
#######################################################
#                                                     #
#                        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       0.66     0.66
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   126      59_A - 187_A       0.66     0.66
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   126      59_A - 187_A       0.66     0.66
  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    3   86  124  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     R    60_A     R    60_A    126  126  126      0   77  122  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     V    61_A     V    61_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     K    62_A     K    62_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L    63_A     L    63_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     R    64_A     R    64_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     K    65_A     K    65_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     H    66_A     H    66_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L    67_A     L    67_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     V    68_A     V    68_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     E    69_A     E    69_A    126  126  126     86  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     I    70_A     I    70_A    126  126  126     84  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     N    71_A     N    71_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     A    72_A     A    72_A    126  126  126      7  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     D    73_A     D    73_A    126  126  126     83  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     E    74_A     E    74_A    126  126  126     44  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     I    75_A     I    75_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     T    76_A     T    76_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     I    77_A     I    77_A    126  126  126     86  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     T    78_A     T    78_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L    79_A     L    79_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     S    80_A     S    80_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     R    81_A     R    81_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     Y    82_A     Y    82_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     T    83_A     T    83_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     S    84_A     S    84_A    126  126  126     46  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     P    85_A     P    85_A    126  126  126     44  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     E    86_A     E    86_A    126  126  126     34  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     A    87_A     A    87_A    126  126  126     44  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L    88_A     L    88_A    126  126  126     86  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     E    89_A     E    89_A    126  126  126     82  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     R    90_A     R    90_A    126  126  126     43  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     S    91_A     S    91_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     I    92_A     I    92_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     T    93_A     T    93_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     A    94_A     A    94_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L    95_A     L    95_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     A    96_A     A    96_A    126  126  126     49  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     A    97_A     A    97_A    126  126  126     43  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     M    98_A     M    98_A    126  126  126     86  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     T    99_A     T    99_A    126  126  126     41  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     G   100_A     G   100_A    126  126  126     79  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     H   101_A     H   101_A    126  126  126     86  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     A   102_A     A   102_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     P   103_A     P   103_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     S   104_A     S   104_A    126  126  126     58  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     S   105_A     S   105_A    126  126  126     73  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     I   106_A     I   106_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     K   107_A     K   107_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     E   108_A     