
#######################################################
#                                                     #
#                        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  160 ( 1234),  selected  160 , name one
# Molecule2: number of CA atoms  222 ( 1696),  selected  160 , 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:    66     116_A - 181_A       5.00    38.83
  LONGEST_CONTINUOUS_SEGMENT:    66     117_A - 182_A       4.99    38.64
  LCS_AVERAGE:     19.53

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    15     181_A - 195_A       1.68    34.86
  LCS_AVERAGE:      4.77

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    14     182_A - 195_A       0.65    34.67
  LCS_AVERAGE:      3.33

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  160
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     Q    36_A     Q    36_A      3    4   20      3    3    3    3    4    5    6    8   11   12   14   15   16   16   17   19   22   26   27   30 
LCS_GDT     N    37_A     N    37_A      3    4   20      3    3    3    3    4    4    6   10   12   13   14   15   18   19   19   19   22   26   27   30 
LCS_GDT     P    38_A     P    38_A      3    4   20      3    3    4    5    5    5    6   10   12   13   14   15   18   19   19   19   22   23   26   27 
LCS_GDT     Q    39_A     Q    39_A      3    4   20      3    3    4    5    5    5    6    9   12   13   14   15   18   19   19   19   22   23   26   27 
LCS_GDT     L    40_A     L    40_A      3    4   20      3    3    4    6    7    9   12   14   16   16   16   16   18   19   19   19   22   23   26   27 
LCS_GDT     R    41_A     R    41_A      3    6   20      0    3    4    5    8   10   12   14   16   16   16   16   18   19   19   19   19   19   20   20 
LCS_GDT     N    42_A     N    42_A      3   14   20      3    3    3    4    7    8   10   14   16   16   16   16   18   19   19   19   19   19   20   20 
LCS_GDT     M    43_A     M    43_A     11   14   20      7    9   11   13   13   13   13   14   16   16   16   16   18   19   19   19   19   19   20   22 
LCS_GDT     G    44_A     G    44_A     11   14   20      8    9   11   13   13   13   13   14   16   16   16   16   18   19   19   19   19   19   20   21 
LCS_GDT     P    45_A     P    45_A     11   14   20      8    9   11   13   13   13   13   14   16   16   16   16   18   19   19   19   19   19   20   21 
LCS_GDT     E    46_A     E    46_A     11   14   20      8    9   11   13   13   13   13   14   16   16   16   16   18   19   19   19   22   25   26   28 
LCS_GDT     A    47_A     A    47_A     11   14   20      8    9   11   13   13   13   13   14   16   16   16   16   18   20   21   22   23   25   26   28 
LCS_GDT     R    48_A     R    48_A     11   14   20      8    9   11   13   13   13   13   14   16   16   16   16   18   19   19   22   23   25   26   28 
LCS_GDT     Q    49_A     Q    49_A     11   14   20      8    9   11   13   13   13   13   14   16   16   16   16   18   20   21   22   23   25   26   28 
LCS_GDT     M    50_A     M    50_A     11   14   20      8    9   11   13   13   13   13   14   16   16   16   17   18   20   21   22   23   25   26   28 
LCS_GDT     L    51_A     L    51_A     11   14   20      8    9   11   13   13   13   13   14   16   16   16   17   18   20   21   22   23   25   26   28 
LCS_GDT     R    52_A     R    52_A     11   14   20      6    6   10   13   13   13   13   14   16   16   16   17   18   20   21   22   23   25   26   28 
LCS_GDT     P    53_A     P    53_A     11   14   20      6    7   11   13   13   13   13   14   16   16   16   17   18   20   21   22   23   25   26   28 
LCS_GDT     M    54_A     M    54_A     10   14   20      6    8   11   13   13   13   13   14   16   16   16   16   18   20   21   22   23   25   26   28 
LCS_GDT     F    55_A     F    55_A     10   14   20      6    8   11   13   13   13   13   14   16   16   16   16   17   19   20   22   22   24   25   28 
LCS_GDT     R    56_A     R    56_A      3    4   19      3    3    3    3    4    6    7   12   14   14   15   17   18   20   21   22   23   25   26   28 
LCS_GDT     E    57_A     E    57_A      3    4   19      3    3    3    4    5    5    7   10   14   14   15   17   18   20   21   22   23   25   26   28 
LCS_GDT     M    58_A     M    58_A      3    3   19      3    3    3    5    5    5    7   10   14   14   15   17   18   20   21   22   23   25   32   36 
LCS_GDT     M    59_A     M    59_A      3    3   18      0    3    4    5    5    5    8    9   14   14   15   17   18   20   21   22   25   28   32   38 
