
#######################################################
#                                                     #
#                        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  175 ( 1482),  selected  173 , name one
# Molecule2: number of CA atoms  173 ( 1441),  selected  173 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:B  -ch2:A  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   173       3_A - 175_A       1.25     1.25
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   173       3_A - 175_A       1.25     1.25
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   144      13_A - 156_A       1.00     1.26
  LCS_AVERAGE:     81.32

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  173
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_B     G     3_A    137  173  173      0    3   20   29   63   79  159  169  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     R     4_B     R     4_A    143  173  173     42   97  142  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     H     5_B     H     5_A    143  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     S     6_B     S     6_A    143  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     V     7_B     V     7_A    143  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     V     8_B     V     8_A    143  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     R     9_B     R     9_A    143  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     V    10_B     V    10_A    143  173  173     61  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     E    11_B     E    11_A    143  173  173     43  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     G    12_B     G    12_A    143  173  173      8   48  141  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     D    13_B     D    13_A    144  173  173     41  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     R    14_B     R    14_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     A    15_B     A    15_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     I    16_B     I    16_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     K    17_B     K    17_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     Q    18_B     Q    18_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     F    19_B     F    19_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     F    20_B     F    20_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     P    21_B     P    21_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     A    22_B     A    22_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     Y    23_B     Y    23_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     R    24_B     R    24_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     Y    25_B     Y    25_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     N    26_B     N    26_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     F    27_B     F    27_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     W    28_B     W    28_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     K    29_B     K    29_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     E    30_B     E    30_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     A    31_B     A    31_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     G    32_B     G    32_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     F    33_B     F    33_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     L    34_B     L    34_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     S    35_B     S    35_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     L    36_B     L    36_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     L    37_B     L    37_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     Q    38_B     Q    38_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     E    39_B     E    39_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     F    40_B     F    40_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     D    41_B     D    41_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     F    42_B     F    42_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     V    43_B     V    43_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     P    44_B     P    44_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     R    45_B     R    45_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     L    46_B     L    46_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     Y    47_B     Y    47_A    144  173  173     55  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     S    48_B     S    48_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     I    49_B     I    49_A    144  173  173     52  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     N    50_B     N    50_A    144  173  173     57  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     P    51_B     P    51_A    144  173  173     57  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     E    52_B     E    52_A    144  173  173     47  104  144  164  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     K    53_B     K    53_A    144  173  173     54  115  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     L    54_B     