
#######################################################
#                                                     #
#                        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  179 ( 1456),  selected  179 , name one
# Molecule2: number of CA atoms  239 ( 1927),  selected  179 , 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:   101      72_A - 172_A       4.78    29.27
  LCS_AVERAGE:     39.52

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    49     113_A - 161_A       1.94    32.56
  LCS_AVERAGE:     15.80

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    35     203_A - 237_A       0.87    28.61
  LONGEST_CONTINUOUS_SEGMENT:    35     204_A - 238_A       0.98    28.75
  LCS_AVERAGE:      8.98

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  179
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     T    72_A     T    72_A     23   33  101      9   20   41   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     E    73_A     E    73_A     23   33  101      9   19   41   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     E    74_A     E    74_A     23   33  101      7   20   41   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     Q    75_A     Q    75_A     23   33  101      7   20   41   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     L    76_A     L    76_A     23   33  101      7   12   27   53   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     D    77_A     D    77_A     23   33  101      7   15   41   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     N    78_A     N    78_A     23   33  101      9   20   41   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     Y    79_A     Y    79_A     23   33  101      8   20   41   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     Q    80_A     Q    80_A     23   33  101      8   20   41   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     D    81_A     D    81_A     23   33  101      9   20   41   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     C    82_A     C    82_A     23   33  101      9   20   41   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     T    83_A     T    83_A     23   33  101      9   20   42   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     F    84_A     F    84_A     23   33  101      3    7   19   49   67   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     F    85_A     F    85_A     23   33  101      5   20   42   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     N    86_A     N    86_A     23   33  101     14   27   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     K    87_A     K    87_A     23   33  101     14   28   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     K    88_A     K    88_A     23   33  101     14   28   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     D    89_A     D    89_A     23   33  101     14   27   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     I    90_A     I    90_A     23   33  101     14   28   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     L    91_A     L    91_A     23   33  101     14   28   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     K    92_A     K    92_A     23   33  101     14   28   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     L    93_A     L    93_A     23   33  101     12   28   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     H    94_A     H    94_A     23   33  101     12   28   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     S    95_A     S    95_A     20   33  101     12   28   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     R    96_A     R    96_A     20   33  101     12   28   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     F    97_A     F    97_A     20   33  101     12   28   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     Y    98_A     Y    98_A     20   33  101     12   28   43   55   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     E    99_A     E    99_A     20   33  101     12   28   39   55   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     L   100_A     L   100_A     20   33  101     12   28   39   55   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     A   101_A     A   101_A     20   33  101      9   23   34   47   58   70   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     P   102_A     P   102_A      3   33  101      3    3   11   29   36   53   78   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     N   103_A     N   103_A      3   33  101      7   17   43   57   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     L   104_A     L   104_A      4   33  101      3    4    5    8   21   40   65   74   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     V   105_A     V   105_A      4   30  101      3    4    5    6    7   12   14   19   41   60   83   90   92   95   98   98   98   98   99   99 