LCS_GDT     S    60_A     S    60_A      5    5   16      3    4    5    5    5    7    8   10   14   14   15   17   18   20   21   27   32   38   41   43 
LCS_GDT     N    61_A     N    61_A      5    5   16      3    4    5    5    5    7    8   10   14   14   19   23   26   32   34   36   38   40   43   45 
LCS_GDT     P    62_A     P    62_A      5    5   17      3    4    5    5    6    7    9   12   15   18   21   25   27   32   34   36   38   40   43   45 
LCS_GDT     E    63_A     E    63_A      5    5   17      3    4    6    8    9   12   13   15   17   19   24   25   27   32   34   36   38   40   43   45 
LCS_GDT     S    64_A     S    64_A      5    5   17      3    3    6    8    9   12   13   15   17   19   24   25   27   32   34   36   38   40   43   45 
LCS_GDT     M    65_A     M    65_A      4    5   17      4    4    6    8    9   12   13   15   17   19   24   25   27   32   34   36   38   40   43   45 
LCS_GDT     R    66_A     R    66_A      4    5   17      4    4    6    8    9   12   13   15   17   19   24   25   27   32   34   36   38   40   43   45 
LCS_GDT     S    67_A     S    67_A      4   11   17      4    4    4    5    7    8   11   11   14   14   24   25   27   32   34   36   38   40   43   45 
LCS_GDT     M    68_A     M    68_A      5   11   17      4    4    7    9   10   11   11   11   14   14   17   19   27   29   34   35   38   40   43   45 
LCS_GDT     M    69_A     M    69_A      5   11   17      4    4    7    9   10   11   11   11   12   13   15   17   18   23   25   33   35   40   43   45 
LCS_GDT     N    70_A     N    70_A      7   11   17      4    4    7    9   10   11   11   11   14   14   15   17   18   23   25   30   32   35   39   45 
LCS_GDT     M    71_A     M    71_A      7   11   17      4    5    7    9   10   11   11   11   12   13   15   17   18   23   25   30   32   35   39   44 
LCS_GDT     G    72_A     G    72_A      7   11   17      5    5    7    9   10   11   11   11   12   13   14   15   17   18   21   24   26   29   34   44 
LCS_GDT     R    73_A     R    73_A      7   11   23      5    5    7    9   10   11   11   11   13   18   19   20   21   22   23   24   27   32   35   44 
LCS_GDT     A    74_A     A    74_A      7   11   23      5    5    7    9   10   11   11   11   12   13   14   15   17   21   23   24   26   29   35   43 
LCS_GDT     W    75_A     W    75_A      7   11   24      5    5    7    9   10   11   11   11   12   13   14   15   21   22   23   25   28   32   35   37 
LCS_GDT     G    76_A     G    76_A      7   11   24      5    5    7    9   10   11   13   16   18   18   19   20   21   25   26   28   29   32   35   37 
LCS_GDT     S    77_A     S    77_A      9   13   24      3    5    9   12   14   15   17   17   18   18   19   20   21   25   26   28   29   32   35   37 
LCS_GDT     K    78_A     K    78_A      9   13   24      3    6    9   13   14   15   17   17   18   18   19   20   21   25   26   28   29   32   35   37 
LCS_GDT     K    79_A     K    79_A      9   13   24      5    7    9   13   14   15   17   17   18   18   19   20   21   25   26   28   29   30   35   37 
LCS_GDT     I    80_A     I    80_A      9   13   24      5    7    9   13   14   15   17   17   18   18   19   20   21   25   26   28   29   32   35   37 
LCS_GDT     L    81_A     L    81_A      9   13   24      5    7    9   13   14   15   17   17   18   18   19   20   21   25   26   28   29   32   35   37 
LCS_GDT     I    82_A     I    82_A      9   13   24      5    7    9   13   14   15   17   17   18   18   19   20   21   25   26   28   29   32   35   37 
LCS_GDT     V    83_A     V    83_A      9   13   24      5    7    9   13   14   15   17   17   18   18   19   20   21   25   26   28   29   32   35   37 
LCS_GDT     E    84_A     E    84_A      9   13   24      3    7    9   13   14   15   17   17   18   18   19   20   21   25   26   28   29   32   35   37 
LCS_GDT     S    85_A     S    85_A      9   13   24      5    7    9   13   14   15   17   17   18   18   19   20   24   49   60   64   68   74   79   81 
LCS_GDT     D    86_A     D    86_A      4   13   24      3    4    7   12   13   15   17   17   18   18   19   26   30   40   56   63   69   73   78   80 
LCS_GDT     T    87_A     T    87_A      3   13   24      3    4    8   13   14   15   17   17   18   18   19   20   31   42   52   63   66   71   76   80 
LCS_GDT     A    88_A     A    88_A      3   13   24      3    3    3    4    8   15   17   17   18   18   19   22   31   41   51   63   66   71   76   80 
LCS_GDT     L    89_A     L    89_A      4   13   24      3    3    6    9   14   15   17   17   18   18   23   30   43   53   60   64   69   74   78   81 
