
#######################################################
#                                                     #
#                        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       0.90     0.90
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   126      59_A - 187_A       0.90     0.90
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   126      59_A - 187_A       0.90     0.90
  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   45   66   83  104  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     22  100  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     33  116  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     35  116  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     35  116  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     10  116  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     76  116  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     76  116  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     76  116  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     72  116  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     57  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     57  116  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     22  111  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     22  108  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     20   83  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     20  103  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     57  116  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     41  115  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     20  113  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     57  116  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     76  116  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     76  116  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     58  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     74  116  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     46  116  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     67  116  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     76  116  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     63  116  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     58  116  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     74  116  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     72  116  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     57  116  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     69  116  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     75  116  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     76  116  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     76  116  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     76  116  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     76  116  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     44  116  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     44  116  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     63  116  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     64  116  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     63  116  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     27  116  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     27   56  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     76  116  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     76  116  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     76  116  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     59  116  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     76  116  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     76  116  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     76  116  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     76  116  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     65  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     63  116  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     20  116  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     44  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     46  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     73  116  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     73  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     76  116  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     64  116  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     38  116  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     38  116  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    6   73  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     76    116    124    124    124    124    125    125    126    126    126    126    126    126    126    126    126    126    126    126 
GDT PERCENT_AT  60.32  92.06  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    0.35   0.51   0.61   0.61   0.61   0.61   0.75   0.75   0.90   0.90   0.90   0.90   0.90   0.90   0.90   0.90   0.90   0.90   0.90   0.90
GDT RMS_ALL_AT   0.94   0.91   0.90   0.90   0.90   0.90   0.90   0.90   0.90   0.90   0.90   0.90   0.90   0.90   0.90   0.90   0.90   0.90   0.90   0.90

# 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     5.654     6    0.565   0.583     6.706   32.976   13.203
LGA    R    60_A      R    60_A     1.258     6    0.557   0.510     4.041   79.524   32.294
LGA    V    61_A      V    61_A     0.188     0    0.054   0.047     0.496  100.000  100.000
LGA    K    62_A      K    62_A     0.169     0    0.085   0.318     2.091  100.000   91.905
LGA    L    63_A      L    63_A     0.371     0    0.034   1.241     2.596  100.000   86.726
LGA    R    64_A      R    64_A     0.262     6    0.067   0.091     0.327  100.000   45.455
LGA    K    65_A      K    65_A     0.440     0    0.045   0.322     1.103   95.238   94.762
LGA    H    66_A      H    66_A     0.372     0    0.068   1.160     2.523  100.000   87.571
LGA    L    67_A      L    67_A     0.210     0    0.036   0.103     0.676  100.000   98.810
LGA    V    68_A      V    68_A     0.321     0    0.042   0.058     0.393  100.000  100.000
LGA    E    69_A      E    69_A     0.650     0    0.101   0.473     3.076   90.476   82.063
LGA    I    70_A      I    70_A     0.560     0    0.040   0.234     0.639   90.476   91.667
LGA    N    71_A      N    71_A     0.546     0    0.017   0.394     1.540   90.476   88.274
LGA    A    72_A      A    72_A     0.657     0    0.021   0.051     0.958   95.238   94.286
LGA    D    73_A      D    73_A     0.552     0    0.078   0.142     1.223   95.238   90.595
LGA    E    74_A      E    74_A     0.547     0    0.015   1.049     3.067   95.238   84.127
LGA    I    75_A      I    75_A     0.192     0    0.062   1.210     3.171  100.000   86.845
LGA    T    76_A      T    76_A     0.377     0    0.030   0.128     0.709   97.619   95.918
LGA    I    77_A      I    77_A     0.562     0    0.019   0.475     1.270   90.476   89.345
LGA    T    78_A      T    78_A     0.340     0    0.012   0.078     0.720  100.000   98.639
LGA    L    79_A      L    79_A     0.226     0    0.020   0.105     0.497  100.000  100.000
LGA    S    80_A      S    80_A     0.210     0    0.066   0.099     0.360  100.000  100.000
LGA    R    81_A      R    81_A     0.231     0    0.042   0.859     3.333  100.000   91.212
LGA    Y    82_A      Y    82_A     0.350     0    0.087   0.068     0.805   95.238   96.825
LGA    T    83_A      T    83_A     0.577     0    0.046   0.081     0.681   92.857   93.197
LGA    S    84_A      S    84_A     1.168     0    0.022   0.147     1.447   83.690   82.937
LGA    P    85_A      P    85_A     1.354     0    0.052   0.072     1.733   81.429   78.980
LGA    E    86_A      E    86_A     1.680     0    0.075   0.129     2.177   72.857   71.958
LGA    A    87_A      A    87_A     1.260     0    0.043   0.054     1.375   83.690   83.238
LGA    L    88_A      L    88_A     0.693     0    0.082   0.142     1.002   88.214   90.536
LGA    E    89_A      E    89_A     0.896     0    0.036   0.228     1.098   90.476   88.466
LGA    R    90_A      R    90_A     1.107     0    0.026   0.860     5.501   85.952   69.567
LGA    S    91_A      S    91_A     0.570     0    0.029   0.049     0.740   95.238   93.651
LGA    I    92_A      I    92_A     0.185     0    0.081   0.161     0.799  100.000   97.619
LGA    T    93_A      T    93_A     0.271     0    0.025   0.066     0.982  100.000   95.918
LGA    A    94_A      A    94_A     0.539     0    0.031   0.030     0.686   95.238   94.286
LGA    L    95_A      L    95_A     0.378     0    0.032   0.111     0.775   95.238   97.619
LGA    A    96_A      A    96_A     0.519     0    0.051   0.071     0.761   92.857   94.286
LGA    A    97_A      A    97_A     0.693     0    0.087   0.116     1.058   88.214   88.667
