
#######################################################
#                                                     #
#                        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  187 ( 1458),  selected  126 , name one
# Molecule2: number of CA atoms  126 (  936),  selected  126 , 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:   126      59_A - 187_A       0.83     0.83
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   126      59_A - 187_A       0.83     0.83
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   126      59_A - 187_A       0.83     0.83
  LCS_AVERAGE:    100.00

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  126
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     R    59_A     R    59_A    126  126  126      0   25   43   67   80  105  124  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     R    60_A     R    60_A    126  126  126     32  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     V    61_A     V    61_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     K    62_A     K    62_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L    63_A     L    63_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     R    64_A     R    64_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     K    65_A     K    65_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     H    66_A     H    66_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L    67_A     L    67_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     V    68_A     V    68_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     E    69_A     E    69_A    126  126  126     78  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     I    70_A     I    70_A    126  126  126     78  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     N    71_A     N    71_A    126  126  126     73  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     A    72_A     A    72_A    126  126  126      5  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     D    73_A     D    73_A    126  126  126     65  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     E    74_A     E    74_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     I    75_A     I    75_A    126  126  126     50  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     T    76_A     T    76_A    126  126  126     74  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     I    77_A     I    77_A    126  126  126     77  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     T    78_A     T    78_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L    79_A     L    79_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     S    80_A     S    80_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     R    81_A     R    81_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     Y    82_A     Y    82_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     T    83_A     T    83_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     S    84_A     S    84_A    126  126  126     46  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     P    85_A     P    85_A    126  126  126     45  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     E    86_A     E    86_A    126  126  126     28  117  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     A    87_A     A    87_A    126  126  126     32  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L    88_A     L    88_A    126  126  126     71  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     E    89_A     E    89_A    126  126  126     55  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     R    90_A     R    90_A    126  126  126     32  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     S    91_A     S    91_A    126  126  126     77  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     I    92_A     I    92_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     T    93_A     T    93_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     A    94_A     A    94_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L    95_A     L    95_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     A    96_A     A    96_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     A    97_A     A    97_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     M    98_A     M    98_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     T    99_A     T    99_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     G   100_A     G   100_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     H   101_A     H   101_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     A   102_A     A   102_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     P   103_A     P   103_A    126  126  126     78  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     S   104_A     S   104_A    126  126  126     69  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     S   105_A     S   105_A    126  126  126     77  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     I   106_A     I   106_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     K   107_A     K   107_A    126  126  126     77  