LCS_GDT     S    90_A     S    90_A      4    5   24      3    3    4    5    6    7   10   11   12   18   19   20   29   35   44   55   65   70   74   78 
LCS_GDT     A    91_A     A    91_A      4    5   24      3    3    4    5    6    8   11   15   18   18   19   20   22   28   33   39   50   57   67   71 
LCS_GDT     T    92_A     T    92_A      4    5   24      3    4    9   13   14   15   17   17   18   18   19   20   22   26   30   35   44   48   55   64 
LCS_GDT     L    93_A     L    93_A      3    4   24      3    5    9   13   14   15   17   17   18   18   19   20   22   25   26   28   36   40   45   53 
LCS_GDT     R    94_A     R    94_A      4    5   24      3    4    8   13   14   15   17   17   18   18   19   20   21   25   26   28   29   32   38   44 
LCS_GDT     S    95_A     S    95_A      4    5   24      3    7    9   13   13   15   17   17   18   18   19   19   21   25   26   28   29   32   38   44 
LCS_GDT     A    96_A     A    96_A      4    5   24      3    4    5    6    6    7    8   10   11   17   19   19   21   25   26   28   32   35   39   44 
LCS_GDT     L    97_A     L    97_A      4    5   24      3    4    5    6    6    7    8   10   12   13   16   17   20   23   24   28   32   35   39   44 
LCS_GDT     E    98_A     E    98_A      3    5   24      3    3    3    6    6    7    8   10   12   13   16   17   20   23   24   26   28   32   35   43 
LCS_GDT     G    99_A     G    99_A      3    4   24      3    3    3    5    6    8    8   10   12   13   15   18   23   26   28   32   36   40   43   45 
LCS_GDT     R   100_A     R   100_A      4    8   22      3    4    4    6    7   10   13   15   16   18   24   25   27   32   34   36   38   40   43   45 
LCS_GDT     G   101_A     G   101_A      4   11   22      3    4    8    9   10   12   12   14   16   18   24   25   27   32   34   36   38   40   43   45 
LCS_GDT     F   102_A     F   102_A      6   11   22      3    4    8    9   10   12   13   15   17   19   24   25   27   32   34   36   38   40   43   45 
LCS_GDT     T   103_A     T   103_A      6   11   22      3    4    6    7    8   10   12   14   16   18   19   25   27   32   34   36   38   40   43   45 
LCS_GDT     V   104_A     V   104_A      6   11   22      4    5    8    9   10   12   13   15   17   19   24   25   27   33   34   36   40   43   47   57 
LCS_GDT     D   105_A     D   105_A      6   11   22      4    5    8    9   10   12   13   15   17   19   24   26   34   36   40   46   54   58   67   71 
LCS_GDT     E   106_A     E   106_A      6   11   22      4    5    8    9   10   12   13   15   17   19   24   25   27   35   40   48   62   71   76   80 
LCS_GDT     T   107_A     T   107_A      6   11   22      4    5    8    9   10   12   13   15   17   20   24   46   56   61   67   72   75   80   82   83 
LCS_GDT     T   108_A     T   108_A      6   11   22      3    5    8    9   10   12   13   15   17   20   24   25   39   45   62   66   73   76   81   82 
LCS_GDT     D   109_A     D   109_A      6   11   22      3    4    8    9   10   12   13   21   38   47   55   57   61   70   73   76   77   80   82   83 
LCS_GDT     G   110_A     G   110_A      8   11   22      4    5    9   11   11   12   12   14   17   19   24   29   36   49   59   65   69   74   79   81 
LCS_GDT     K   111_A     K   111_A      8   11   22      4    4    8   11   11   12   13   15   17   24   35   47   57   61   68   72   75   78   81   82 
LCS_GDT     G   112_A     G   112_A      8   10   22      6    7    9   11   11   11   12   15   23   35   48   56   60   68   72   76   77   78   82   83 
LCS_GDT     S   113_A     S   113_A      8   10   22      6    7    9   11   11   11   12   14   17   26   45   47   60   68   72   76   79   81   82   83 
LCS_GDT     V   114_A     V   114_A      8   10   31      6    7    9   11   11   12   17   25   37   55   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     E   115_A     E   115_A      8   10   31      6    7    9   11   17   28   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     Q   116_A     Q   116_A      8   10   66      6    7    9   11   11   28   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     I   117_A     I   117_A      8   10   66      6    7    9   11   18   31   38   44   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     R   118_A     R   118_A      7   10   66      6    7   13   20   25   31   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     R   119_A     R   119_A      4   10   66      3    3    5    6    8    9   12   31   41   48   53   64   67   72   75   78   80   81   82   83 
