1.077     2.682   81.429   76.310
LGA    T   194_A      T   194_A     1.070     0    0.024   0.121     1.592   79.286   82.789
LGA    L   195_A      L   195_A     2.056     0    0.024   0.104     2.939   66.786   62.917
LGA    A   196_A      A   196_A     2.320     0    0.029   0.044     2.372   64.762   64.762
LGA    R   197_A      R   197_A     1.855     0    0.018   0.455     2.307   68.810   78.528
LGA    L   198_A      L   198_A     2.355     0    0.086   0.363     3.239   59.167   61.012
LGA    T   199_A      T   199_A     3.034     0    0.121   1.207     5.310   51.786   48.639
LGA    K   200_A      K   200_A     3.494     0    0.025   0.666     4.393   46.667   44.180
LGA    S   201_A      S   201_A     3.887     0    0.251   0.693     5.167   37.500   41.746
LGA    E   202_A      E   202_A     3.939     0    0.106   1.095     7.931   41.786   32.116
LGA    L   203_A      L   203_A     3.059     0    0.029   1.339     4.880   50.000   45.357
LGA    D   204_A      D   204_A     2.976     0    0.041   0.920     3.001   57.143   61.131
LGA    E   205_A      E   205_A     2.512     0    0.036   0.973     4.919   60.952   52.857
LGA    E   206_A      E   206_A     2.455     0    0.030   1.152     3.549   62.857   60.053
LGA    E   207_A      E   207_A     2.476     0    0.026   0.787     4.096   64.762   55.979
LGA    V   208_A      V   208_A     2.152     0    0.027   0.121     2.839   68.810   67.143
LGA    V   209_A      V   209_A     1.590     0    0.046   0.139     1.819   77.143   76.531
LGA    L   210_A      L   210_A     1.383     0    0.043   0.922     4.339   81.429   66.429
LGA    V   211_A      V   211_A     1.847     0    0.021   0.085     2.396   72.857   69.388
LGA    C   212_A      C   212_A     1.835     0    0.031   0.078     3.021   77.143   70.556
LGA    D   213_A      D   213_A     1.206     0    0.070   0.836     3.228   81.429   73.333
LGA    K   214_A      K   214_A     1.105     0    0.047   1.047     3.203   81.429   79.365
LGA    V   215_A      V   215_A     1.152     0    0.062   0.194     1.809   81.429   80.204
LGA    I   216_A      I   216_A     1.506     0    0.054   1.120     5.082   77.143   61.786
LGA    E   217_A      E   217_A     1.525     0    0.053   0.732     5.957   79.286   57.672
LGA    E   218_A      E   218_A     1.371     0    0.109   0.908     4.781   81.429   67.037
LGA    A   219_A      A   219_A     1.714     0    0.044   0.051     1.944   72.857   72.857
LGA    D   220_A      D   220_A     1.187     0    0.094   0.284     1.321   83.690   85.952
LGA    L   221_A      L   221_A     1.502     0    0.255   0.222     2.079   70.833   76.131
LGA    D   222_A      D   222_A     1.400     0    0.156   1.133     3.677   77.143   70.357
LGA    G   223_A      G   223_A     1.385     0    0.080   0.080     1.415   83.690   83.690
LGA    D   224_A      D   224_A     1.384     0    0.094   1.130     2.781   83.690   79.702
LGA    G   225_A      G   225_A     0.575     0    0.065   0.065     0.650   95.238   95.238
LGA    K   226_A      K   226_A     0.811     0    0.107   0.902     5.634   88.333   67.725
LGA    L   227_A      L   227_A     1.412     0    0.036   0.085     1.700   81.429   78.214
LGA    G   228_A      G   228_A     1.483     0    0.024   0.024     1.564   79.286   79.286
LGA    F   229_A      F   229_A     0.999     0    0.019   0.241     1.250   88.214   88.874
LGA    A   230_A      A   230_A     0.456     0    0.022   0.044     0.635   92.857   94.286
LGA    D   231_A      D   231_A     0.887     0    0.055   0.289     1.496   85.952   83.690
LGA    F   232_A      F   232_A     1.469     0    0.048   0.271     2.800   79.286   70.866
LGA    E   233_A      E   233_A     0.975     0    0.033   0.633     2.318   81.548   78.836
LGA    D   234_A      D   234_A     1.731     0    0.025   0.141     2.589   69.048   70.952
LGA    M   235_A      M   235_A     2.724     0    0.094   1.104     4.282   55.595   51.250
LGA    I   236_A      I   236_A     1.853     0    0.118   1.399     2.941   68.810   68.929
LGA    A   237_A      A   237_A     2.765     0    0.056   0.079     4.546   51.190   50.952
LGA    K   238_A      K   238_A     5.187     0    0.025   0.996     6.576   24.524   37.196
LGA    A   239_A      A   239_A     5.541     0    0.291   0.312     7.464   18.690   19.238
LGA    P   240_A      P   240_A     6.632     0    0.075   0.165     7.462   14.524   18.299
LGA    D   241_A      D   241_A     6.222     0    0.037   0.395     7.126   14.405   21.726
LGA    F   242_A      F   242_A     7.104     0    0.121   1.104     8.826   10.833    8.442
LGA    L   243_A      L   243_A     7.323     0    0.252   0.805     8.293   12.619   10.357
LGA    S   244_A      S   244_A     7.486     0    0.132   0.531     9.544   10.119    7.619
LGA    T   245_A      T   245_A     7.219     0    0.107   0.197     8.962   15.714   10.748
LGA    F   246_A      F   246_A     3.922     0    0.328   0.520     4.962   45.476   42.987
LGA    H   247_A      H   247_A     1.915     0    0.177   1.236     6.696   70.833   46.476
LGA    I   248_A      I   248_A     1.384     0    0.093   1.054     3.110   77.143   67.321
LGA    R   249_A      R   249_A     1.277     6    0.029   0.071     1.458   81.429   37.013
LGA    I   250_A      I   250_A     1.395     0    0.151   0.517     2.157   75.119   76.190

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      239     956    956  100.00    1927   1927  100.00               239
SUMMARY(RMSD_GDC):    52.331         52.311                 52.057           58.425   54.972

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  250  239    4.0    176    1.66    64.226    64.785     9.982

LGA_LOCAL      RMSD:   1.663  Number of atoms:  176  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  67.312  Number of assigned atoms:  239 
Std_ASGN_ATOMS RMSD:  52.331  Standard rmsd on all 239 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.419387 * X  +  -0.652727 * Y  +  -0.630922 * Z  +  -9.142343
  Y_new =   0.898077 * X  +   0.196829 * Y  +   0.393338 * Z  +  -0.477119
  Z_new =  -0.132559 * X  +  -0.731578 * Y  +   0.668747 * Z  +  34.931133 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  1.133910  0.132950 -0.830237   [DEG:   64.9682    7.6175  -47.5691 ]
ZXZ: -2.128269  0.838274 -2.962342   [DEG: -121.9408   48.0296 -169.7297 ]
 
# END of job