L    54_A    144  173  173     62  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     E    55_B     E    55_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     I    56_B     I    56_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     E    57_B     E    57_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     M    58_B     M    58_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     E    59_B     E    59_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     F    60_B     F    60_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     I    61_B     I    61_A    144  173  173     54  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     E    62_B     E    62_A    144  173  173     44  106  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     G    63_B     G    63_A    144  173  173     54  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     R    64_B     R    64_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     P    65_B     P    65_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     I    66_B     I    66_A    144  173  173     54  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     K    67_B     K    67_A    144  173  173     46  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     D    68_B     D    68_A    144  173  173     50  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     V    69_B     V    69_A    144  173  173     49  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     I    70_B     I    70_A    144  173  173     49  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     N    71_B     N    71_A    144  173  173     45  114  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     E    72_B     E    72_A    144  173  173     41  112  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     L    73_B     L    73_A    144  173  173     45  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     N    74_B     N    74_A    144  173  173     45  112  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     S    75_B     S    75_A    144  173  173     45  111  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     E    76_B     E    76_A    144  173  173     45  111  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     T    77_B     T    77_A    144  173  173     45  114  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     I    78_B     I    78_A    144  173  173     45  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     G    79_B     G    79_A    144  173  173     45  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     R    80_B     R    80_A    144  173  173     45  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     I    81_B     I    81_A    144  173  173     49  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     L    82_B     L    82_A    144  173  173     49  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     D    83_B     D    83_A    144  173  173     50  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     I    84_B     I    84_A    144  173  173     54  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     C    85_B     C    85_A    144  173  173     60  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     R    86_B     R    86_A    144  173  173     61  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     K    87_B     K    87_A    144  173  173     59  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     L    88_B     L    88_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     D    89_B     D    89_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     V    90_B     V    90_A    144  173  173     61  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     L    91_B     L    91_A    144  173  173     42  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     G    92_B     G    92_A    144  173  173     57  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     I    93_B     I    93_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     Q    94_B     Q    94_A    144  173  173     57  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     K    95_B     K    95_A    144  173  173     57  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     E    96_B     E    96_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     E    97_B     E    97_A    144  173  173      4   83  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     M    98_B     M    98_A    144  173  173     54  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     N    99_B     N    99_A    144  173  173     47  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     H   100_B     H   100_A    144  173  173     45  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     P   101_B     P   101_A    144  173  173     54  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     D   102_B     D   102_A    144  173  173     54  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     R   103_B     R   103_A    144  173  173     54  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     H   104_B     H   104_A    144  173  173     43  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     I   105_B     I   105_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     I   106_B     I   106_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     I   107_B     