LCS_GDT     D   120_A     D   120_A      4   11   66      3    3   12   15   23   31   36   44   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     R   121_A     R   121_A      4   11   66     12   14   15   21   27   32   36   44   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     P   122_A     P   122_A      4   11   66      3    3    5    7   17   19   29   36   42   49   59   64   67   72   75   78   80   81   82   83 
LCS_GDT     D   123_A     D   123_A      8   11   66      2   10   22   25   28   32   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     L   124_A     L   124_A      8   11   66      7   14   22   25   28   32   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     V   125_A     V   125_A      8   11   66      7   12   22   25   28   32   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     V   126_A     V   126_A      8   11   66      7   11   19   25   28   32   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     L   127_A     L   127_A      8   11   66      6   11   16   23   28   32   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     A   128_A     A   128_A      8   11   66      4   10   13   20   24   31   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     V   129_A     V   129_A      8   11   66      4    7   12   15   23   28   36   44   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     D   130_A     D   130_A      8   11   66      4    7   12   17   23   28   35   44   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     L   131_A     L   131_A      4    5   66      3    4    4    5    6    8   24   31   37   45   51   58   64   70   75   78   80   81   82   83 
LCS_GDT     S   132_A     S   132_A      4    5   66      3    4    4    5    5    8   12   18   28   32   39   44   54   59   63   66   74   77   78   81 
LCS_GDT     A   133_A     A   133_A      4    5   66      3    4    5    6    9   10   13   15   18   18   21   31   37   48   57   61   66   70   75   79 
LCS_GDT     G   134_A     G   134_A      4   12   66      3    4    5    7   10   11   21   25   36   41   49   53   62   67   71   78   80   81   82   83 
LCS_GDT     Q   135_A     Q   135_A      4   12   66      1    4    5    7   11   19   24   31   38   44   53   60   65   70   75   78   80   81   82   83 
LCS_GDT     N   136_A     N   136_A     10   12   66      9    9   13   20   24   31   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     G   137_A     G   137_A     10   12   66      9    9   10   15   23   31   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     Y   138_A     Y   138_A     10   12   66      9    9   10   17   23   31   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     L   139_A     L   139_A     10   12   66      9    9   13   20   24   31   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     I   140_A     I   140_A     10   12   66      9    9   10   10   20   31   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     C   141_A     C   141_A     10   12   66      9    9   10   10   12   23   34   41   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     G   142_A     G   142_A     10   12   66      9    9   10   17   23   31   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     K   143_A     K   143_A     10   12   66      9    9   10   12   20   26   36   42   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     L   144_A     L   144_A     10   12   66      9    9   10   11   11   16   21   33   40   44   54   60   67   72   75   78   80   81   82   83 
LCS_GDT     K   145_A     K   145_A     10   12   66      3    3   10   10   10   13   13   19   28   36   47   53   60   63   69   78   80   81   82   83 
LCS_GDT     K   146_A     K   146_A      3   11   66      3    3    5    9   13   18   22   32   37   41   46   55   61   70   74   78   80   81   82   83 
LCS_GDT     D   147_A     D   147_A      4    6   66      4    4    5   10   15   21   30   34   40   50   59   64   67   72   75   78   80   81   82   83 
LCS_GDT     D   148_A     D   148_A      4    6   66      4    4    8    9    9   11   11   14   16   19   24   25   49   60   68   76   80   81   82   83 
LCS_GDT     D   149_A     D   149_A      4    6   66      4    4    4   11   11   11   12   14   31   39   48   58   65   67   73   78   80   81   82   83 