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     E   108_A     E   108_A    126  126  126     76  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     E   109_A     E   109_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     C   110_A     C   110_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     V   111_A     V   111_A    126  126  126     69  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     E   112_A     E   112_A    126  126  126     78  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L   113_A     L   113_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     I   114_A     I   114_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     D   115_A     D   115_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     K   116_A     K   116_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L   117_A     L   117_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     D   118_A     D   118_A    126  126  126     39  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     W   119_A     W   119_A    126  126  126     39  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L   120_A     L   120_A    126  126  126     78  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     R   121_A     R   121_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     V   122_A     V   122_A    126  126  126     68  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     E   123_A     E   123_A    126  126  126     49  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     N   124_A     N   124_A    126  126  126      3   70  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     D   125_A     D   125_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     V   126_A     V   126_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     I   127_A     I   127_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     Q   128_A     Q   128_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     Y   129_A     Y   129_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     P   130_A     P   130_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     T   131_A     T   131_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L   132_A     L   132_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     S   133_A     S   133_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     K   134_A     K   134_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L   135_A     L   135_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L   136_A     L   136_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     E   137_A     E   137_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L   138_A     L   138_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     Y   139_A     Y   139_A    126  126  126     78  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     N   140_A     N   140_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     S   141_A     S   141_A    126  126  126     78  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     Q   142_A     Q   142_A    126  126  126     28  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     N   143_A     N   143_A    126  126  126     28  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     H   147_A     H   147_A    126  126  126     49  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L   148_A     L   148_A    126  126  126     77  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     S   149_A     S   149_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     I   150_A     I   150_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     E   151_A     E   151_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     K   152_A     K   152_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L   153_A     L   153_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     I   154_A     I   154_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     A   155_A     A   155_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     G   156_A     G   156_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L   157_A     L   157_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     A   158_A     A   158_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     V   159_A     V   159_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     R   160_A     R   160_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     R   161_A     R   161_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     K   162_A     K   162_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     V   163_A     V   163_A    126  126  126     77  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     C   164_A     C   164_A    126  126  126     32  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     K   165_A     K   165_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L   166_A     L   166_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     V   167_A     V   167_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     Q   168_A     Q   168_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     D   169_A     D   169_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     G   170_A     G   