E   108_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     E   109_A     E   109_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     C   110_A     C   110_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     V   111_A     V   111_A    126  126  126     82  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     E   112_A     E   112_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L   113_A     L   113_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     I   114_A     I   114_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     D   115_A     D   115_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     K   116_A     K   116_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L   117_A     L   117_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     D   118_A     D   118_A    126  126  126     49  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     W   119_A     W   119_A    126  126  126     56  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L   120_A     L   120_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     R   121_A     R   121_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     V   122_A     V   122_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     E   123_A     E   123_A    126  126  126      4  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     N   124_A     N   124_A    126  126  126     15   53  122  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     D   125_A     D   125_A    126  126  126     84  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     V   126_A     V   126_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     I   127_A     I   127_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     Q   128_A     Q   128_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     Y   129_A     Y   129_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     P   130_A     P   130_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     T   131_A     T   131_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L   132_A     L   132_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     S   133_A     S   133_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     K   134_A     K   134_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L   135_A     L   135_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L   136_A     L   136_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     E   137_A     E   137_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L   138_A     L   138_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     Y   139_A     Y   139_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     N   140_A     N   140_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     S   141_A     S   141_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     Q   142_A     Q   142_A    126  126  126     71  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     N   143_A     N   143_A    126  126  126     56  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     H   147_A     H   147_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L   148_A     L   148_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     S   149_A     S   149_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     I   150_A     I   150_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     E   151_A     E   151_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     K   152_A     K   152_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L   153_A     L   153_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     I   154_A     I   154_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     A   155_A     A   155_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     G   156_A     G   156_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L   157_A     L   157_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     A   158_A     A   158_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     V   159_A     V   159_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     R   160_A     R   160_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     R   161_A     R   161_A    126  126  126     51  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     K   162_A     K   162_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     V   163_A     V   163_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     C   164_A     C   164_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     K   165_A     K   165_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L   166_A     L   166_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     V   167_A     V   167_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     Q   168_A     Q   168_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     D   169_A     D   169_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     G   170_A     G   170_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     