LCS_GDT     P   106_A     P   106_A      4    7  101      3    4    5    8   12   17   25   60   83   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     M   107_A     M   107_A      4    7  101      3    7   23   57   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     D   108_A     D   108_A      4    7  101      4   11   41   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     Y   109_A     Y   109_A      4    7  101      6   15   32   57   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     R   110_A     R   110_A      4    7  101      4   12   24   53   68   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     K   111_A     K   111_A      4    7  101      4   15   20   31   39   54   70   73   79   84   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     S   112_A     S   112_A      4   33  101      4    4    5    8   13   34   38   70   75   80   87   91   93   95   98   98   98   98   99   99 
LCS_GDT     P   113_A     P   113_A     13   49  101      3    4    5    8   32   48   65   78   82   85   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     I   114_A     I   114_A     27   49  101      8   24   43   56   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     V   115_A     V   115_A     27   49  101      8   26   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     H   116_A     H   116_A     27   49  101      9   26   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     V   117_A     V   117_A     27   49  101      9   27   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     P   118_A     P   118_A     27   49  101      7   28   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     M   119_A     M   119_A     27   49  101     12   28   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     S   120_A     S   120_A     27   49  101      7   28   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     L   121_A     L   121_A     27   49  101      8   26   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     I   122_A     I   122_A     27   49  101      9   27   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     I   123_A     I   123_A     27   49  101      9   26   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     Q   124_A     Q   124_A     27   49  101     14   27   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     M   125_A     M   125_A     27   49  101      6   27   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     P   126_A     P   126_A     27   49  101      5   27   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     E   127_A     E   127_A     27   49  101     14   27   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     L   128_A     L   128_A     27   49  101     14   27   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     R   129_A     R   129_A     27   49  101      4   12   41   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     E   130_A     E   130_A     27   49  101      4   19   41   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     N   131_A     N   131_A     27   49  101      5   27   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     P   132_A     P   132_A     27   49  101     14   27   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     F   133_A     F   133_A     27   49  101      6   26   46   57   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     K   134_A     K   134_A     27   49  101      8   26   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     E   135_A     E   135_A     27   49  101      6   22   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     R   136_A     R   136_A     27   49  101      7   26   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     I   137_A     I   137_A     27   49  101      6   26   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     V   138_A     V   138_A     27   49  101      9   22   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     A   139_A     A   139_A     27   49  101      6   25   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     A   140_A     A   140_A     27   49  101      8   28   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     F   141_A     F   141_A     27   49  101     10   28   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     S   142_A     S   142_A     12   49  101      5   28   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     E   143_A     E   143_A     12   49  101      3   13   30   53   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     D   144_A     D   144_A     12   49  101      4    8   20   34   68   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     G   145_A     G   145_A      6   49  101      4   14   23   32   45   61   75   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     E   146_A     E   146_A      6   49  101      4   14   23   31   45   62   75   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     G   147_A     G   147_A      6   49  101      4    6   14   37   58   71   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     N   148_A     N   148_A     15   49  101     14   28   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     L   149_A     L   149_A     15   49  101     14   28   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     T   150_A     T   150_A     15   49  101     14   28   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     F   151_A     F   151_A     15   49  101     14   28   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     N   152_A     N   152_A     15   49  101     14   28   46   58   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     D   153_A     D   153_A     15   49  101     14   28   