LCS_GDT     L   150_A     L   150_A     10   11   66      7   11   22   25   28   32   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     K   151_A     K   151_A     10   11   66      6   13   22   25   28   32   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     N   152_A     N   152_A     10   11   66      5   12   22   25   28   32   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     V   153_A     V   153_A     10   11   66      6   13   22   25   28   32   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     P   154_A     P   154_A     10   11   66      7   13   22   25   28   32   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     I   155_A     I   155_A     10   11   66      7   13   22   25   28   32   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     V   156_A     V   156_A     10   11   66      7   13   22   25   28   32   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     I   157_A     I   157_A     10   11   66      6   11   16   23   28   32   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     I   158_A     I   158_A     10   11   66      3   11   14   23   28   32   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     G   159_A     G   159_A     10   11   66      3    4   12   21   26   32   35   42   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     N   160_A     N   160_A      4   13   66      3    4    5   11   26   32   33   40   46   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     P   161_A     P   161_A      4   13   66      4   10   17   21   27   31   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     D   162_A     D   162_A      7   13   66      4    4    8   10   11   12   13   16   22   31   46   60   67   72   75   78   80   81   82   83 
LCS_GDT     G   163_A     G   163_A      8   13   66      4    8   10   10   12   14   21   32   37   55   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     F   164_A     F   164_A      8   13   66      4   10   17   21   27   31   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     A   165_A     A   165_A      8   13   66      4    8    8   10   11   16   19   25   50   55   59   62   67   72   75   78   80   81   82   83 
LCS_GDT     Q   166_A     Q   166_A      8   13   66      4    8    8   10   11   12   17   21   37   41   45   53   61   72   75   78   80   81   82   83 
LCS_GDT     H   167_A     H   167_A      8   13   66      4    8    8   20   27   31   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     R   168_A     R   168_A      8   13   66      4    8    8   14   23   28   34   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     K   169_A     K   169_A      8   13   66      4    8    8   12   23   28   31   41   50   55   58   63   67   72   75   78   80   81   82   83 
LCS_GDT     L   170_A     L   170_A      8   13   66      4    8   13   20   24   31   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     K   171_A     K   171_A      4   13   66      3    4   12   15   19   21   34   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     A   172_A     A   172_A      4   13   66      3    4   10   17   28   29   33   39   46   52   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     H   173_A     H   173_A      3    8   66      3    3    4    7   15   23   33   44   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     A   174_A     A   174_A      3    8   66      3    3    5   10   21   26   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     D   175_A     D   175_A      7   10   66      4    5    9   14   23   28   34   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     E   176_A     E   176_A      7   10   66      4    6   13   20   27   31   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     Y   177_A     Y   177_A      7   10   66      4    6    8   19   26   32   36   44   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     V   178_A     V   178_A      7   10   66      4    6   15   22   27   32   38   44   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     A   179_A     A   179_A      7   10   66      3    6    8    9   12   14   29   37   48   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     K   180_A     K   180_A      7   10   66      3    6    8    9   12   19   25   31   41   45   51   58   64   69   75   78   80   81   82   83 