170_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     H   171_A     H   171_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     I   172_A     I   172_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     D   173_A     D   173_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     E   174_A     E   174_A    126  126  126     77  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     T   175_A     T   175_A    126  126  126     77  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     V   176_A     V   176_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     Y   177_A     Y   177_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     R   178_A     R   178_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     A   179_A     A   179_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L   180_A     L   180_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     D   181_A     D   181_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     E   182_A     E   182_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     M   183_A     M   183_A    126  126  126     79  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     A   184_A     A   184_A    126  126  126     70  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     A   185_A     A   185_A    126  126  126     49  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     G   186_A     G   186_A    126  126  126     49  120  124  124  124  124  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     A   187_A     A   187_A    126  126  126      3    3    3    3    4  108  125  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_AVERAGE  LCS_A: 100.00  ( 100.00  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     79    120    124    124    124    124    125    125    126    126    126    126    126    126    126    126    126    126    126    126 
GDT PERCENT_AT  62.70  95.24  98.41  98.41  98.41  98.41  99.21  99.21 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00
GDT RMS_LOCAL    0.34   0.50   0.54   0.54   0.54   0.54   0.68   0.68   0.83   0.83   0.83   0.83   0.83   0.83   0.83   0.83   0.83   0.83   0.83   0.83
GDT RMS_ALL_AT   0.85   0.84   0.83   0.83   0.83   0.83   0.84   0.84   0.83   0.83   0.83   0.83   0.83   0.83   0.83   0.83   0.83   0.83   0.83   0.83

# Checking swapping
#   possible swapping detected:  E    69_A      E    69_A
#   possible swapping detected:  E    74_A      E    74_A
#   possible swapping detected:  E    86_A      E    86_A
#   possible swapping detected:  E    89_A      E    89_A
#   possible swapping detected:  E   112_A      E   112_A
#   possible swapping detected:  Y   129_A      Y   129_A
#   possible swapping detected:  Y   139_A      Y   139_A
#   possible swapping detected:  E   151_A      E   151_A
#   possible swapping detected:  E   182_A      E   182_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    R    59_A      R    59_A     5.444     6    0.527   0.549     6.854   33.690   13.463
LGA    R    60_A      R    60_A     0.962     6    0.537   0.493     3.668   86.071   35.238
LGA    V    61_A      V    61_A     0.209     0    0.054   0.048     0.405  100.000  100.000
LGA    K    62_A      K    62_A     0.205     0    0.088   0.319     2.150  100.000   91.905
LGA    L    63_A      L    63_A     0.494     0    0.038   1.240     2.609   95.238   84.345
LGA    R    64_A      R    64_A     0.280     6    0.066   0.090     0.364  100.000   45.455
LGA    K    65_A      K    65_A     0.437     0    0.041   0.302     1.193  100.000   93.704
LGA    H    66_A      H    66_A     0.287     0    0.065   0.081     0.531  100.000   98.095
LGA    L    67_A      L    67_A     0.151     0    0.038   0.087     0.395  100.000  100.000
LGA    V    68_A      V    68_A     0.167     0    0.044   0.058     0.199  100.000  100.000
LGA    E    69_A      E    69_A     0.420     0    0.080   0.413     2.622  100.000   88.148
LGA    I    70_A      I    70_A     0.424     0    0.030   0.211     0.569   95.238   92.857
LGA    N    71_A      N    71_A     0.515     0    0.066   0.328     1.293   90.476   91.726
LGA    A    72_A      A    72_A     0.861     0    0.129   0.129     1.225   92.857   90.571
LGA    D    73_A      D    73_A     0.594     0    0.157   0.239     1.492   92.857   89.405
LGA    E    74_A      E    74_A     0.348     0    0.022   0.869     2.765   97.619   84.127
LGA    I    75_A      I    75_A     0.683     0    0.064   1.210     3.772   92.857   84.702
LGA    T    76_A      T    76_A     0.495     0    0.047   0.129     0.855   92.857   93.197
LGA    I    77_A      I    77_A     0.491     0    0.023   0.561     1.260  100.000   94.167
LGA    T    78_A      T    78_A     0.234     0    0.009   0.073     0.591  100.000   98.639
LGA    L    79_A      L    79_A     0.113     0    0.019   0.117     0.383  100.000  100.000
LGA    S    80_A      S    80_A     0.119     0    0.071   0.110     0.352  100.000  100.000
LGA    R    81_A      R    81_A     0.173     0    0.048   1.168     3.723  100.000   85.281
LGA    Y    82_A      Y    82_A     0.251     0    0.086   0.063     0.639   97.619   99.206
LGA    T    83_A      T    83_A     0.397     0    0.052   0.082     0.475  100.000  100.000