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     F   154_A     F   154_A     15   49  101     14   28   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     V   155_A     V   155_A     15   49  101     14   28   46   59   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     D   156_A     D   156_A     15   49  101     14   27   41   55   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     M   157_A     M   157_A     15   49  101     14   27   41   57   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     F   158_A     F   158_A     15   49  101     14   28   41   57   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     S   159_A     S   159_A     15   49  101     14   27   41   55   72   75   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     V   160_A     V   160_A     15   49  101     14   27   34   46   58   72   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     L   161_A     L   161_A     15   49  101     11   27   34   46   58   72   79   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     C   162_A     C   162_A     15   30  101      4    7   22   36   44   54   75   81   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     E   163_A     E   163_A      6   18  101      4    6   11   23   34   44   64   77   84   87   89   91   93   95   98   98   98   98   99   99 
LCS_GDT     S   164_A     S   164_A      6   17  101      4    6    7   10   10   16   27   37   54   68   79   87   92   95   98   98   98   98   99   99 
LCS_GDT     A   165_A     A   165_A      6    9  101      4    6    7   10   10   16   28   43   56   68   80   91   93   95   98   98   98   98   99   99 
LCS_GDT     P   166_A     P   166_A      6    9  101      3    6   11   20   27   34   40   49   61   68   80   91   93   95   98   98   98   98   99   99 
LCS_GDT     R   167_A     R   167_A      4   33  101      3    4    5    8    9   12   15   22   39   46   68   76   78   94   98   98   98   98   99   99 
LCS_GDT     E   168_A     E   168_A     16   33  101      7   24   49   60   64   67   70   73   74   75   77   78   85   95   98   98   98   98   99   99 
LCS_GDT     L   169_A     L   169_A     24   33  101     12   39   51   60   64   67   70   73   74   75   77   80   92   95   98   98   98   98   99   99 
LCS_GDT     K   170_A     K   170_A     24   33  101      7   38   51   60   64   67   70   73   74   75   77   78   79   79   81   81   84   95   99   99 
LCS_GDT     A   171_A     A   171_A     24   33  101      7   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   89   99 
LCS_GDT     N   172_A     N   172_A     24   33  101     14   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   89   99 
LCS_GDT     Y   173_A     Y   173_A     24   33   86     14   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     A   174_A     A   174_A     24   33   86     14   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     F   175_A     F   175_A     24   33   86     13   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     K   176_A     K   176_A     24   33   86     14   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     I   177_A     I   177_A     24   33   86     14   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     Y   178_A     Y   178_A     24   33   86     14   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     D   179_A     D   179_A     24   33   86     11   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     F   180_A     F   180_A     24   33   86      6   27   47   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     N   181_A     N   181_A     24   33   86      4   11   27   47   60   66   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     T   182_A     T   182_A     24   33   86      6   12   39   58   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     D   183_A     D   183_A     24   33   86      6   31   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     N   184_A     N   184_A     24   33   86     12   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     F   185_A     F   185_A     24   33   86     14   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     I   186_A     I   186_A     24   33   86      6   36   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     C   187_A     C   187_A     24   33   86     12   25   46   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     K   188_A     K   188_A     24   33   86     12   25   48   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     E   189_A     E   189_A     24   33   86     12   31   50   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     D   190_A     D   190_A     24   33   86     14   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     L   191_A     L   191_A     24   33   86     12   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     E   192_A     E   192_A     24   33   86     14   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     L   193_A     L   193_A     24   33   86     12   18   49   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     T   194_A     T   194_A     18   33   86     12   15   48   59   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     L   195_A     L   195_A     18   33   86     12   27   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     A   196_A     A   196_A     18   33   86     12   28   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     R   197_A     R   197_A     17   33   86      6   15   27   49   63   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     L   198_A     L   198_A     17   33   86      3   14   25   50   63   67   70   72   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     T   199_A     T   199_A      6   33   86      0    5   28   55   63   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     K   200_A     K   200_A      6   33   86      3    5   13   20   25   33   41   62   67   72   77   78   79   79   81   81   81   83   84   85 
