
#######################################################
#                                                     #
#                        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       0.99     0.99
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   126      59_A - 187_A       0.99     0.99
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   126      59_A - 187_A       0.99     0.99
  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    3    5    5   87  107  117  125  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     R    60_A     R    60_A    126  126  126     38  109  120  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     65  112  120  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     61  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     64  112  120  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     45  112  120  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     45  112  120  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     38  112  120  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     38  112  120  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     60  112  120  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     64  112  120  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     45  112  120  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     45  112  120  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     45  112  120  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     46  112  120  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     64  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     45  112  120  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     36   98  120  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     23   86  120  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     23   62  113  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     23   86  120  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     45  112  120  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     42  103  120  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     23   88  120  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     38  112  120  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     48  112  120  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     45  112  120  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     20  112  120  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     38  112  120  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     48  112  120  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     13  112  120  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     36  112  120  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     19  112  120  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     23  112  120  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     64  112  120  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     62  112  120  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     45  112  120  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     45  112  120  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     45  112  120  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     54  112  120  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     45  112  120  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     45  112  120  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     48  112  120  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     46  112  120  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     45  112  120  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     45  112  120  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     63  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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      4  112  120  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      6   60  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     38  112  120  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     38  112  120  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     63  108  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     65  112  120  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     63  112  120  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     59   92  120  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     14   89  118  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    5    5    6  123  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     65    112    120    124    124    124    125    125    126    126    126    126    126    126    126    126    126    126    126    126 