LGA    M    98_A      M    98_A     0.504     0    0.020   0.174     0.739   92.857   94.048
LGA    T    99_A      T    99_A     0.537     0    0.076   0.099     0.794   90.476   90.476
LGA    G   100_A      G   100_A     0.508     0    0.040   0.040     0.508   95.238   95.238
LGA    H   101_A      H   101_A     0.571     5    0.018   0.031     0.824   97.619   48.095
LGA    A   102_A      A   102_A     0.552     0    0.046   0.091     0.785   95.238   94.286
LGA    P   103_A      P   103_A     0.514     0    0.039   0.053     0.755   92.857   94.558
LGA    S   104_A      S   104_A     0.809     0    0.015   0.198     1.336   90.476   88.968
LGA    S   105_A      S   105_A     0.639     0    0.049   0.551     1.615   90.476   87.540
LGA    I   106_A      I   106_A     0.417     0    0.032   0.113     0.597   97.619   97.619
LGA    K   107_A      K   107_A     0.601     0    0.035   0.256     1.193   92.857   90.529
LGA    E   108_A      E   108_A     0.636     3    0.067   0.720     2.801   90.476   56.614
LGA    E   109_A      E   109_A     0.494     0    0.033   0.615     2.289   95.238   81.164
LGA    C   110_A      C   110_A     0.527     0    0.041   0.042     0.593   90.476   92.063
LGA    V   111_A      V   111_A     0.656     0    0.026   0.065     0.925   90.476   90.476
LGA    E   112_A      E   112_A     0.551     0    0.014   0.465     1.963   95.238   90.635
LGA    L   113_A      L   113_A     0.474     0    0.022   0.125     0.713  100.000   97.619
LGA    I   114_A      I   114_A     0.299     0    0.043   0.112     0.398  100.000  100.000
LGA    D   115_A      D   115_A     0.211     0    0.019   0.792     3.442  100.000   83.988
LGA    K   116_A      K   116_A     0.421     2    0.055   0.081     0.497  100.000   77.778
LGA    L   117_A      L   117_A     0.242     0    0.117   0.148     0.360  100.000  100.000
LGA    D   118_A      D   118_A     0.840     0    0.071   0.651     3.657   90.476   75.357
LGA    W   119_A      W   119_A     0.892     0    0.055   0.162     0.990   90.476   91.837
LGA    L   120_A      L   120_A     0.660     0    0.112   1.362     2.953   92.857   83.155
LGA    R   121_A      R   121_A     0.660     0    0.023   0.968     2.720   90.476   85.108
LGA    V   122_A      V   122_A     0.775     0    0.190   0.197     1.368   92.857   90.544
LGA    E   123_A      E   123_A     0.818     4    0.034   0.064     1.093   85.952   47.249
LGA    N   124_A      N   124_A     1.457     0    0.065   0.109     3.396   83.690   69.583
LGA    D   125_A      D   125_A     0.280     0    0.074   0.748     2.290   97.619   86.488
LGA    V   126_A      V   126_A     0.355     0    0.037   0.065     0.749  100.000   95.918
LGA    I   127_A      I   127_A     0.251     0    0.031   0.199     0.536  100.000   98.810
LGA    Q   128_A      Q   128_A     0.583     0    0.048   1.007     2.629   97.619   87.989
LGA    Y   129_A      Y   129_A     0.551     0    0.025   0.193     2.125   95.238   83.254
LGA    P   130_A      P   130_A     0.530     0    0.046   0.054     0.683   95.238   93.197
LGA    T   131_A      T   131_A     0.227     0    0.033   0.076     0.394  100.000  100.000
LGA    L   132_A      L   132_A     0.368     0    0.029   0.113     0.464  100.000  100.000
LGA    S   133_A      S   133_A     0.673     0    0.078   0.622     1.538   97.619   90.794
LGA    K   134_A      K   134_A     0.307     4    0.052   0.053     0.427  100.000   55.556
LGA    L   135_A      L   135_A     0.427     0    0.029   0.107     0.458  100.000  100.000
LGA    L   136_A      L   136_A     0.505     0    0.041   1.230     2.991   97.619   86.548
LGA    E   137_A      E   137_A     0.551     4    0.040   0.039     0.714   92.857   51.323
LGA    L   138_A      L   138_A     0.368     3    0.006   0.008     0.438  100.000   62.500
LGA    Y   139_A      Y   139_A     0.532     0    0.014   0.084     0.860   92.857   91.270
LGA    N   140_A      N   140_A     0.561     0    0.026   0.115     0.970   90.476   90.476
LGA    S   141_A      S   141_A     0.629     0    0.154   0.205     0.835   90.476   90.476
LGA    Q   142_A      Q   142_A     0.936     4    0.155   0.150     1.269   88.214   49.259
LGA    N   143_A      N   143_A     0.891     3    0.017   0.034     0.947   90.476   56.548
LGA    H   147_A      H   147_A     1.065     0    0.105   1.163     2.928   83.690   76.619
LGA    L   148_A      L   148_A     0.564     0    0.048   0.105     0.810   90.476   90.476
LGA    S   149_A      S   149_A     0.573     0    0.015   0.179     1.231   90.476   88.968