LCS_GDT     P   181_A     P   181_A      7   15   66      3    6   10   20   23   28   35   41   48   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     V   182_A     V   182_A     14   15   66      6   12   19   25   27   32   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     D   183_A     D   183_A     14   15   62     13   14   22   25   28   32   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     A   184_A     A   184_A     14   15   62     13   14   22   25   28   32   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     D   185_A     D   185_A     14   15   62     13   14   22   25   28   32   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     Q   186_A     Q   186_A     14   15   62     13   14   22   25   28   32   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     L   187_A     L   187_A     14   15   62     13   14   22   25   28   32   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     V   188_A     V   188_A     14   15   62     13   14   22   25   28   32   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     E   189_A     E   189_A     14   15   62     13   14   22   25   28   32   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     R   190_A     R   190_A     14   15   62     13   14   22   25   28   32   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     A   191_A     A   191_A     14   15   62     13   14   22   25   28   32   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     G   192_A     G   192_A     14   15   62     13   14   22   25   28   32   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     A   193_A     A   193_A     14   15   62     13   14   22   25   28   32   38   45   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     L   194_A     L   194_A     14   15   62     13   14   19   25   28   32   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_GDT     I   195_A     I   195_A     14   15   62     13   14   22   25   28   32   38   46   51   57   61   64   67   72   75   78   80   81   82   83 
LCS_AVERAGE  LCS_A:   9.21  (   3.33    4.77   19.53 )

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     13     14     22     25     28     32     38     46     51     57     61     64     67     72     75     78     80     81     82     83 
GDT PERCENT_AT   5.86   6.31   9.91  11.26  12.61  14.41  17.12  20.72  22.97  25.68  27.48  28.83  30.18  32.43  33.78  35.14  36.04  36.49  36.94  37.39
GDT RMS_LOCAL    0.30   0.34   1.00   1.15   1.44   1.68   2.37   2.79   2.97   3.25   3.54   3.67   3.84   4.14   4.42   4.65   4.80   4.87   4.94   5.04
GDT RMS_ALL_AT  34.72  34.76  34.80  34.71  35.27  34.78  35.74  36.07  36.18  36.46  36.68  36.69  36.79  36.97  37.10  37.14  37.11  37.12  37.04  37.10

# Checking swapping
#   possible swapping detected:  E    46_A      E    46_A
#   possible swapping detected:  F    55_A      F    55_A
#   possible swapping detected:  E    57_A      E    57_A
#   possible swapping detected:  E    84_A      E    84_A
#   possible swapping detected:  D    86_A      D    86_A
#   possible swapping detected:  E    98_A      E    98_A
#   possible swapping detected:  E   106_A      E   106_A
#   possible swapping detected:  D   109_A      D   109_A
#   possible swapping detected:  D   130_A      D   130_A
#   possible swapping detected:  D   147_A      D   147_A
#   possible swapping detected:  D   148_A      D   148_A
#   possible swapping detected:  D   149_A      D   149_A
#   possible swapping detected:  D   162_A      D   162_A
#   possible swapping detected:  D   175_A      D   175_A
#   possible swapping detected:  D   183_A      D   183_A
#   possible swapping detected:  D   185_A      D   185_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    Q    36_A      Q    36_A    74.791     0    0.033   0.861    76.078    0.000    0.000
LGA    N    37_A      N    37_A    77.146     0    0.563   1.078    80.128    0.000    0.000
LGA    P    38_A      P    38_A    79.614     0    0.644   0.842    79.650    0.000    0.000
LGA    Q    39_A      Q    39_A    77.013     0    0.593   0.803    77.808    0.000    0.000
LGA    L    40_A      L    40_A    73.538     0    0.673   0.635    74.455    0.000    0.000
LGA    R    41_A      R    41_A    73.604     0    0.672   1.607    76.449    0.000    0.000
LGA    N    42_A      N    42_A    73.090     0    0.734   0.731    74.453    0.000    0.000
LGA    M    43_A      M    43_A    69.639     0    0.637   0.928    70.255    0.000    0.000
LGA    G    44_A      G    44_A    69.540     0    0.068   0.068    69.647    0.000    0.000
LGA    P    45_A      P    45_A    69.245     0    0.049   0.277    70.401    0.000    0.000
LGA    E    46_A      E    46_A    67.884     0    0.019   1.095    68.919    0.000    0.000
LGA    A    47_A      A    47_A    67.639     0    0.018   0.020    67.865    0.000    0.000
LGA    R    48_A      R    48_A    68.467     0    0.020   1.530    70.009    0.000    0.000
LGA    Q    49_A      Q    49_A    67.609     0    0.179   0.959    68.045    0.000    0.000
LGA    M    50_A      M    50_A    66.166     0    0.218   0.810    66.829    0.000    0.000
LGA    L    51_A      L    51_A    66.823     0    0.054   0.117    68.202    0.000    0.000