GDT PERCENT_AT  51.59  88.89  95.24  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   0.60   0.68   0.74   0.74   0.74   0.84   0.84   0.99   0.99   0.99   0.99   0.99   0.99   0.99   0.99   0.99   0.99   0.99   0.99
GDT RMS_ALL_AT   1.29   1.00   0.99   0.99   0.99   0.99   0.99   0.99   0.99   0.99   0.99   0.99   0.99   0.99   0.99   0.99   0.99   0.99   0.99   0.99

# Checking swapping
#   possible swapping detected:  E    69_A      E    69_A
#   possible swapping detected:  E    74_A      E    74_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   182_A      E   182_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    R    59_A      R    59_A     5.983     6    0.566   0.576     7.096   32.024   12.554
LGA    R    60_A      R    60_A     1.013     6    0.588   0.535     3.838   81.786   33.680
LGA    V    61_A      V    61_A     0.211     0    0.053   0.046     0.290  100.000  100.000
LGA    K    62_A      K    62_A     0.348     0    0.087   0.309     1.883  100.000   92.804
LGA    L    63_A      L    63_A     0.537     0    0.037   1.250     2.695   92.857   83.155
LGA    R    64_A      R    64_A     0.293     6    0.059   0.078     0.320  100.000   45.455
LGA    K    65_A      K    65_A     0.388     0    0.039   0.317     0.968  100.000   97.884
LGA    H    66_A      H    66_A     0.400     0    0.056   0.129     0.796  100.000   94.286
LGA    L    67_A      L    67_A     0.365     0    0.015   1.035     3.257  100.000   82.917
LGA    V    68_A      V    68_A     0.204     0    0.039   0.056     0.337  100.000  100.000
LGA    E    69_A      E    69_A     0.583     0    0.094   0.465     2.947   97.619   86.032
LGA    I    70_A      I    70_A     0.597     0    0.055   0.228     0.720   90.476   91.667
LGA    N    71_A      N    71_A     0.897     0    0.038   0.412     1.597   88.214   84.881
LGA    A    72_A      A    72_A     0.843     0    0.141   0.169     1.438   88.214   88.667
LGA    D    73_A      D    73_A     0.198     0    0.151   0.874     2.762   95.357   84.524
LGA    E    74_A      E    74_A     0.388     0    0.102   1.041     3.487   97.619   83.651
LGA    I    75_A      I    75_A     0.645     0    0.077   1.217     3.325   90.476   82.024
LGA    T    76_A      T    76_A     0.608     0    0.025   0.101     0.830   90.476   90.476
LGA    I    77_A      I    77_A     0.613     0    0.032   0.412     1.525   90.476   88.274
LGA    T    78_A      T    78_A     0.425     0    0.036   0.096     0.822  100.000   97.279
LGA    L    79_A      L    79_A     0.207     0    0.021   0.115     0.530  100.000   98.810
LGA    S    80_A      S    80_A     0.219     0    0.052   0.078     0.377  100.000  100.000
LGA    R    81_A      R    81_A     0.229     0    0.052   1.182     3.645  100.000   86.017
LGA    Y    82_A      Y    82_A     0.262     0    0.051   0.062     0.474  100.000  100.000
LGA    T    83_A      T    83_A     0.541     0    0.058   0.110     0.696   92.857   94.558
LGA    S    84_A      S    84_A     1.349     0    0.020   0.046     1.734   81.429   78.571
LGA    P    85_A      P    85_A     1.649     0    0.054   0.085     2.120   72.857   71.701
LGA    E    86_A      E    86_A     2.028     0    0.039   1.323     7.620   70.833   46.349
LGA    A    87_A      A    87_A     1.518     0    0.046   0.056     1.647   77.143   78.000
LGA    L    88_A      L    88_A     0.795     0    0.068   0.138     1.164   88.214   90.536
LGA    E    89_A      E    89_A     1.226     0    0.033   1.031     5.668   81.429   61.429
LGA    R    90_A      R    90_A     1.438     0    0.025   1.269     6.029   81.429   63.506
LGA    S    91_A      S    91_A     0.779     0    0.030   0.041     1.000   88.214   88.968
LGA    I    92_A      I    92_A     0.336     0    0.084   0.162     0.904   97.619   96.429
LGA    T    93_A      T    93_A     0.492     0    0.021   0.071     1.237  100.000   93.333
LGA    A    94_A      A    94_A     0.774     0    0.039   0.038     0.897   90.476   90.476
LGA    L    95_A      L    95_A     0.541     0    0.020   0.131     0.773   90.476   91.667
LGA    A    96_A      A    96_A     0.609     0    0.065   0.085     0.920   90.476   92.381
LGA    A    97_A      A    97_A     0.805     0    0.090   0.124     1.124   88.214   88.667