LCS_GDT     S   201_A     S   201_A      6   39   86      3    5   13   20   25   37   55   65   67   72   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     E   202_A     E   202_A      6   40   86      3    5    6   15   32   42   59   64   69   73   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     L   203_A     L   203_A     35   43   86     14   23   50   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     D   204_A     D   204_A     35   43   86     14   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     E   205_A     E   205_A     35   43   86     14   32   50   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     E   206_A     E   206_A     35   43   86     14   32   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     E   207_A     E   207_A     35   43   86     14   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     V   208_A     V   208_A     35   43   86     14   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     V   209_A     V   209_A     35   43   86     14   38   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     L   210_A     L   210_A     35   43   86     14   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     V   211_A     V   211_A     35   43   86     14   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     C   212_A     C   212_A     35   43   86     14   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     D   213_A     D   213_A     35   43   86     14   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     K   214_A     K   214_A     35   43   86     14   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     V   215_A     V   215_A     35   43   86     14   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     I   216_A     I   216_A     35   43   86      8   17   48   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     E   217_A     E   217_A     35   43   86      8   17   48   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     E   218_A     E   218_A     35   43   86     14   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     A   219_A     A   219_A     35   43   86     14   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     D   220_A     D   220_A     35   43   86     14   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     L   221_A     L   221_A     35   43   86     14   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     D   222_A     D   222_A     35   43   86     13   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     G   223_A     G   223_A     35   43   86      8   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     D   224_A     D   224_A     35   43   86     13   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     G   225_A     G   225_A     35   43   86      4   31   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     K   226_A     K   226_A     35   43   86      9   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     L   227_A     L   227_A     35   43   86      9   30   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     G   228_A     G   228_A     35   43   86     10   32   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     F   229_A     F   229_A     35   43   86     13   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     A   230_A     A   230_A     35   43   86     13   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     D   231_A     D   231_A     35   43   86     14   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     F   232_A     F   232_A     35   43   86     14   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     E   233_A     E   233_A     35   43   86     14   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     D   234_A     D   234_A     35   43   86     14   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     M   235_A     M   235_A     35   43   86     14   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     I   236_A     I   236_A     35   43   86     12   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     A   237_A     A   237_A     35   43   86     10   39   51   60   64   67   70   73   74   75   77   78   79   79   81   81   82   83   94   98 
LCS_GDT     K   238_A     K   238_A     35   43   86      4   12   20   37   58   66   70   73   74   75   77   78   79   79   81   81   82   83   87   96 
LCS_GDT     A   239_A     A   239_A     13   43   86      4   11   20   29   43   60   70   73   74   75   77   78   79   79   81   81   82   83   84   90 
LCS_GDT     P   240_A     P   240_A      6   43   86      4    5   10   25   38   54   67   73   74   75   77   78   79   79   81   81   82   89   96   99 