LGA    I   150_A      I   150_A     0.508     0    0.017   0.474     2.057   90.476   87.262
LGA    E   151_A      E   151_A     0.489     0    0.032   0.128     0.578   97.619   97.884
LGA    K   152_A      K   152_A     0.391     0    0.066   0.766     1.814  100.000   90.794
LGA    L   153_A      L   153_A     0.438     0    0.039   0.096     0.603  100.000   98.810
LGA    I   154_A      I   154_A     0.360     0    0.016   0.074     0.506  100.000   98.810
LGA    A   155_A      A   155_A     0.245     0    0.035   0.045     0.317  100.000  100.000
LGA    G   156_A      G   156_A     0.260     0    0.036   0.036     0.260  100.000  100.000
LGA    L   157_A      L   157_A     0.250     0    0.064   0.092     0.337  100.000  100.000
LGA    A   158_A      A   158_A     0.367     0    0.081   0.090     0.498  100.000  100.000
LGA    V   159_A      V   159_A     0.361     0    0.167   0.200     1.050   95.357   95.986
LGA    R   160_A      R   160_A     0.254     0    0.069   0.969     2.399  100.000   90.996
LGA    R   161_A      R   161_A     0.428     0    0.072   1.053     5.754  100.000   74.935
LGA    K   162_A      K   162_A     0.426     0    0.084   0.529     1.770   97.619   87.778
LGA    V   163_A      V   163_A     0.520     0    0.015   0.062     0.571   92.857   94.558
LGA    C   164_A      C   164_A     0.671     0    0.013   0.598     1.165   90.476   88.968
LGA    K   165_A      K   165_A     0.573     0    0.027   0.590     2.574   92.857   86.825
LGA    L   166_A      L   166_A     0.415     0    0.039   0.139     0.514   95.238   97.619
LGA    V   167_A      V   167_A     0.442     0    0.022   0.032     0.530   97.619   98.639
LGA    Q   168_A      Q   168_A     0.418     0    0.011   1.051     4.032  100.000   85.926
LGA    D   169_A      D   169_A     0.524     0    0.024   0.136     0.852   95.238   94.048
LGA    G   170_A      G   170_A     0.395     0    0.056   0.056     0.662   97.619   97.619
LGA    H   171_A      H   171_A     0.359     0    0.120   0.133     0.893   97.619   94.286
LGA    I   172_A      I   172_A     0.393     0    0.008   0.712     2.750  100.000   94.643
LGA    D   173_A      D   173_A     0.494     0    0.045   0.177     1.108   97.619   92.917
LGA    E   174_A      E   174_A     0.757     4    0.027   0.044     0.859   90.476   50.265
LGA    T   175_A      T   175_A     0.676     0    0.015   0.233     1.190   92.857   91.905
LGA    V   176_A      V   176_A     0.218     0    0.018   0.098     0.360  100.000  100.000
LGA    Y   177_A      Y   177_A     0.448     7    0.013   0.025     0.538   97.619   40.079
LGA    R   178_A      R   178_A     0.627     0    0.034   0.670     4.489   92.857   76.104
LGA    A   179_A      A   179_A     0.297     0    0.059   0.063     0.518  100.000   98.095
LGA    L   180_A      L   180_A     0.249     0    0.022   0.114     0.482  100.000  100.000
LGA    D   181_A      D   181_A     0.599     0    0.027   0.276     1.337   92.857   90.536
LGA    E   182_A      E   182_A     0.606     0    0.061   0.275     1.283   90.476   89.471
LGA    M   183_A      M   183_A     0.510     0    0.065   0.079     0.985   92.857   96.429
LGA    A   184_A      A   184_A     0.827     0    0.049   0.074     1.218   85.952   86.857
LGA    A   185_A      A   185_A     1.149     0    0.112   0.139     1.865   81.548   81.524
LGA    G   186_A      G   186_A     1.247     0    0.275   0.275     3.446   71.429   71.429
LGA    A   187_A      A   187_A     4.883     0    0.082   0.126     5.867   36.786   33.714

# 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):     0.898          0.859                  1.130           93.440   86.017

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  187  126    4.0    125    0.75    97.421    98.855    14.686

LGA_LOCAL      RMSD:   0.751  Number of atoms:  125  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   0.902  Number of assigned atoms:  126 
Std_ASGN_ATOMS RMSD:   0.898  Standard rmsd on all 126 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.182692 * X  +  -0.699645 * Y  +   0.690740 * Z  + -14.857281
  Y_new =   0.346277 * X  +  -0.703335 * Y  +  -0.620816 * Z  +  19.312431
  Z_new =   0.920172 * X  +   0.125769 * Y  +   0.370764 * Z  +  17.074280 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  2.056271 -1.168519  0.327035   [DEG:  117.8156  -66.9512   18.7377 ]
ZXZ:  0.838661  1.190965  1.434958   [DEG:   48.0517   68.2373   82.2171 ]
 
# END of job