LGA    M    98_A      M    98_A     0.644     0    0.032   0.170     0.985   90.476   92.857
LGA    T    99_A      T    99_A     0.813     0    0.065   0.090     1.136   88.214   89.184
LGA    G   100_A      G   100_A     0.799     0    0.034   0.034     0.799   90.476   90.476
LGA    H   101_A      H   101_A     0.394     5    0.020   0.030     0.722  100.000   49.048
LGA    A   102_A      A   102_A     0.429     0    0.039   0.081     0.653  100.000   98.095
LGA    P   103_A      P   103_A     0.609     0    0.048   0.058     0.886   92.857   93.197
LGA    S   104_A      S   104_A     0.902     0    0.015   0.204     1.395   90.476   88.968
LGA    S   105_A      S   105_A     0.656     0    0.039   0.553     1.752   90.476   87.540
LGA    I   106_A      I   106_A     0.443     0    0.026   0.151     0.564   95.238   95.238
LGA    K   107_A      K   107_A     0.703     0    0.031   0.323     1.184   90.476   89.471
LGA    E   108_A      E   108_A     0.742     3    0.072   0.716     2.919   90.476   56.614
LGA    E   109_A      E   109_A     0.513     0    0.034   0.821     3.627   90.476   76.878
LGA    C   110_A      C   110_A     0.540     0    0.038   0.039     0.633   90.476   92.063
LGA    V   111_A      V   111_A     0.741     0    0.030   0.066     1.010   90.476   89.184
LGA    E   112_A      E   112_A     0.637     0    0.007   0.462     2.095   95.238   88.730
LGA    L   113_A      L   113_A     0.427     0    0.022   0.127     0.614  100.000   98.810
LGA    I   114_A      I   114_A     0.333     0    0.050   0.100     0.506  100.000   98.810
LGA    D   115_A      D   115_A     0.240     0    0.019   0.778     3.494  100.000   83.988
LGA    K   116_A      K   116_A     0.285     2    0.056   0.083     0.424  100.000   77.778
LGA    L   117_A      L   117_A     0.186     0    0.090   0.129     0.352  100.000  100.000
LGA    D   118_A      D   118_A     0.664     0    0.080   0.641     3.346   92.857   77.381
LGA    W   119_A      W   119_A     0.712     0    0.043   0.141     0.760   90.476   94.558
LGA    L   120_A      L   120_A     0.519     0    0.077   0.126     0.773   95.238   92.857
LGA    R   121_A      R   121_A     0.436     0    0.028   0.964     2.883   95.238   89.307
LGA    V   122_A      V   122_A     0.655     0    0.175   0.216     1.135   95.238   90.612
LGA    E   123_A      E   123_A     0.741     4    0.032   0.064     0.996   90.476   50.265
LGA    N   124_A      N   124_A     1.409     0    0.064   0.084     3.303   83.690   69.583
LGA    D   125_A      D   125_A     0.127     0    0.069   0.755     2.617  100.000   86.845
LGA    V   126_A      V   126_A     0.170     0    0.036   0.066     0.595  100.000   97.279
LGA    I   127_A      I   127_A     0.092     0    0.038   0.079     0.296  100.000  100.000
LGA    Q   128_A      Q   128_A     0.588     0    0.035   1.028     2.758   97.619   87.989
LGA    Y   129_A      Y   129_A     0.594     0    0.011   0.196     2.386   92.857   81.746
LGA    P   130_A      P   130_A     0.605     0    0.028   0.048     0.721   90.476   90.476
LGA    T   131_A      T   131_A     0.323     0    0.048   0.095     0.468  100.000  100.000
LGA    L   132_A      L   132_A     0.387     0    0.018   0.112     0.509  100.000   98.810
LGA    S   133_A      S   133_A     0.705     0    0.107   0.516     1.116   92.857   89.048
LGA    K   134_A      K   134_A     0.410     4    0.036   0.041     0.478  100.000   55.556
LGA    L   135_A      L   135_A     0.455     0    0.025   0.138     0.495  100.000  100.000
LGA    L   136_A      L   136_A     0.566     0    0.046   1.252     3.026   92.857   83.274
LGA    E   137_A      E   137_A     0.672     4    0.029   0.033     0.797   90.476   50.265
LGA    L   138_A      L   138_A     0.477     3    0.005   0.008     0.539   92.857   58.929
LGA    Y   139_A      Y   139_A     0.630     0    0.013   0.086     1.130   90.476   88.968
LGA    N   140_A      N   140_A     0.701     0    0.024   0.094     1.130   90.476   87.083
LGA    S   141_A      S   141_A     0.777     0    0.162   0.222     1.008   90.476   88.968
LGA    Q   142_A      Q   142_A     1.128     4    0.173   0.166     1.493   81.429   46.243
LGA    N   143_A      N   143_A     1.064     3    0.019   0.030     1.121   83.690   53.155
LGA    H   147_A      H   147_A     1.349     0    0.100   1.173     3.129   81.429   74.190
LGA    L   148_A      L   148_A     0.727     0    0.051   0.112     1.043   90.476   89.345