LCS_GDT     D   241_A     D   241_A      6   43   86      4   11   17   25   38   49   63   71   74   75   75   77   79   79   81   81   82   83   84   85 
LCS_GDT     F   242_A     F   242_A      6   43   86      4   11   19   25   43   57   69   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     L   243_A     L   243_A      5   43   86      4    5    7   30   57   66   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     S   244_A     S   244_A      5   43   86      4    5    7   38   63   66   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     T   245_A     T   245_A      5   43   86      4    6   39   58   64   67   70   73   74   75   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     F   246_A     F   246_A      3    6   86      3    3    5    9   15   25   41   62   68   73   77   78   79   79   81   81   82   83   84   85 
LCS_GDT     H   247_A     H   247_A      4    6   86      3    4    5    6    7    8    9   17   23   37   41   51   55   72   78   80   80   82   82   82 
LCS_GDT     I   248_A     I   248_A      4    6   86      3    4    5    6    7    8    9    9   10   11   11   13   15   18   19   20   21   22   63   67 
LCS_GDT     R   249_A     R   249_A      4    6   86      3    4    5    6    7    8    9    9   10   11   11   12   15   18   19   20   21   22   28   30 
LCS_GDT     I   250_A     I   250_A      4    6   85      3    4    4    6    7    8    9    9   10   11   11   12   14   15   16   17   17   18   20   21 
LCS_AVERAGE  LCS_A:  21.43  (   8.98   15.80   39.52 )

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     14     39     51     60     72     75     79     81     84     87     89     91     93     95     98     98     98     98     99     99 
GDT PERCENT_AT   5.86  16.32  21.34  25.10  30.13  31.38  33.05  33.89  35.15  36.40  37.24  38.08  38.91  39.75  41.00  41.00  41.00  41.00  41.42  41.42
GDT RMS_LOCAL    0.25   0.69   0.90   1.09   1.60   1.65   1.81   1.90   2.14   2.33   2.45   2.61   2.90   3.11   3.66   3.66   3.66   3.66   3.98   3.98
GDT RMS_ALL_AT  32.53  28.11  28.13  28.05  31.30  31.25  31.25  31.27  31.42  31.39  31.39  31.34  31.09  31.05  30.35  30.35  30.35  30.35  30.04  30.04

# Checking swapping
#   possible swapping detected:  E    74_A      E    74_A
#   possible swapping detected:  Y    98_A      Y    98_A
#   possible swapping detected:  E    99_A      E    99_A
#   possible swapping detected:  Y   109_A      Y   109_A
#   possible swapping detected:  E   127_A      E   127_A
#   possible swapping detected:  D   144_A      D   144_A
#   possible swapping detected:  E   163_A      E   163_A
#   possible swapping detected:  E   168_A      E   168_A
#   possible swapping detected:  Y   173_A      Y   173_A
#   possible swapping detected:  F   175_A      F   175_A
#   possible swapping detected:  Y   178_A      Y   178_A
#   possible swapping detected:  D   179_A      D   179_A
#   possible swapping detected:  F   180_A      F   180_A
#   possible swapping detected:  D   183_A      D   183_A
#   possible swapping detected:  D   190_A      D   190_A
#   possible swapping detected:  E   202_A      E   202_A
#   possible swapping detected:  E   205_A      E   205_A
#   possible swapping detected:  E   218_A      E   218_A
#   possible swapping detected:  D   220_A      D   220_A
#   possible swapping detected:  D   222_A      D   222_A
#   possible swapping detected:  D   231_A      D   231_A
#   possible swapping detected:  F   232_A      F   232_A
#   possible swapping detected:  D   234_A      D   234_A
#   possible swapping detected:  D   241_A      D   241_A
#   possible swapping detected:  F   242_A      F   242_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    T    72_A      T    72_A     2.005     0    0.593   1.418     6.268   68.810   49.320
LGA    E    73_A      E    73_A     1.861     0    0.142   0.980     4.241   68.810   60.370
LGA    E    74_A      E    74_A     1.751     0    0.034   1.214     7.355   72.857   50.000
LGA    Q    75_A      Q    75_A     2.102     0    0.026   0.540     2.536   64.881   68.413
LGA    L    76_A      L    76_A     2.545     0    0.025   0.110     3.655   60.952   55.536
LGA    D    77_A      D    77_A     2.190     0    0.032   0.321     3.350   68.810   63.988
LGA    N    78_A      N    78_A     1.936     0    0.043   0.151     2.766   72.857   66.905
LGA    Y    79_A      Y    79_A     1.566     0    0.020   0.348     2.415   72.857   70.833
LGA    Q    80_A      Q    80_A     1.583     0    0.049   0.691     3.149   72.857   72.275
LGA    D    81_A      D    81_A     1.755     0    0.076   0.182     2.518   72.857   67.857
LGA    C    82_A      C    82_A     1.542     0    0.165   0.166     2.375   77.143   75.794
LGA    T    83_A      T    83_A     1.328     0    0.691   0.649     2.111   77.262   79.048
LGA    F    84_A      F    84_A     3.355     0    0.096   0.354     6.796   53.571   33.896
LGA    F    85_A      F    85_A     1.643     0    0.060   0.389     3.099   75.119   68.831
LGA    N    86_A      N    86_A     0.661     0    0.117   1.007     3.695   88.214   78.036
LGA    K    87_A      K    87_A     0.640     0    0.021   0.886     6.341   90.476   67.778
LGA    K    88_A      K    88_A     1.313     0    0.053   0.634     3.771   81.429   67.778
LGA    D    89_A      D    89_A     0.969     0    0.067   0.216     1.374   88.214   84.821