I   107_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     S   108_B     S   108_A    144  173  173     36   83  136  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     D   109_B     D   109_A    144  173  173     36   80  121  160  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     R   110_B     R   110_A    144  173  173     45  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     I   111_B     I   111_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     V   112_B     V   112_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     F   113_B     F   113_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     I   114_B     I   114_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     D   115_B     D   115_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     F   116_B     F   116_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     E   117_B     E   117_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     R   118_B     R   118_A    144  173  173     54  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     G   119_B     G   119_A    144  173  173     51  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     V   120_B     V   120_A    144  173  173     57  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     I   121_B     I   121_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     K   122_B     K   122_A    144  173  173     57  113  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     C   123_B     C   123_A    144  173  173     21   95  140  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     R   124_B     R   124_A    144  173  173     17   92  131  164  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     P   125_B     P   125_A    144  173  173     63  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     S   126_B     S   126_A    144  173  173     45  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     N   127_B     N   127_A    144  173  173     55  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     L   128_B     L   128_A    144  173  173     49  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     T   129_B     T   129_A    144  173  173     45  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     Q   130_B     Q   130_A    144  173  173     45  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     F   131_B     F   131_A    144  173  173     47  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     A   132_B     A   132_A    144  173  173     45  113  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     V   133_B     V   133_A    144  173  173     40  107  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     Y   134_B     Y   134_A    144  173  173     43  111  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     L   135_B     L   135_A    144  173  173     47  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     N   136_B     N   136_A    144  173  173     45  111  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     S   137_B     S   137_A    144  173  173     43  107  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     R   138_B     R   138_A    144  173  173     45  114  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     L   139_B     L   139_A    144  173  173     45  114  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     R   140_B     R   140_A    144  173  173     45  108  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     L   141_B     L   141_A    144  173  173     43  103  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     M   142_B     M   142_A    144  173  173     36   88  133  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     K   143_B     K   143_A    144  173  173     36   87  129  164  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     N   144_B     N   144_A    144  173  173     36   87  130  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     E   145_B     E   145_A    144  173  173     36   80  127  163  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     E   146_B     E   146_A    144  173  173     36   89  129  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     L   147_B     L   147_A    144  173  173     40   95  147  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     K   148_B     K   148_A    144  173  173     40   95  150  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     K   149_B     K   149_A    144  173  173     40   95  150  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     L   150_B     L   150_A    144  173  173     36   99  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     L   151_B     L   151_A    144  173  173     45  111  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     R   152_B     R   152_A    144  173  173     45  111  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     E   153_B     E   153_A    144  173  173     41  111  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     Y   154_B     Y   154_A    144  173  173     43  113  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     K   155_B     K   155_A    144  173  173     47  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     K   156_B     K   156_A    144  173  173      3  109  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     G   157_B     