H   171_A     H   171_A    126  126  126     51  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     I   172_A     I   172_A    126  126  126     31  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     D   173_A     D   173_A    126  126  126     31  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     E   174_A     E   174_A    126  126  126     34  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     T   175_A     T   175_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     V   176_A     V   176_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     Y   177_A     Y   177_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     R   178_A     R   178_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     A   179_A     A   179_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     L   180_A     L   180_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     D   181_A     D   181_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     E   182_A     E   182_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     M   183_A     M   183_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     A   184_A     A   184_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     A   185_A     A   185_A    126  126  126     87  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     G   186_A     G   186_A    126  126  126      3  122  123  125  125  126  126  126  126  126  126  126  126  126  126  126  126  126  126  126 
LCS_GDT     A   187_A     A   187_A    126  126  126     10   99  123  125  125  126  126  126  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     87    122    123    125    125    126    126    126    126    126    126    126    126    126    126    126    126    126    126    126 
GDT PERCENT_AT  69.05  96.83  97.62  99.21  99.21 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00
GDT RMS_LOCAL    0.34   0.48   0.50   0.54   0.54   0.66   0.66   0.66   0.66   0.66   0.66   0.66   0.66   0.66   0.66   0.66   0.66   0.66   0.66   0.66
GDT RMS_ALL_AT   0.66   0.66   0.66   0.66   0.66   0.66   0.66   0.66   0.66   0.66   0.66   0.66   0.66   0.66   0.66   0.66   0.66   0.66   0.66   0.66

# Checking swapping
#   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     4.132     6    0.205   0.227     5.565   47.024   20.476
LGA    R    60_A      R    60_A     1.819     6    0.461   0.428     4.514   77.143   30.909
LGA    V    61_A      V    61_A     0.274     0    0.059   0.074     0.591  100.000   98.639
LGA    K    62_A      K    62_A     0.127     0    0.101   0.397     2.445  100.000   92.963
LGA    L    63_A      L    63_A     0.377     0    0.044   1.257     2.707  100.000   87.857
LGA    R    64_A      R    64_A     0.285     6    0.064   0.084     0.405  100.000   45.455
LGA    K    65_A      K    65_A     0.490     0    0.039   0.377     1.103   95.238   93.704
LGA    H    66_A      H    66_A     0.354     0    0.049   0.071     0.642  100.000   96.190
LGA    L    67_A      L    67_A     0.221     0    0.047   0.100     0.441  100.000  100.000
LGA    V    68_A      V    68_A     0.275     0    0.035   0.054     0.321  100.000  100.000
LGA    E    69_A      E    69_A     0.526     0    0.057   0.727     2.371   97.619   84.921
LGA    I    70_A      I    70_A     0.548     0    0.037   0.202     0.679   90.476   91.667
LGA    N    71_A      N    71_A     0.424     0    0.045   0.192     1.061   97.619   92.917
LGA    A    72_A      A    72_A     0.783     0    0.132   0.132     1.101   92.857   90.571
LGA    D    73_A      D    73_A     0.551     0    0.146   0.312     1.747   95.238   88.393
LGA    E    74_A      E    74_A     0.857     0    0.057   1.173     2.791   88.214   84.921
LGA    I    75_A      I    75_A     0.425     0    0.054   0.136     1.952   97.619   89.583
LGA    T    76_A      T    76_A     0.396     0    0.044   0.135     0.842   97.619   94.558
LGA    I    77_A      I    77_A     0.502     0    0.034   0.483     1.107   97.619   92.917
LGA    T    78_A      T    78_A     0.284     0    0.014   0.054     0.682  100.000   98.639
LGA    L    79_A      L    79_A     0.169     0    0.021   0.110     0.409  100.000  100.000
LGA    S    80_A      S    80_A     0.231     0    0.068   0.107     0.371  100.000  100.000
LGA    R    81_A      R    81_A     0.336     0    0.064   1.181     3.832  100.000   84.632
LGA    Y    82_A      Y    82_A     0.392     0    0.073   0.056     0.648   97.619   99.206
LGA    T    83_A      T    83_A     0.480     0    0.050   0.078     0.504   97.619   98.639
LGA    S    84_A      S    84_A     0.748     0    0.022   0.145     0.901   90.476   92.063
LGA    P    85_A      P    85_A     0.815     0    0.059   0.073     1.073   90.476   89.184
LGA    E    86_A      E    86_A     0.985     0    0.093   0.147     1.317   88.214   84.444
LGA    A    87_A      A    87_A     0.752     0    0.078   0.088     0.804   92.857   92.381