LGA    I    90_A      I    90_A     0.811     0    0.000   0.590     2.313   90.476   87.262
LGA    L    91_A      L    91_A     1.049     0    0.064   1.240     3.736   88.214   80.060
LGA    K    92_A      K    92_A     0.541     0    0.040   0.970     4.244   95.238   84.286
LGA    L    93_A      L    93_A     0.536     0    0.036   0.978     2.250   92.857   85.238
LGA    H    94_A      H    94_A     1.366     0    0.025   0.112     2.903   77.143   68.238
LGA    S    95_A      S    95_A     1.516     0    0.036   0.752     3.605   75.000   70.794
LGA    R    96_A      R    96_A     1.304     0    0.027   0.700     2.006   79.286   76.017
LGA    F    97_A      F    97_A     1.527     0    0.028   0.155     2.117   72.976   72.900
LGA    Y    98_A      Y    98_A     2.307     0    0.016   0.311     2.705   62.857   65.476
LGA    E    99_A      E    99_A     2.511     0    0.104   0.922     7.329   62.857   45.661
LGA    L   100_A      L   100_A     2.453     0    0.116   0.108     3.510   55.714   66.429
LGA    A   101_A      A   101_A     3.554     0    0.442   0.505     4.459   64.405   58.952
LGA    P   102_A      P   102_A     4.761     0    0.679   0.761     9.031   40.714   25.918
LGA    N   103_A      N   103_A     2.149     0    0.198   0.899     4.360   54.167   49.643
LGA    L   104_A      L   104_A     5.527     0    0.591   1.389    11.771   35.000   18.929
LGA    V   105_A      V   105_A     7.280     0    0.019   0.070    11.145   21.429   12.449
LGA    P   106_A      P   106_A     5.778     0    0.105   0.355     9.592   19.524   12.313
LGA    M   107_A      M   107_A     2.507     0    0.142   0.356     3.294   61.190   61.071
LGA    D   108_A      D   108_A     2.017     0    0.137   0.624     3.346   61.071   56.429
LGA    Y   109_A      Y   109_A     2.572     0    0.094   1.214    12.616   64.881   28.571
LGA    R   110_A      R   110_A     2.860     0    0.059   1.163     6.674   48.333   37.100
LGA    K   111_A      K   111_A     5.715     0    0.323   0.749    12.210   23.214   12.910
LGA    S   112_A      S   112_A     6.795     0    0.497   0.677     9.391   16.310   11.349
LGA    P   113_A      P   113_A     5.187     0    0.703   0.793     6.052   39.167   35.510
LGA    I   114_A      I   114_A     2.296     0    0.540   1.030     5.558   61.071   48.155
LGA    V   115_A      V   115_A     1.523     0    0.113   1.260     3.283   72.857   69.864
LGA    H   116_A      H   116_A     1.750     0    0.038   0.230     2.296   72.857   72.095
LGA    V   117_A      V   117_A     1.505     0    0.063   0.085     1.869   77.143   76.531
LGA    P   118_A      P   118_A     1.133     0    0.035   0.360     1.517   85.952   82.789
LGA    M   119_A      M   119_A     0.272     0    0.064   0.576     3.663  100.000   82.202
LGA    S   120_A      S   120_A     1.365     0    0.043   0.704     2.260   85.952   81.667
LGA    L   121_A      L   121_A     1.354     0    0.016   0.899     3.646   81.429   70.476
LGA    I   122_A      I   122_A     1.051     0    0.045   0.676     2.039   83.690   79.405
LGA    I   123_A      I   123_A     1.084     0    0.146   1.320     3.430   88.214   78.750
LGA    Q   124_A      Q   124_A     0.503     0    0.104   1.338     4.594   90.476   76.402
LGA    M   125_A      M   125_A     1.100     0    0.036   1.188     2.748   88.214   80.714
LGA    P   126_A      P   126_A     0.848     0    0.083   0.094     1.263   92.857   87.959
LGA    E   127_A      E   127_A     0.795     0    0.030   0.501     2.831   90.476   80.952
LGA    L   128_A      L   128_A     0.761     0    0.100   0.247     2.325   88.214   80.595
LGA    R   129_A      R   129_A     2.057     0    0.062   0.621     5.433   68.810   47.662
LGA    E   130_A      E   130_A     1.978     0    0.023   0.419     3.199   72.857   67.619
LGA    N   131_A      N   131_A     0.924     0    0.039   0.864     2.498   88.214   81.786
LGA    P   132_A      P   132_A     0.417     0    0.709   0.614     2.231   88.810   88.231
LGA    F   133_A      F   133_A     2.188     0    0.120   0.236     3.613   70.952   58.961
LGA    K   134_A      K   134_A     1.750     0    0.046   0.729     3.002   72.857   74.233
LGA    E   135_A      E   135_A     1.666     0    0.018   0.930     4.355   72.857   65.344
LGA    R   136_A      R   136_A     1.262     0    0.029   0.887     3.374   81.429   69.654
LGA    I   137_A      I   137_A     1.397     0    0.020   0.053     1.728   81.429   77.143
LGA    V   138_A      V   138_A     1.672     0    0.034   0.068     2.552   77.143   70.748
LGA    A   139_A      A   139_A     1.297     0    0.026   0.025     1.412   81.429   81.429
LGA    A   140_A      A   140_A     1.074     0    0.088   0.091     1.326   81.429   81.429
LGA    F   141_A      F   141_A     1.781     0    0.181   0.243     2.824   72.857   66.364
LGA    S   142_A      S   142_A     1.360     0    0.112   0.566     1.654   79.286   80.079
LGA    E   143_A      E   143_A     2.751     0    0.054   0.643     4.526   57.262   48.254
LGA    D   144_A      D   144_A     3.710     0    0.625   0.551     5.019   46.786   41.488
LGA    G   145_A      G   145_A     6.029     0    0.034   0.034     7.388   18.929   18.929
LGA    E   146_A      E   146_A     5.677     0    0.690   0.650    10.510   26.429   15.873