LGA    S    84_A      S    84_A     0.793     0    0.023   0.129     0.977   90.476   90.476
LGA    P    85_A      P    85_A     0.979     0    0.064   0.080     1.294   85.952   85.306
LGA    E    86_A      E    86_A     1.225     0    0.092   0.151     1.613   81.429   80.476
LGA    A    87_A      A    87_A     0.905     0    0.042   0.052     0.968   90.476   90.476
LGA    L    88_A      L    88_A     0.567     0    0.085   0.145     0.802   90.476   94.048
LGA    E    89_A      E    89_A     0.763     0    0.040   0.204     0.930   90.476   90.476
LGA    R    90_A      R    90_A     0.970     0    0.020   0.135     2.178   90.476   78.615
LGA    S    91_A      S    91_A     0.484     0    0.021   0.060     0.649   97.619   98.413
LGA    I    92_A      I    92_A     0.227     0    0.077   0.163     0.745  100.000   97.619
LGA    T    93_A      T    93_A     0.336     0    0.022   0.064     1.030  100.000   94.626
LGA    A    94_A      A    94_A     0.404     0    0.028   0.027     0.527  100.000   98.095
LGA    L    95_A      L    95_A     0.280     0    0.024   0.107     0.543   97.619   98.810
LGA    A    96_A      A    96_A     0.391     0    0.045   0.066     0.586   97.619   98.095
LGA    A    97_A      A    97_A     0.507     0    0.084   0.115     0.877   92.857   92.381
LGA    M    98_A      M    98_A     0.367     0    0.071   0.134     0.810   95.238   96.429
LGA    T    99_A      T    99_A     0.505     0    0.029   0.044     0.622   92.857   94.558
LGA    G   100_A      G   100_A     0.459     0    0.029   0.029     0.459  100.000  100.000
LGA    H   101_A      H   101_A     0.423     5    0.023   0.029     0.654  100.000   49.048
LGA    A   102_A      A   102_A     0.382     0    0.038   0.079     0.555  100.000   98.095
LGA    P   103_A      P   103_A     0.420     0    0.035   0.050     0.691   95.238   97.279
LGA    S   104_A      S   104_A     0.735     0    0.018   0.192     1.187   90.476   88.968
LGA    S   105_A      S   105_A     0.511     0    0.048   0.489     1.387   95.238   92.143
LGA    I   106_A      I   106_A     0.304     0    0.029   0.115     0.621  100.000   98.810
LGA    K   107_A      K   107_A     0.508     0    0.027   0.259     1.128   92.857   91.587
LGA    E   108_A      E   108_A     0.567     3    0.063   0.709     2.817   90.476   56.614
LGA    E   109_A      E   109_A     0.317     0    0.037   0.632     2.355   97.619   85.079
LGA    C   110_A      C   110_A     0.371     0    0.043   0.043     0.509   97.619   98.413
LGA    V   111_A      V   111_A     0.606     0    0.027   0.069     0.955   90.476   90.476
LGA    E   112_A      E   112_A     0.476     0    0.023   0.399     1.993   97.619   90.688
LGA    L   113_A      L   113_A     0.292     0    0.022   0.138     0.479  100.000  100.000
LGA    I   114_A      I   114_A     0.202     0    0.046   0.098     0.358  100.000  100.000
LGA    D   115_A      D   115_A     0.154     0    0.022   0.783     3.391  100.000   84.940
LGA    K   116_A      K   116_A     0.325     2    0.067   0.091     0.389  100.000   77.778
LGA    L   117_A      L   117_A     0.268     0    0.110   0.147     0.416  100.000  100.000
LGA    D   118_A      D   118_A     0.875     0    0.097   0.625     3.618   90.476   74.226
LGA    W   119_A      W   119_A     0.865     0    0.052   0.176     1.058   90.476   90.544
LGA    L   120_A      L   120_A     0.588     0    0.113   1.366     2.915   95.238   84.345
LGA    R   121_A      R   121_A     0.516     0    0.020   0.966     2.756   90.476   86.840
LGA    V   122_A      V   122_A     0.702     0    0.173   0.184     1.162   92.857   90.544
LGA    E   123_A      E   123_A     0.633     4    0.036   0.066     0.975   92.857   51.323
LGA    N   124_A      N   124_A     1.431     0    0.063   0.135     3.442   83.690   69.583
LGA    D   125_A      D   125_A     0.288     0    0.062   0.751     2.417  100.000   88.690
LGA    V   126_A      V   126_A     0.338     0    0.034   0.063     0.784  100.000   95.918
LGA    I   127_A      I   127_A     0.195     0    0.034   0.194     0.626  100.000   98.810
LGA    Q   128_A      Q   128_A     0.481     0    0.044   1.035     2.574  100.000   90.106
LGA    Y   129_A      Y   129_A     0.452     0    0.028   0.171     2.186  100.000   85.595
LGA    P   130_A      P   130_A     0.412     0    0.054   0.056     0.516  100.000   98.639
LGA    T   131_A      T   131_A     0.201     0    0.021   0.064     0.322  100.000  100.000
LGA    L   132_A      L   132_A     0.323     0    0.031   0.119     0.418  100.000  100.000
LGA    S   133_A      S   133_A     0.574     0    0.048   0.610     1.610   97.619   92.302
LGA    K   134_A      K   134_A     0.225     4    0.068   0.067     0.451  100.000   55.556
LGA    L   135_A      L   135_A     0.409     0    0.021   0.121     0.482  100.000  100.000
LGA    L   136_A      L   136_A     0.539     0    0.030   0.678     1.900   92.857   88.452
LGA    E   137_A      E   137_A     0.594     4    0.021   0.033     0.693   90.476   50.265
LGA    L   138_A      L   138_A     0.477     3    0.014   0.020     0.618   95.238   60.119
LGA    Y   139_A      Y   139_A     0.636     0    0.014   0.084     1.002   90.476   89.722