LGA    L    88_A      L    88_A     0.501     0    0.068   0.138     0.721   90.476   94.048
LGA    E    89_A      E    89_A     0.575     0    0.047   0.197     0.775   92.857   91.534
LGA    R    90_A      R    90_A     0.755     0    0.028   0.140     2.006   90.476   81.688
LGA    S    91_A      S    91_A     0.400     0    0.024   0.030     0.561   97.619   96.825
LGA    I    92_A      I    92_A     0.152     0    0.070   0.156     0.639  100.000   98.810
LGA    T    93_A      T    93_A     0.270     0    0.023   0.062     0.776  100.000   97.279
LGA    A    94_A      A    94_A     0.486     0    0.027   0.026     0.614   97.619   96.190
LGA    L    95_A      L    95_A     0.451     0    0.026   0.148     0.816   95.238   95.238
LGA    A    96_A      A    96_A     0.658     0    0.035   0.058     0.889   90.476   92.381
LGA    A    97_A      A    97_A     0.818     0    0.068   0.095     1.077   88.214   88.667
LGA    M    98_A      M    98_A     0.599     0    0.026   0.902     3.422   90.476   87.798
LGA    T    99_A      T    99_A     0.761     0    0.049   0.066     0.964   90.476   90.476
LGA    G   100_A      G   100_A     0.700     0    0.036   0.036     0.700   90.476   90.476
LGA    H   101_A      H   101_A     0.640     5    0.026   0.044     0.965   95.238   47.143
LGA    A   102_A      A   102_A     0.415     0    0.040   0.083     0.599  100.000   98.095
LGA    P   103_A      P   103_A     0.285     0    0.031   0.047     0.546   97.619   98.639
LGA    S   104_A      S   104_A     0.732     0    0.021   0.187     1.122   90.476   88.968
LGA    S   105_A      S   105_A     0.583     0    0.015   0.599     1.753   95.238   90.714
LGA    I   106_A      I   106_A     0.224     0    0.018   0.174     0.638  100.000   98.810
LGA    K   107_A      K   107_A     0.371     0    0.029   0.258     0.888  100.000   97.884
LGA    E   108_A      E   108_A     0.410     3    0.079   0.717     2.345   97.619   61.693
LGA    E   109_A      E   109_A     0.222     0    0.040   0.552     2.110  100.000   87.037
LGA    C   110_A      C   110_A     0.321     0    0.040   0.043     0.436  100.000  100.000
LGA    V   111_A      V   111_A     0.568     0    0.020   0.058     0.890   92.857   91.837
LGA    E   112_A      E   112_A     0.360     0    0.019   0.453     1.950  100.000   94.868
LGA    L   113_A      L   113_A     0.320     0    0.023   0.140     0.593  100.000   98.810
LGA    I   114_A      I   114_A     0.126     0    0.047   0.097     0.323  100.000  100.000
LGA    D   115_A      D   115_A     0.325     0    0.025   0.772     3.093  100.000   85.952
LGA    K   116_A      K   116_A     0.482     2    0.076   0.094     0.482  100.000   77.778
LGA    L   117_A      L   117_A     0.304     0    0.086   0.110     0.448  100.000  100.000
LGA    D   118_A      D   118_A     0.731     0    0.055   0.230     1.682   92.857   87.202
LGA    W   119_A      W   119_A     0.659     0    0.030   0.167     0.999   92.857   91.837
LGA    L   120_A      L   120_A     0.378     0    0.084   0.135     0.584  100.000   97.619
LGA    R   121_A      R   121_A     0.376     0    0.025   0.965     2.521  100.000   90.303
LGA    V   122_A      V   122_A     0.503     0    0.171   0.208     0.983   92.857   93.197
LGA    E   123_A      E   123_A     0.975     4    0.041   0.074     1.326   85.952   48.254
LGA    N   124_A      N   124_A     1.614     0    0.065   0.137     3.657   81.548   66.786
LGA    D   125_A      D   125_A     0.522     0    0.067   0.729     2.112   95.238   86.310
LGA    V   126_A      V   126_A     0.323     0    0.036   0.064     0.756   97.619   94.558
LGA    I   127_A      I   127_A     0.133     0    0.038   0.081     0.343  100.000  100.000
LGA    Q   128_A      Q   128_A     0.366     0    0.040   1.029     2.339  100.000   91.111
LGA    Y   129_A      Y   129_A     0.274     0    0.025   0.181     1.780  100.000   90.714
LGA    P   130_A      P   130_A     0.252     0    0.049   0.051     0.350  100.000  100.000
LGA    T   131_A      T   131_A     0.180     0    0.022   0.065     0.295  100.000  100.000
LGA    L   132_A      L   132_A     0.165     0    0.030   0.117     0.289  100.000  100.000
LGA    S   133_A      S   133_A     0.367     0    0.050   0.608     1.665  100.000   93.889
LGA    K   134_A      K   134_A     0.183     4    0.077   0.075     0.454  100.000   55.556
LGA    L   135_A      L   135_A     0.354     0    0.031   0.098     0.365  100.000  100.000
LGA    L   136_A      L   136_A     0.324     0    0.030   0.273     0.847  100.000   96.429
LGA    E   137_A      E   137_A     0.339     4    0.046   0.047     0.517  100.000   54.497
LGA    L   138_A      L   138_A     0.238     3    0.020   0.019     0.437  100.000   62.500
LGA    Y   139_A      Y   139_A     0.450     0    0.012   0.083     0.767  100.000   94.444
LGA    N   140_A      N   140_A     0.343     0    0.073   0.087     0.601   97.619   96.429
LGA    S   141_A      S   141_A     0.393     0    0.147   0.204     0.740  100.000   98.413