G   157_A    120  173  173      3    4   14  132  144  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     F   158_B     F   158_A    120  173  173      3   83  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     D   159_B     D   159_A    120  173  173     32  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     D   160_B     D   160_A    120  173  173     18  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     E   161_B     E   161_A    120  173  173     13  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     S   162_B     S   162_A    120  173  173     18  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     Y   163_B     Y   163_A    120  173  173     13  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     R   164_B     R   164_A    120  173  173     28  116  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     E   165_B     E   165_A    120  173  173     28  111  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     L   166_B     L   166_A    120  173  173     28  111  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     R   167_B     R   167_A    120  173  173     28  111  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     T   168_B     T   168_A    120  173  173     28  111  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     Q   169_B     Q   169_A    120  173  173     14   82  150  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     I   170_B     I   170_A    120  173  173     14   89  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     L   171_B     L   171_A    120  173  173     21   95  151  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     Q   172_B     Q   172_A    120  173  173     21   80  139  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     Y   173_B     Y   173_A    120  173  173     13   80  133  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     M   174_B     M   174_A    120  173  173      7   80  133  165  170  171  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_GDT     K   175_B     K   175_A     18  173  173      0   13   28   87  109  144  172  172  173  173  173  173  173  173  173  173  173  173  173  173 
LCS_AVERAGE  LCS_A:  93.77  (  81.32  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     63    116    151    165    170    171    172    172    173    173    173    173    173    173    173    173    173    173    173    173 
GDT PERCENT_AT  36.42  67.05  87.28  95.38  98.27  98.84  99.42  99.42 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00
GDT RMS_LOCAL    0.33   0.63   0.85   1.00   1.06   1.09   1.15   1.15   1.25   1.25   1.25   1.25   1.25   1.25   1.25   1.25   1.25   1.25   1.25   1.25
GDT RMS_ALL_AT   1.87   1.46   1.28   1.25   1.25   1.25   1.25   1.25   1.25   1.25   1.25   1.25   1.25   1.25   1.25   1.25   1.25   1.25   1.25   1.25

# Checking swapping
#   possible swapping detected:  E    11_B      E    11_A
#   possible swapping detected:  F    19_B      F    19_A
#   possible swapping detected:  Y    25_B      Y    25_A
#   possible swapping detected:  F    27_B      F    27_A
#   possible swapping detected:  E    30_B      E    30_A
#   possible swapping detected:  E    39_B      E    39_A
#   possible swapping detected:  F    42_B      F    42_A
#   possible swapping detected:  E    55_B      E    55_A
#   possible swapping detected:  E    59_B      E    59_A
#   possible swapping detected:  E    62_B      E    62_A
#   possible swapping detected:  E    72_B      E    72_A
#   possible swapping detected:  E    76_B      E    76_A
#   possible swapping detected:  E    96_B      E    96_A
#   possible swapping detected:  F   113_B      F   113_A
#   possible swapping detected:  F   116_B      F   116_A
#   possible swapping detected:  E   117_B      E   117_A
#   possible swapping detected:  F   131_B      F   131_A
#   possible swapping detected:  Y   134_B      Y   134_A
#   possible swapping detected:  E   153_B      E   153_A
#   possible swapping detected:  Y   154_B      Y   154_A
#   possible swapping detected:  E   161_B      E   161_A
#   possible swapping detected:  Y   163_B      Y   163_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    G     3_B      G     3_A     6.590     0    0.360   0.360     8.099   16.667   16.667
LGA    R     4_B      R     4_A     1.926     0    0.602   1.370    13.323   70.833   33.593
LGA    H     5_B      H     5_A     1.321     0    0.094   0.213     1.552   79.286   85.095
LGA    S     6_B      S     6_A     1.126     0    0.020   0.069     1.152   81.429   81.429
LGA    V     7_B      V     7_A     1.188     0    0.032   0.051     1.384   83.690   82.721
LGA    V     8_B      V     8_A     0.867     0    0.018   0.078     1.017   88.214   89.184
LGA    R     9_B      R     9_A     0.897     0    0.122   0.947     3.282   90.476   81.126
LGA    V    10_B      V    10_A     0.521     0    0.014   0.023     0.873   92.857   93.197
LGA    E    11_B      E    11_A     1.159     0    0.132   0.140     1.855   83.690   79.577
LGA    G    12_B      G    12_A     1.951     0    0.050   0.050     1.951   72.857   72.857
LGA    D    13_B      D    13_A     1.289     0    0.022   0.331     1.480   83.690   82.560
LGA    R    14_B      R    14_A     0.740     0    0.043   1.101     5.110   90.476   73.939