LGA    G   147_A      G   147_A     4.032     0    0.200   0.200     4.439   45.357   45.357
LGA    N   148_A      N   148_A     0.585     0    0.310   0.880     5.032   81.786   62.619
LGA    L   149_A      L   149_A     0.993     0    0.028   0.084     1.430   85.952   87.083
LGA    T   150_A      T   150_A     1.758     0    0.051   0.081     2.412   77.143   71.837
LGA    F   151_A      F   151_A     1.516     0    0.010   0.148     1.870   77.143   79.957
LGA    N   152_A      N   152_A     1.982     0    0.047   0.797     5.997   72.857   54.405
LGA    D   153_A      D   153_A     1.645     0    0.032   0.144     1.805   77.143   76.071
LGA    F   154_A      F   154_A     0.647     0    0.033   0.184     1.002   88.214   94.848
LGA    V   155_A      V   155_A     1.152     0    0.025   0.052     1.707   79.405   79.048
LGA    D   156_A      D   156_A     2.364     0    0.052   0.319     4.369   64.881   55.060
LGA    M   157_A      M   157_A     2.087     0    0.045   0.202     2.783   64.881   67.857
LGA    F   158_A      F   158_A     1.915     0    0.036   0.889     3.728   68.810   63.160
LGA    S   159_A      S   159_A     2.641     0    0.059   0.635     3.396   55.476   54.841
LGA    V   160_A      V   160_A     4.032     0    0.000   0.037     4.621   37.262   38.095
LGA    L   161_A      L   161_A     4.019     0    0.070   0.115     5.307   34.524   43.155
LGA    C   162_A      C   162_A     5.734     0    0.093   0.599     9.620   22.857   17.540
LGA    E   163_A      E   163_A     6.860     0    0.030   1.264     9.121    9.167    9.153
LGA    S   164_A      S   164_A    10.622     0    0.046   0.633    12.046    0.357    0.238
LGA    A   165_A      A   165_A     9.295     0    0.176   0.220     9.295    1.786    2.000
LGA    P   166_A      P   166_A     9.988     0    0.145   0.214    12.452    0.119    0.068
LGA    R   167_A      R   167_A    11.701     0    0.608   0.709    15.792    0.000    0.000
LGA    E   168_A      E   168_A    13.799     0    0.569   0.954    16.420    0.000    0.000
LGA    L   169_A      L   169_A    12.266     0    0.043   0.939    16.480    0.000    0.119
LGA    K   170_A      K   170_A    17.358     0    0.014   0.508    21.874    0.000    0.000
LGA    A   171_A      A   171_A    22.008     0    0.047   0.048    25.421    0.000    0.000
LGA    N   172_A      N   172_A    21.949     0    0.026   1.000    25.535    0.000    0.000
LGA    Y   173_A      Y   173_A    24.345     0    0.028   1.369    29.065    0.000    0.000
LGA    A   174_A      A   174_A    29.106     0    0.033   0.044    33.520    0.000    0.000
LGA    F   175_A      F   175_A    32.362     0    0.057   0.267    38.060    0.000    0.000
LGA    K   176_A      K   176_A    33.450     0    0.071   0.192    37.354    0.000    0.000
LGA    I   177_A      I   177_A    36.433     0    0.039   0.059    41.026    0.000    0.000
LGA    Y   178_A      Y   178_A    41.028     0    0.074   1.140    44.913    0.000    0.000
LGA    D   179_A      D   179_A    43.018     0    0.044   1.081    44.479    0.000    0.000
LGA    F   180_A      F   180_A    48.372     0    0.016   1.198    50.646    0.000    0.000
LGA    N   181_A      N   181_A    51.213     0    0.022   1.221    55.902    0.000    0.000
LGA    T   182_A      T   182_A    44.580     0    0.103   0.892    46.726    0.000    0.000
LGA    D   183_A      D   183_A    47.439     0    0.072   0.895    52.001    0.000    0.000
LGA    N   184_A      N   184_A    41.890     0    0.118   0.966    43.641    0.000    0.000
LGA    F   185_A      F   185_A    45.415     0    0.021   0.137    49.263    0.000    0.000
LGA    I   186_A      I   186_A    46.296     0    0.017   0.668    49.030    0.000    0.000
LGA    C   187_A      C   187_A    53.616     0    0.000   0.103    56.812    0.000    0.000
LGA    K   188_A      K   188_A    57.493     0    0.060   0.936    66.624    0.000    0.000
LGA    E   189_A      E   189_A    58.915     0    0.038   1.285    65.763    0.000    0.000
LGA    D   190_A      D   190_A    51.558     0    0.024   1.057    54.205    0.000    0.000
LGA    L   191_A      L   191_A    49.805     0    0.029   0.562    51.332    0.000    0.000
LGA    E   192_A      E   192_A    55.680     0    0.039   1.075    64.139    0.000    0.000
LGA    L   193_A      L   193_A    53.456     0    0.041   0.184    57.799    0.000    0.000
LGA    T   194_A      T   194_A    46.390     0    0.022   0.113    48.934    0.000    0.000
LGA    L   195_A      L   195_A    48.562     0    0.041   0.920    50.373    0.000    0.000
LGA    A   196_A      A   196_A    54.130     0    0.208   0.213    56.377    0.000    0.000
LGA    R   197_A      R   197_A    49.596     0    0.098   0.898    50.830    0.000    0.000
LGA    L   198_A      L   198_A    46.549     0    0.617   0.744    48.561    0.000    0.000
LGA    T   199_A      T   199_A    51.471     0    0.593   0.557    53.246    0.000    0.000
LGA    K   200_A      K   200_A    55.142     0    0.546   0.733    58.133    0.000    0.000
LGA    S   201_A      S   201_A    60.455     0    0.447   0.438    62.650    0.000    0.000
LGA    E   202_A      E   202_A    56.654     0    0.073   0.296    57.891    0.000    0.000
LGA    L   203_A      L   203_A    60.605     0    0.634   0.552    63.684    0.000    0.000