LGA    Q   142_A      Q   142_A     0.807     4    0.176   0.169     1.251   88.214   49.259
LGA    N   143_A      N   143_A     0.912     3    0.080   0.102     0.955   90.476   56.548
LGA    H   147_A      H   147_A     0.556     0    0.101   1.174     2.729   92.857   83.762
LGA    L   148_A      L   148_A     0.273     0    0.037   0.086     0.535  100.000   98.810
LGA    S   149_A      S   149_A     0.137     0    0.015   0.181     0.808  100.000   98.413
LGA    I   150_A      I   150_A     0.249     0    0.024   0.413     1.542  100.000   96.607
LGA    E   151_A      E   151_A     0.263     0    0.034   0.137     0.437  100.000  100.000
LGA    K   152_A      K   152_A     0.264     0    0.061   0.708     2.113  100.000   91.905
LGA    L   153_A      L   153_A     0.295     0    0.034   0.089     0.499  100.000  100.000
LGA    I   154_A      I   154_A     0.183     0    0.018   0.074     0.328  100.000  100.000
LGA    A   155_A      A   155_A     0.279     0    0.034   0.044     0.286  100.000  100.000
LGA    G   156_A      G   156_A     0.199     0    0.038   0.038     0.199  100.000  100.000
LGA    L   157_A      L   157_A     0.265     0    0.076   0.095     0.374  100.000  100.000
LGA    A   158_A      A   158_A     0.433     0    0.090   0.099     0.540   97.619   98.095
LGA    V   159_A      V   159_A     0.513     0    0.130   0.170     1.080   90.595   93.265
LGA    R   160_A      R   160_A     0.342     0    0.086   0.970     2.281  100.000   91.861
LGA    R   161_A      R   161_A     0.662     0    0.080   1.030     6.126   92.857   69.784
LGA    K   162_A      K   162_A     0.511     0    0.057   0.523     1.882   92.857   85.661
LGA    V   163_A      V   163_A     0.252     0    0.014   0.049     0.380  100.000  100.000
LGA    C   164_A      C   164_A     0.346     0    0.020   0.056     0.437  100.000  100.000
LGA    K   165_A      K   165_A     0.372     0    0.037   0.580     2.469  100.000   92.910
LGA    L   166_A      L   166_A     0.357     0    0.028   0.142     0.465  100.000  100.000
LGA    V   167_A      V   167_A     0.362     0    0.027   0.030     0.523   97.619   98.639
LGA    Q   168_A      Q   168_A     0.388     0    0.017   0.794     2.989  100.000   90.159
LGA    D   169_A      D   169_A     0.363     0    0.026   0.135     0.694  100.000   97.619
LGA    G   170_A      G   170_A     0.447     0    0.058   0.058     0.887   95.238   95.238
LGA    H   171_A      H   171_A     0.785     0    0.222   1.112     2.426   83.810   78.238
LGA    I   172_A      I   172_A     0.729     0    0.064   0.718     3.141   90.476   85.417
LGA    D   173_A      D   173_A     0.734     0    0.041   0.171     0.982   92.857   91.667
LGA    E   174_A      E   174_A     0.757     4    0.029   0.043     0.853   92.857   51.323
LGA    T   175_A      T   175_A     0.484     0    0.015   0.197     0.739   97.619   95.918
LGA    V   176_A      V   176_A     0.093     0    0.017   0.109     0.233  100.000  100.000
LGA    Y   177_A      Y   177_A     0.393     7    0.009   0.020     0.556  100.000   40.873
LGA    R   178_A      R   178_A     0.297     0    0.044   0.715     3.362  100.000   84.113
LGA    A   179_A      A   179_A     0.277     0    0.057   0.062     0.581  100.000   98.095
LGA    L   180_A      L   180_A     0.358     0    0.022   0.103     0.473  100.000  100.000
LGA    D   181_A      D   181_A     0.438     0    0.024   0.402     1.443  100.000   95.298
LGA    E   182_A      E   182_A     0.348     0    0.072   0.336     1.163   97.619   94.762
LGA    M   183_A      M   183_A     0.401     0    0.064   0.070     0.647   97.619   96.429
LGA    A   184_A      A   184_A     0.495     0    0.068   0.093     0.820   95.238   96.190
LGA    A   185_A      A   185_A     0.535     0    0.110   0.139     0.969   92.857   94.286
LGA    G   186_A      G   186_A     1.064     0    0.185   0.185     1.412   85.952   85.952
LGA    A   187_A      A   187_A     1.594     0    0.088   0.086     3.417   67.619   70.381

# 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):     0.656          0.660                  0.938           95.908   88.675

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  187  126    4.0    126    0.66    99.008    99.464    16.667

LGA_LOCAL      RMSD:   0.656  Number of atoms:  126  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   0.656  Number of assigned atoms:  126 
Std_ASGN_ATOMS RMSD:   0.656  Standard rmsd on all 126 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.716060 * X  +  -0.674671 * Y  +   0.179099 * Z  + -15.988488
  Y_new =   0.413363 * X  +  -0.616590 * Y  +  -0.670036 * Z  +  19.383493
  Z_new =   0.562485 * X  +  -0.405753 * Y  +   0.720399 * Z  +  15.326828 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  2.618052 -0.597388 -0.512947   [DEG:  150.0033  -34.2278  -29.3897 ]
ZXZ:  0.261192  0.766418  2.195714   [DEG:   14.9652   43.9125  125.8051 ]
 
# END of job