LGA    A    15_B      A    15_A     0.409     0    0.046   0.042     0.457  100.000  100.000
LGA    I    16_B      I    16_A     0.663     0    0.028   0.034     0.756   90.476   90.476
LGA    K    17_B      K    17_A     0.784     0    0.033   0.080     0.856   90.476   90.476
LGA    Q    18_B      Q    18_A     0.963     0    0.040   0.177     1.304   90.476   86.455
LGA    F    19_B      F    19_A     1.079     0    0.023   0.036     1.318   81.429   87.186
LGA    F    20_B      F    20_A     1.455     0    0.044   0.155     1.841   81.429   75.974
LGA    P    21_B      P    21_A     1.603     0    0.048   0.093     2.016   75.000   72.925
LGA    A    22_B      A    22_A     1.450     0    0.035   0.048     1.651   79.286   78.000
LGA    Y    23_B      Y    23_A     0.957     0    0.054   0.209     1.294   88.214   84.444
LGA    R    24_B      R    24_A     0.787     0    0.036   1.115     4.877   90.476   79.048
LGA    Y    25_B      Y    25_A     0.775     0    0.011   0.124     1.340   90.476   87.460
LGA    N    26_B      N    26_A     0.433     0    0.034   0.303     1.383  100.000   94.107
LGA    F    27_B      F    27_A     0.362     0    0.018   0.041     0.590  100.000   95.671
LGA    W    28_B      W    28_A     0.348     0    0.027   0.073     0.765  100.000   94.558
LGA    K    29_B      K    29_A     0.343     0    0.062   1.107     6.671  100.000   76.772
LGA    E    30_B      E    30_A     0.225     0    0.033   0.597     2.182  100.000   91.005
LGA    A    31_B      A    31_A     0.021     0    0.009   0.014     0.136  100.000  100.000
LGA    G    32_B      G    32_A     0.062     0    0.016   0.016     0.134  100.000  100.000
LGA    F    33_B      F    33_A     0.231     0    0.042   0.070     0.990  100.000   94.805
LGA    L    34_B      L    34_A     0.216     0    0.013   0.063     0.385  100.000  100.000
LGA    S    35_B      S    35_A     0.221     0    0.005   0.011     0.254  100.000  100.000
LGA    L    36_B      L    36_A     0.229     0    0.115   1.372     3.882  100.000   83.155
LGA    L    37_B      L    37_A     0.373     0    0.060   0.101     0.628   97.619   97.619
LGA    Q    38_B      Q    38_A     0.481     0    0.013   0.124     0.777   95.238   97.884
LGA    E    39_B      E    39_A     0.833     0    0.032   0.160     1.076   88.214   89.471
LGA    F    40_B      F    40_A     0.904     0    0.046   0.109     1.504   90.476   86.407
LGA    D    41_B      D    41_A     0.804     0    0.029   0.159     1.076   90.476   89.345
LGA    F    42_B      F    42_A     0.725     0    0.027   0.054     0.725   90.476   93.939
LGA    V    43_B      V    43_A     0.425     0    0.014   0.077     0.612   95.238   95.918
LGA    P    44_B      P    44_A     0.446     0    0.004   0.058     0.462  100.000  100.000
LGA    R    45_B      R    45_A     0.690     0    0.031   1.639     7.060   90.476   63.247
LGA    L    46_B      L    46_A     0.737     0    0.046   0.205     1.053   90.476   89.345
LGA    Y    47_B      Y    47_A     1.081     0    0.038   0.064     1.214   83.690   85.198
LGA    S    48_B      S    48_A     1.104     0    0.019   0.050     1.104   83.690   82.937
LGA    I    49_B      I    49_A     1.296     0    0.126   1.225     4.150   79.286   68.988
LGA    N    50_B      N    50_A     1.424     0    0.054   0.073     1.796   81.429   78.214
LGA    P    51_B      P    51_A     1.481     0    0.020   0.066     1.708   77.143   75.306
LGA    E    52_B      E    52_A     2.026     3    0.032   0.034     2.431   68.810   44.974
LGA    K    53_B      K    53_A     1.649     0    0.028   0.448     2.080   75.000   72.011
LGA    L    54_B      L    54_A     1.253     0    0.030   0.073     1.489   81.429   81.429
LGA    E    55_B      E    55_A     0.977     0    0.035   0.104     1.310   88.214   85.450
LGA    I    56_B      I    56_A     0.581     0    0.034   0.078     0.689   92.857   96.429
LGA    E    57_B      E    57_A     0.501     0    0.048   0.806     3.662   92.857   75.185
LGA    M    58_B      M    58_A     0.442     0    0.019   0.238     0.486  100.000  100.000
LGA    E    59_B      E    59_A     0.556     0    0.018   0.107     1.090   97.619   90.635
LGA    F    60_B      F    60_A     0.464     0    0.020   0.344     1.249   95.238   93.160
LGA    I    61_B      I    61_A     0.896     0    0.019   0.055     1.088   85.952   87.083
LGA    E    62_B      E    62_A     1.332     0    0.086   0.576     3.610   79.286   68.942
LGA    G    63_B      G    63_A     1.309     0    0.028   0.028     1.519   79.286   79.286
LGA    R    64_B      R    64_A     1.211     0    0.043   1.130     5.528   81.429   63.117
LGA    P    65_B      P    65_A     1.036     0    0.030   0.314     1.223   85.952   84.014
LGA    I    66_B      I    66_A     0.669     0    0.016   0.048     0.758   90.476   90.476
LGA    K    67_B      K    67_A     0.965     0    0.029   0.569     2.605   88.214   81.746
LGA    D    68_B      D    68_A     1.002     0    0.072   0.154     1.527   85.952   82.619
LGA    V    69_B      V    69_A     0.521     0    0.035   0.038     0.845   92.857   91.837
LGA    I    70_B      I    70_A     0.356     0    0.026   0.121     0.554  100.000   98.810
LGA    N    71_B      N    71_A     0.324     0    0.029   1.099     2.539   95.238   87.857