LGA    D   204_A      D   204_A    67.250     0    0.044   0.882    73.302    0.000    0.000
LGA    E   205_A      E   205_A    68.872     0    0.043   0.913    74.910    0.000    0.000
LGA    E   206_A      E   206_A    69.509     0    0.012   1.010    77.086    0.000    0.000
LGA    E   207_A      E   207_A    62.988     0    0.026   0.852    65.570    0.000    0.000
LGA    V   208_A      V   208_A    59.825     0    0.046   0.050    61.362    0.000    0.000
LGA    V   209_A      V   209_A    63.362     0    0.027   0.033    67.617    0.000    0.000
LGA    L   210_A      L   210_A    61.104     0    0.038   1.168    64.177    0.000    0.000
LGA    V   211_A      V   211_A    53.807     0    0.033   1.044    56.610    0.000    0.000
LGA    C   212_A      C   212_A    54.143     0    0.023   0.037    55.564    0.000    0.000
LGA    D   213_A      D   213_A    58.436     0    0.055   0.866    64.625    0.000    0.000
LGA    K   214_A      K   214_A    53.625     0    0.026   0.944    55.427    0.000    0.000
LGA    V   215_A      V   215_A    47.825     0    0.064   0.146    50.089    0.000    0.000
LGA    I   216_A      I   216_A    51.594     0    0.028   0.620    55.148    0.000    0.000
LGA    E   217_A      E   217_A    54.827     0    0.064   0.860    62.118    0.000    0.000
LGA    E   218_A      E   218_A    48.422     0    0.107   1.242    50.469    0.000    0.000
LGA    A   219_A      A   219_A    44.802     0    0.070   0.074    46.532    0.000    0.000
LGA    D   220_A      D   220_A    50.330     0    0.184   1.013    55.151    0.000    0.000
LGA    L   221_A      L   221_A    51.542     0    0.107   0.225    54.840    0.000    0.000
LGA    D   222_A      D   222_A    55.850     0    0.070   0.993    60.138    0.000    0.000
LGA    G   223_A      G   223_A    60.551     0    0.130   0.130    63.647    0.000    0.000
LGA    D   224_A      D   224_A    60.277     0    0.050   0.319    61.223    0.000    0.000
LGA    G   225_A      G   225_A    59.046     0    0.056   0.056    59.179    0.000    0.000
LGA    K   226_A      K   226_A    52.995     0    0.178   0.662    58.601    0.000    0.000
LGA    L   227_A      L   227_A    45.746     0    0.089   1.375    48.217    0.000    0.000
LGA    G   228_A      G   228_A    41.292     0    0.041   0.041    43.214    0.000    0.000
LGA    F   229_A      F   229_A    33.710     0    0.047   1.390    36.497    0.000    0.000
LGA    A   230_A      A   230_A    34.105     0    0.021   0.043    35.957    0.000    0.000
LGA    D   231_A      D   231_A    38.398     0    0.040   1.126    43.691    0.000    0.000
LGA    F   232_A      F   232_A    34.888     0    0.028   1.455    36.153    0.000    0.000
LGA    E   233_A      E   233_A    28.226     0    0.029   1.056    30.701    0.000    0.000
LGA    D   234_A      D   234_A    31.676     0    0.043   1.100    34.280    0.000    0.000
LGA    M   235_A      M   235_A    34.657     0    0.027   0.886    40.318    0.000    0.000
LGA    I   236_A      I   236_A    28.365     0    0.243   1.381    30.426    0.000    0.000
LGA    A   237_A      A   237_A    24.218     0    0.111   0.116    26.044    0.000    0.000
LGA    K   238_A      K   238_A    26.904     0    0.257   0.953    32.821    0.000    0.000
LGA    A   239_A      A   239_A    27.848     0    0.020   0.021    30.536    0.000    0.000
LGA    P   240_A      P   240_A    21.793     0    0.105   0.184    23.706    0.000    0.000
LGA    D   241_A      D   241_A    26.920     0    0.188   1.084    30.174    0.000    0.000
LGA    F   242_A      F   242_A    29.978     0    0.103   1.360    37.205    0.000    0.000
LGA    L   243_A      L   243_A    26.559     0    0.166   1.304    27.608    0.000    0.000
LGA    S   244_A      S   244_A    30.069     0    0.088   0.705    32.862    0.000    0.000
LGA    T   245_A      T   245_A    35.064     0    0.188   1.002    38.083    0.000    0.000
LGA    F   246_A      F   246_A    30.496     0    0.090   1.084    32.829    0.000    0.000
LGA    H   247_A      H   247_A    29.379     0    0.107   0.814    30.828    0.000    0.000
LGA    I   248_A      I   248_A    28.834     0    0.095   0.682    31.441    0.000    0.000
LGA    R   249_A      R   249_A    26.970     6    0.100   0.142    28.402    0.000    0.000
LGA    I   250_A      I   250_A    30.969     0    0.096   0.940    32.563    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      179     716    716  100.00    1450   1450  100.00               239
SUMMARY(RMSD_GDC):    16.098         16.035                 16.489           26.252   23.813

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  179  239    4.0     81    1.90    29.080    27.206     4.043

LGA_LOCAL      RMSD:   1.904  Number of atoms:   81  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  31.272  Number of assigned atoms:  179 
Std_ASGN_ATOMS RMSD:  16.098  Standard rmsd on all 179 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.723928 * X  +   0.665368 * Y  +   0.182247 * Z  + -75.761230
  Y_new =   0.243842 * X  +  -0.493910 * Y  +   0.834622 * Z  + -113.860420
  Z_new =   0.645345 * X  +  -0.559767 * Y  +  -0.519800 * Z  + 101.498070 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  0.324896 -0.701474 -2.319190   [DEG:   18.6152  -40.1915 -132.8798 ]
ZXZ:  2.926608  2.117413  2.285301   [DEG:  167.6823  121.3188  130.9381 ]
 
# END of job