LGA    R    52_A      R    52_A    66.146     0    0.041   1.490    66.573    0.000    0.000
LGA    P    53_A      P    53_A    65.067     0    0.113   0.132    65.756    0.000    0.000
LGA    M    54_A      M    54_A    65.025     0    0.280   0.873    66.093    0.000    0.000
LGA    F    55_A      F    55_A    65.418     0    0.324   1.575    66.292    0.000    0.000
LGA    R    56_A      R    56_A    67.783     0    0.588   1.133    75.435    0.000    0.000
LGA    E    57_A      E    57_A    69.393     0    0.585   0.657    76.077    0.000    0.000
LGA    M    58_A      M    58_A    64.093     0    0.604   1.073    65.961    0.000    0.000
LGA    M    59_A      M    59_A    64.405     0    0.652   1.277    66.181    0.000    0.000
LGA    S    60_A      S    60_A    65.227     0    0.630   0.734    67.896    0.000    0.000
LGA    N    61_A      N    61_A    62.412     0    0.108   1.130    63.343    0.000    0.000
LGA    P    62_A      P    62_A    60.723     0    0.042   0.072    61.659    0.000    0.000
LGA    E    63_A      E    63_A    60.489     0    0.642   1.566    63.992    0.000    0.000
LGA    S    64_A      S    64_A    58.013     0    0.080   0.091    59.487    0.000    0.000
LGA    M    65_A      M    65_A    53.740     0    0.590   1.027    55.780    0.000    0.000
LGA    R    66_A      R    66_A    53.593     0    0.252   1.123    53.948    0.000    0.000
LGA    S    67_A      S    67_A    55.392     0    0.312   0.723    55.745    0.000    0.000
LGA    M    68_A      M    68_A    54.915     0    0.560   1.123    59.553    0.000    0.000
LGA    M    69_A      M    69_A    55.178     0    0.134   0.753    55.732    0.000    0.000
LGA    N    70_A      N    70_A    56.442     0    0.189   1.057    59.953    0.000    0.000
LGA    M    71_A      M    71_A    55.841     0    0.158   1.123    57.634    0.000    0.000
LGA    G    72_A      G    72_A    56.174     0    0.213   0.213    56.274    0.000    0.000
LGA    R    73_A      R    73_A    55.606     0    0.054   1.352    58.946    0.000    0.000
LGA    A    74_A      A    74_A    56.207     0    0.097   0.090    56.380    0.000    0.000
LGA    W    75_A      W    75_A    56.698     0    0.052   0.677    57.175    0.000    0.000
LGA    G    76_A      G    76_A    57.221     0    0.544   0.544    57.221    0.000    0.000
LGA    S    77_A      S    77_A    57.267     0    0.516   0.886    59.374    0.000    0.000
LGA    K    78_A      K    78_A    52.616     0    0.026   0.599    54.375    0.000    0.000
LGA    K    79_A      K    79_A    49.409     0    0.078   0.614    52.339    0.000    0.000
LGA    I    80_A      I    80_A    41.969     0    0.034   0.686    44.660    0.000    0.000
LGA    L    81_A      L    81_A    37.359     0    0.050   0.099    39.124    0.000    0.000
LGA    I    82_A      I    82_A    30.201     0    0.019   0.092    32.984    0.000    0.000
LGA    V    83_A      V    83_A    25.457     0    0.078   0.089    28.925    0.000    0.000
LGA    E    84_A      E    84_A    19.461     0    0.146   0.889    21.606    0.000    0.000
LGA    S    85_A      S    85_A    14.323     0    0.707   0.823    16.244    0.000    0.000
LGA    D    86_A      D    86_A    16.708     0    0.494   1.336    20.292    0.000    0.000
LGA    T    87_A      T    87_A    19.881     0    0.262   0.379    21.910    0.000    0.000
LGA    A    88_A      A    88_A    20.997     0    0.312   0.295    21.828    0.000    0.000
LGA    L    89_A      L    89_A    16.443     0    0.344   1.397    17.635    0.000    0.000
LGA    S    90_A      S    90_A    19.575     0    0.316   0.675    22.337    0.000    0.000
LGA    A    91_A      A    91_A    24.541     0    0.077   0.087    27.896    0.000    0.000
LGA    T    92_A      T    92_A    27.232     0    0.496   0.513    29.549    0.000    0.000
LGA    L    93_A      L    93_A    27.391     0    0.091   1.445    31.863    0.000    0.000
LGA    R    94_A      R    94_A    33.709     0    0.578   0.945    40.848    0.000    0.000
LGA    S    95_A      S    95_A    38.967     0    0.132   0.678    41.841    0.000    0.000
LGA    A    96_A      A    96_A    39.620     0    0.242   0.248    41.602    0.000    0.000
LGA    L    97_A      L    97_A    38.516     0    0.608   0.558    39.628    0.000    0.000
LGA    E    98_A      E    98_A    40.333     0    0.180   1.173    43.643    0.000    0.000
LGA    G    99_A      G    99_A    38.383     0    0.701   0.701    39.170    0.000    0.000
LGA    R   100_A      R   100_A    35.424     0    0.665   0.947    37.457    0.000    0.000
LGA    G   101_A      G   101_A    37.822     0    0.691   0.691    37.822    0.000    0.000