LGA    E    72_B      E    72_A     0.760     0    0.040   1.000     3.905   90.476   75.291
LGA    L    73_B      L    73_A     0.420     0    0.015   0.072     0.804  100.000   97.619
LGA    N    74_B      N    74_A     0.621     0    0.016   0.183     1.410   92.857   90.536
LGA    S    75_B      S    75_A     0.610     0    0.016   0.045     1.209   90.476   88.968
LGA    E    76_B      E    76_A     0.882     0    0.043   0.121     1.193   90.476   86.455
LGA    T    77_B      T    77_A     0.827     0    0.015   0.029     0.999   90.476   90.476
LGA    I    78_B      I    78_A     0.446     0    0.012   0.071     0.639   97.619   97.619
LGA    G    79_B      G    79_A     0.299     0    0.024   0.024     0.484  100.000  100.000
LGA    R    80_B      R    80_A     0.683     0    0.036   1.131     5.731   90.476   62.944
LGA    I    81_B      I    81_A     0.643     0    0.010   0.046     0.674   90.476   90.476
LGA    L    82_B      L    82_A     0.469     0    0.004   0.125     0.668   92.857   95.238
LGA    D    83_B      D    83_A     0.654     0    0.022   0.050     0.817   90.476   90.476
LGA    I    84_B      I    84_A     0.611     0    0.025   0.037     0.648   90.476   90.476
LGA    C    85_B      C    85_A     0.595     0    0.026   0.064     0.749   90.476   92.063
LGA    R    86_B      R    86_A     0.884     0    0.021   1.159     5.526   88.214   74.199
LGA    K    87_B      K    87_A     0.982     0    0.010   0.263     1.929   88.214   85.503
LGA    L    88_B      L    88_A     0.853     0    0.009   0.070     0.984   90.476   90.476
LGA    D    89_B      D    89_A     1.078     0    0.010   0.060     1.188   83.690   82.560
LGA    V    90_B      V    90_A     1.212     0    0.003   0.137     1.451   81.429   81.429
LGA    L    91_B      L    91_A     1.199     0    0.046   0.042     1.313   81.429   82.560
LGA    G    92_B      G    92_A     1.182     0    0.058   0.058     1.182   83.690   83.690
LGA    I    93_B      I    93_A     0.812     0    0.033   0.079     0.961   90.476   90.476
LGA    Q    94_B      Q    94_A     0.716     0    0.051   0.420     1.736   90.476   86.508
LGA    K    95_B      K    95_A     0.949     0    0.025   0.271     1.598   90.476   84.497
LGA    E    96_B      E    96_A     1.086     0    0.661   0.779     3.350   73.571   79.101
LGA    E    97_B      E    97_A     1.237     0    0.094   0.573     3.989   90.714   69.153
LGA    M    98_B      M    98_A     0.369     0    0.020   0.134     1.191   92.976   94.107
LGA    N    99_B      N    99_A     1.459     0    0.069   0.259     2.168   81.429   76.131
LGA    H   100_B      H   100_A     0.808     0    0.021   0.070     1.048   90.476   88.667
LGA    P   101_B      P   101_A     0.803     0    0.071   0.086     0.854   90.476   90.476
LGA    D   102_B      D   102_A     0.834     0    0.021   0.603     1.542   90.476   87.143
LGA    R   103_B      R   103_A     0.708     0    0.066   1.227     6.805   85.952   69.134
LGA    H   104_B      H   104_A     1.204     0    0.050   0.822     3.185   83.690   75.905
LGA    I   105_B      I   105_A     0.934     0    0.029   0.043     1.033   85.952   88.214
LGA    I   106_B      I   106_A     1.001     0    0.027   0.570     2.519   81.429   81.786
LGA    I   107_B      I   107_A     1.126     0    0.049   0.632     1.393   81.429   82.560
LGA    S   108_B      S   108_A     1.806     0    0.095   0.644     2.550   75.000   70.317
LGA    D   109_B      D   109_A     2.357     0    0.056   0.309     3.306   68.810   62.083
LGA    R   110_B      R   110_A     0.954     0    0.014   0.750     2.707   83.690   77.100
LGA    I   111_B      I   111_A     0.848     0    0.020   0.058     0.883   90.476   90.476
LGA    V   112_B      V   112_A     0.843     0    0.031   0.041     1.055   90.476   89.184
LGA    F   113_B      F   113_A     0.636     0    0.033   0.205     1.008   90.476   91.385
LGA    I   114_B      I   114_A     0.420     0    0.033   0.104     0.622   95.238   94.048
LGA    D   115_B      D   115_A     0.497     0    0.034   0.104     0.567   95.238   96.429
LGA    F   116_B      F   116_A     0.438     0    0.014   0.034     0.438  100.000  100.000
LGA    E   117_B      E   117_A     0.380     0    0.041   0.499     1.461  100.000   94.815
LGA    R   118_B      R   118_A     0.504     0    0.072   0.981     4.050   97.619   84.416
LGA    G   119_B      G   119_A     0.606     0    0.020   0.020     0.624   90.476   90.476
LGA    V   120_B      V   120_A     0.599     0    0.041   0.071     0.772   92.857   93.197
LGA    I   121_B      I   121_A     0.812     0    0.070   0.619     2.498   88.214   86.131
LGA    K   122_B      K   122_A     1.417     0    0.048   0.820     3.294   79.286   71.587
LGA    C   123_B      C   123_A     2.019     0    0.045   0.043     2.353   66.786   66.111
LGA    R   124_B      R   124_A     2.375     0    0.066   1.194     5.820   68.810   50.390
LGA    P   125_B      P   125_A     1.160     0    0.028   0.347     1.652   83.810   81.565
LGA    S   126_B      S   126_A     0.608     0    0.017   0.036     0.913   90.476   90.476
LGA    N   127_B      N   127_A     0.721     0    0.029   0.104     1.250   92.857   88.274
LGA    L   128_B      L   128_A     0.265     0    0.010   0.097     0.597  100.000   98.810
LGA    T   129_B      T   129_A     0.320     0    0.060   1.045     2.690   97.619   87.483