LGA    S   149_A      S   149_A     0.904     0    0.016   0.040     0.984   90.476   90.476
LGA    I   150_A      I   150_A     0.704     0    0.022   0.447     2.037   90.476   87.262
LGA    E   151_A      E   151_A     0.796     0    0.032   0.928     2.316   90.476   80.794
LGA    K   152_A      K   152_A     0.758     0    0.062   0.696     1.821   90.476   85.556
LGA    L   153_A      L   153_A     0.619     0    0.035   0.087     0.764   95.238   92.857
LGA    I   154_A      I   154_A     0.433     0    0.015   0.075     0.548  100.000   96.429
LGA    A   155_A      A   155_A     0.592     0    0.033   0.039     0.633   90.476   90.476
LGA    G   156_A      G   156_A     0.493     0    0.035   0.035     0.493  100.000  100.000
LGA    L   157_A      L   157_A     0.380     0    0.101   0.116     0.487  100.000  100.000
LGA    A   158_A      A   158_A     0.446     0    0.093   0.104     0.481  100.000  100.000
LGA    V   159_A      V   159_A     0.657     0    0.133   0.177     0.871   90.476   90.476
LGA    R   160_A      R   160_A     0.593     0    0.059   0.971     2.603   92.857   85.974
LGA    R   161_A      R   161_A     0.690     0    0.067   1.046     6.046   92.857   70.606
LGA    K   162_A      K   162_A     0.767     0    0.062   0.744     3.182   90.476   77.460
LGA    V   163_A      V   163_A     0.646     0    0.014   0.055     0.798   92.857   91.837
LGA    C   164_A      C   164_A     0.609     0    0.019   0.053     0.629   90.476   90.476
LGA    K   165_A      K   165_A     0.645     0    0.034   0.579     2.923   90.476   84.762
LGA    L   166_A      L   166_A     0.635     0    0.040   0.146     0.699   90.476   90.476
LGA    V   167_A      V   167_A     0.547     0    0.016   0.025     0.566   90.476   90.476
LGA    Q   168_A      Q   168_A     0.476     0    0.017   0.785     3.331   95.238   84.339
LGA    D   169_A      D   169_A     0.723     0    0.026   0.119     1.141   90.476   90.536
LGA    G   170_A      G   170_A     0.540     0    0.045   0.045     0.709   90.476   90.476
LGA    H   171_A      H   171_A     0.510     0    0.043   1.128     2.492   92.857   83.619
LGA    I   172_A      I   172_A     0.361     0    0.033   0.115     0.524  100.000   98.810
LGA    D   173_A      D   173_A     0.626     0    0.049   0.166     1.268   90.476   87.083
LGA    E   174_A      E   174_A     0.957     4    0.013   0.027     1.105   90.476   49.259
LGA    T   175_A      T   175_A     0.794     0    0.014   0.250     1.276   90.476   89.184
LGA    V   176_A      V   176_A     0.421     0    0.022   0.085     0.585  100.000   98.639
LGA    Y   177_A      Y   177_A     0.745     7    0.014   0.027     0.867   90.476   37.698
LGA    R   178_A      R   178_A     0.887     0    0.033   0.692     4.517   90.476   72.381
LGA    A   179_A      A   179_A     0.530     0    0.050   0.053     0.611   92.857   92.381
LGA    L   180_A      L   180_A     0.493     0    0.020   0.117     0.717   95.238   97.619
LGA    D   181_A      D   181_A     0.905     0    0.027   0.348     1.785   88.214   84.881
LGA    E   182_A      E   182_A     1.039     0    0.055   0.269     1.776   85.952   82.487
LGA    M   183_A      M   183_A     0.805     0    0.054   0.062     1.214   88.214   91.726
LGA    A   184_A      A   184_A     1.108     0    0.067   0.092     1.616   81.548   83.333
LGA    A   185_A      A   185_A     1.599     0    0.106   0.133     2.328   72.976   72.952
LGA    G   186_A      G   186_A     1.756     0    0.327   0.327     3.104   69.286   69.286
LGA    A   187_A      A   187_A     4.522     0    0.085   0.131     5.748   42.738   38.476

# 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):     0.988          0.940                  1.329           91.447   83.594

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  187  126    4.0    125    0.84    96.627    98.367    13.302

LGA_LOCAL      RMSD:   0.840  Number of atoms:  125  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   0.992  Number of assigned atoms:  126 
Std_ASGN_ATOMS RMSD:   0.988  Standard rmsd on all 126 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.021812 * X  +   0.034985 * Y  +   0.999150 * Z  + -15.846540
  Y_new =   0.547640 * X  +  -0.836534 * Y  +   0.017336 * Z  +  20.940403
  Z_new =   0.836429 * X  +   0.546797 * Y  +  -0.037405 * Z  +  17.617008 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  1.530989 -0.990736  1.639098   [DEG:   87.7192  -56.7650   93.9134 ]
ZXZ:  1.588145  1.608210  0.991805   [DEG:   90.9940   92.1437   56.8263 ]
 
# END of job