LGA    N   140_A      N   140_A     0.619     0    0.057   0.098     0.923   90.476   90.476
LGA    S   141_A      S   141_A     0.637     0    0.143   0.140     0.689   90.476   90.476
LGA    Q   142_A      Q   142_A     0.935     4    0.188   0.182     1.300   88.214   49.259
LGA    N   143_A      N   143_A     0.923     3    0.067   0.090     1.006   88.214   55.417
LGA    H   147_A      H   147_A     0.946     0    0.100   1.173     2.760   88.214   81.000
LGA    L   148_A      L   148_A     0.546     0    0.059   0.119     0.823   90.476   90.476
LGA    S   149_A      S   149_A     0.442     0    0.017   0.164     1.002  100.000   96.905
LGA    I   150_A      I   150_A     0.413     0    0.015   0.492     2.001  100.000   94.405
LGA    E   151_A      E   151_A     0.469     0    0.039   0.151     0.509   97.619   98.942
LGA    K   152_A      K   152_A     0.304     0    0.057   0.679     1.656  100.000   93.810
LGA    L   153_A      L   153_A     0.413     0    0.038   0.100     0.597  100.000   98.810
LGA    I   154_A      I   154_A     0.365     0    0.023   0.081     0.477  100.000  100.000
LGA    A   155_A      A   155_A     0.254     0    0.035   0.043     0.359  100.000  100.000
LGA    G   156_A      G   156_A     0.219     0    0.036   0.036     0.248  100.000  100.000
LGA    L   157_A      L   157_A     0.225     0    0.060   0.090     0.282  100.000  100.000
LGA    A   158_A      A   158_A     0.393     0    0.100   0.110     0.641   97.619   98.095
LGA    V   159_A      V   159_A     0.303     0    0.147   0.187     0.917   97.619   98.639
LGA    R   160_A      R   160_A     0.244     0    0.073   0.970     2.449  100.000   90.996
LGA    R   161_A      R   161_A     0.414     0    0.062   1.035     5.751  100.000   74.935
LGA    K   162_A      K   162_A     0.396     0    0.075   0.734     3.136   97.619   80.635
LGA    V   163_A      V   163_A     0.571     0    0.015   0.059     0.600   92.857   91.837
LGA    C   164_A      C   164_A     0.729     0    0.014   0.616     1.159   90.476   88.968
LGA    K   165_A      K   165_A     0.600     0    0.026   0.611     2.635   90.476   84.762
LGA    L   166_A      L   166_A     0.427     0    0.050   0.144     0.596   95.238   97.619
LGA    V   167_A      V   167_A     0.492     0    0.023   0.038     0.619   95.238   95.918
LGA    Q   168_A      Q   168_A     0.521     0    0.006   1.094     4.148   90.476   80.635
LGA    D   169_A      D   169_A     0.523     0    0.025   0.147     0.878   90.476   91.667
LGA    G   170_A      G   170_A     0.513     0    0.060   0.060     0.756   92.857   92.857
LGA    H   171_A      H   171_A     0.319     0    0.067   1.046     2.367   97.619   89.143
LGA    I   172_A      I   172_A     0.369     0    0.024   0.120     0.683  100.000   98.810
LGA    D   173_A      D   173_A     0.408     0    0.048   0.160     1.064  100.000   94.107
LGA    E   174_A      E   174_A     0.715     4    0.027   0.043     0.848   90.476   50.265
LGA    T   175_A      T   175_A     0.656     0    0.014   0.224     1.158   92.857   91.905
LGA    V   176_A      V   176_A     0.229     0    0.016   0.094     0.364  100.000  100.000
LGA    Y   177_A      Y   177_A     0.413     7    0.016   0.025     0.523  100.000   40.873
LGA    R   178_A      R   178_A     0.603     0    0.040   0.695     4.659   92.857   75.584
LGA    A   179_A      A   179_A     0.301     0    0.056   0.059     0.552  100.000   98.095
LGA    L   180_A      L   180_A     0.260     0    0.021   0.130     0.484  100.000  100.000
LGA    D   181_A      D   181_A     0.581     0    0.031   0.261     1.363   92.857   88.274
LGA    E   182_A      E   182_A     0.554     0    0.035   0.265     1.249   92.857   90.529
LGA    M   183_A      M   183_A     0.422     0    0.072   0.076     0.889   95.238   97.619
LGA    A   184_A      A   184_A     0.752     0    0.066   0.089     1.203   88.214   88.667
LGA    A   185_A      A   185_A     1.066     0    0.152   0.182     2.001   79.524   79.905
LGA    G   186_A      G   186_A     1.081     0    0.198   0.198     3.658   72.024   72.024
LGA    A   187_A      A   187_A     4.634     0    0.114   0.155     5.467   39.881   37.143

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      126     504    504  100.00     936    936  100.00               126
SUMMARY(RMSD_GDC):     0.832          0.804                  1.081           94.527   87.104

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  187  126    4.0    125    0.68    98.214    99.105    15.955

LGA_LOCAL      RMSD:   0.683  Number of atoms:  125  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   0.836  Number of assigned atoms:  126 
Std_ASGN_ATOMS RMSD:   0.832  Standard rmsd on all 126 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.076439 * X  +  -0.603985 * Y  +   0.793322 * Z  + -14.584422
  Y_new =   0.763701 * X  +  -0.476065 * Y  +  -0.436030 * Z  +  19.127350
  Z_new =   0.641029 * X  +   0.639190 * Y  +   0.424874 * Z  +  16.140385 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  1.471039 -0.695838  0.984152   [DEG:   84.2843  -39.8686   56.3878 ]
ZXZ:  1.068240  1.131974  0.786834   [DEG:   61.2057   64.8573   45.0823 ]
 
# END of job