LGA    Q   130_B      Q   130_A     0.443     0    0.018   0.173     1.013  100.000   94.762
LGA    F   131_B      F   131_A     0.378     0    0.032   0.126     0.433  100.000  100.000
LGA    A   132_B      A   132_A     0.489     0    0.020   0.018     0.672   95.238   94.286
LGA    V   133_B      V   133_A     1.079     0    0.015   0.050     1.439   83.690   82.721
LGA    Y   134_B      Y   134_A     0.973     0    0.014   0.045     1.454   88.214   84.444
LGA    L   135_B      L   135_A     0.201     0    0.007   0.320     1.014  100.000   95.298
LGA    N   136_B      N   136_A     0.722     0    0.007   0.188     1.094   90.476   89.345
LGA    S   137_B      S   137_A     1.065     0    0.062   0.472     1.884   88.214   84.524
LGA    R   138_B      R   138_A     0.785     0    0.022   0.949     3.745   90.476   83.810
LGA    L   139_B      L   139_A     0.432     0    0.035   0.078     0.628   92.857   94.048
LGA    R   140_B      R   140_A     0.951     0    0.026   1.109     6.827   90.476   65.022
LGA    L   141_B      L   141_A     1.236     0    0.030   0.056     1.652   77.143   81.548
LGA    M   142_B      M   142_A     1.857     0    0.029   0.820     3.302   72.857   70.000
LGA    K   143_B      K   143_A     2.180     4    0.029   0.038     2.408   64.762   35.979
LGA    N   144_B      N   144_A     2.052     3    0.005   0.006     2.129   66.786   41.488
LGA    E   145_B      E   145_A     2.289     4    0.009   0.010     2.492   64.762   35.979
LGA    E   146_B      E   146_A     2.061     4    0.034   0.036     2.109   66.786   36.878
LGA    L   147_B      L   147_A     1.615     0    0.015   0.080     1.824   77.143   77.143
LGA    K   148_B      K   148_A     1.571     0    0.006   0.354     2.383   75.000   72.963
LGA    K   149_B      K   149_A     1.581     0    0.013   0.829     5.902   77.143   56.772
LGA    L   150_B      L   150_A     1.339     0    0.007   1.154     3.593   81.429   73.631
LGA    L   151_B      L   151_A     0.771     0    0.007   0.119     1.027   90.595   91.726
LGA    R   152_B      R   152_A     0.721     0    0.023   0.997     4.711   92.857   80.346
LGA    E   153_B      E   153_A     0.792     0    0.007   0.291     1.664   90.476   84.497
LGA    Y   154_B      Y   154_A     0.535     0    0.011   0.110     0.909   92.857   94.444
LGA    K   155_B      K   155_A     0.403     0    0.079   0.704     1.699   92.976   88.730
LGA    K   156_B      K   156_A     1.083     0    0.026   0.464     3.069   77.381   74.233
LGA    G   157_B      G   157_A     3.278     0    0.359   0.359     3.278   59.167   59.167
LGA    F   158_B      F   158_A     1.373     0    0.158   1.183     2.396   81.548   76.926
LGA    D   159_B      D   159_A     1.185     0    0.088   0.602     3.780   83.690   73.571
LGA    D   160_B      D   160_A     1.364     0    0.007   0.826     2.530   81.429   74.167
LGA    E   161_B      E   161_A     1.612     0    0.038   0.355     2.404   77.143   73.016
LGA    S   162_B      S   162_A     1.411     0    0.053   0.265     1.481   81.429   82.937
LGA    Y   163_B      Y   163_A     1.072     0    0.014   0.162     1.242   85.952   92.937
LGA    R   164_B      R   164_A     0.852     0    0.025   1.273     7.958   90.476   57.056
LGA    E   165_B      E   165_A     1.000     0    0.008   0.506     2.788   88.214   76.190
LGA    L   166_B      L   166_A     0.959     0    0.040   0.097     1.006   85.952   88.214
LGA    R   167_B      R   167_A     0.776     0    0.013   0.231     0.908   90.476   91.342
LGA    T   168_B      T   168_A     0.868     0    0.017   0.050     1.351   85.952   87.891
LGA    Q   169_B      Q   169_A     1.594     0    0.022   0.546     2.952   75.000   73.016
LGA    I   170_B      I   170_A     1.446     0    0.014   0.065     1.643   79.286   80.357
LGA    L   171_B      L   171_A     1.366     0    0.021   0.046     1.853   77.143   81.548
LGA    Q   172_B      Q   172_A     1.696     0    0.057   1.193     6.220   72.857   58.519
LGA    Y   173_B      Y   173_A     1.846     0    0.091   0.195     2.451   70.833   68.810
LGA    M   174_B      M   174_A     1.809     0    0.655   0.526     3.203   63.214   75.714
LGA    K   175_B      K   175_A     4.826     4    0.100   0.105     7.474   47.262   22.116

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      173     692    692  100.00    1441   1441  100.00               173
SUMMARY(RMSD_GDC):     1.247          1.222                  1.710           86.550   81.902

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  175  173    4.0    172    1.15    90.462    95.878    13.790

LGA_LOCAL      RMSD:   1.147  Number of atoms:  172  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   1.249  Number of assigned atoms:  173 
Std_ASGN_ATOMS RMSD:   1.247  Standard rmsd on all 173 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.091359 * X  +   0.022310 * Y  +  -0.995568 * Z  +  14.230384
  Y_new =  -0.873381 * X  +  -0.482075 * Y  +   0.069343 * Z  + -26.891340
  Z_new =  -0.478392 * X  +   0.875846 * Y  +   0.063527 * Z  +   7.051185 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -1.675021  0.498823  1.498391   [DEG:  -95.9716   28.5804   85.8515 ]
ZXZ: -1.640336  1.507227 -0.499925   [DEG:  -93.9843   86.3577  -28.6436 ]
 
# END of job