LGA    F   102_A      F   102_A    32.133     0    0.035   1.411    34.082    0.000    0.000
LGA    T   103_A      T   103_A    31.103     0    0.116   0.207    35.375    0.000    0.000
LGA    V   104_A      V   104_A    24.086     0    0.077   0.176    26.878    0.000    0.000
LGA    D   105_A      D   105_A    20.818     0    0.137   1.205    23.330    0.000    0.000
LGA    E   106_A      E   106_A    16.191     0    0.059   1.131    21.679    0.000    0.000
LGA    T   107_A      T   107_A    10.972     0    0.019   1.173    12.447    0.000    2.041
LGA    T   108_A      T   108_A    11.589     0    0.529   0.818    15.242    0.000    0.000
LGA    D   109_A      D   109_A     7.413     0    0.173   1.362     9.016    4.286   29.167
LGA    G   110_A      G   110_A    11.571     0    0.600   0.600    11.571    0.476    0.476
LGA    K   111_A      K   111_A     9.913     0    0.018   0.796    16.374    2.024    0.899
LGA    G   112_A      G   112_A     8.395     0    0.192   0.192     9.178    6.667    6.667
LGA    S   113_A      S   113_A     7.911     0    0.046   0.644    11.030   10.595    7.302
LGA    V   114_A      V   114_A     5.804     0    0.029   0.059     6.927   25.833   24.218
LGA    E   115_A      E   115_A     3.664     0    0.052   0.803     6.265   47.381   34.233
LGA    Q   116_A      Q   116_A     3.656     0    0.087   0.906     8.956   48.452   29.841
LGA    I   117_A      I   117_A     4.332     0    0.197   1.363     8.764   38.810   26.786
LGA    R   118_A      R   118_A     2.835     0    0.607   1.433     5.846   51.905   51.558
LGA    R   119_A      R   119_A     6.016     0    0.587   1.258    11.848   27.976   10.649
LGA    D   120_A      D   120_A     4.657     0    0.680   0.547     7.112   30.357   23.929
LGA    R   121_A      R   121_A     4.699     0    0.482   1.040     5.254   33.095   33.680
LGA    P   122_A      P   122_A     7.015     0    0.660   0.803    10.205   22.976   13.946
LGA    D   123_A      D   123_A     2.510     0    0.642   1.044     7.523   55.595   38.571
LGA    L   124_A      L   124_A     1.531     0    0.151   0.839     4.728   72.857   61.429
LGA    V   125_A      V   125_A     1.649     0    0.043   0.051     1.878   75.000   74.082
LGA    V   126_A      V   126_A     1.505     0    0.030   0.067     1.751   75.000   77.755
LGA    L   127_A      L   127_A     2.385     0    0.081   1.384     4.434   61.190   57.619
LGA    A   128_A      A   128_A     2.918     0    0.057   0.056     3.664   50.238   50.190
LGA    V   129_A      V   129_A     5.122     0    0.592   0.611     8.874   20.833   23.401
LGA    D   130_A      D   130_A     5.904     0    0.509   1.178     7.181   20.833   18.988
LGA    L   131_A      L   131_A    10.147     0    0.086   0.921    11.765    1.190    0.655
LGA    S   132_A      S   132_A    15.568     0    0.640   0.947    18.463    0.000    0.000
LGA    A   133_A      A   133_A    16.967     0    0.082   0.077    18.735    0.000    0.000
LGA    G   134_A      G   134_A    11.838     0    0.490   0.490    13.398    0.000    0.000
LGA    Q   135_A      Q   135_A     9.173     0    0.585   1.074    16.777   10.000    4.444
LGA    N   136_A      N   136_A     2.761     0    0.608   1.298     6.646   51.310   36.786
LGA    G   137_A      G   137_A     2.642     0    0.067   0.067     3.365   57.262   57.262
LGA    Y   138_A      Y   138_A     3.301     0    0.038   1.288     8.637   51.786   36.508
LGA    L   139_A      L   139_A     2.394     0    0.012   1.416     3.705   60.952   61.250
LGA    I   140_A      I   140_A     3.695     0    0.050   0.082     5.049   42.262   39.881
LGA    C   141_A      C   141_A     4.818     0    0.096   0.800     7.535   30.357   25.794
LGA    G   142_A      G   142_A     3.885     0    0.117   0.117     4.466   40.238   40.238
LGA    K   143_A      K   143_A     5.067     0    0.070   0.408     7.083   22.619   24.074
LGA    L   144_A      L   144_A     7.456     0    0.586   0.603     9.307   11.071    7.262
LGA    K   145_A      K   145_A     9.749     0    0.552   1.085    16.805    0.595    0.265
LGA    K   146_A      K   146_A     9.331     0    0.707   0.952    15.864    5.833    2.593
LGA    D   147_A      D   147_A     6.444     0    0.586   1.037     7.338   16.667   18.750
LGA    D   148_A      D   148_A     9.452     0    0.083   1.255    13.767    3.095    1.548
LGA    D   149_A      D   149_A     7.757     0    0.195   0.339    12.877   12.143    6.667
LGA    L   150_A      L   150_A     3.194     0    0.664   1.234     5.983   48.333   43.929
LGA    K   151_A      K   151_A     3.433     0    0.017   0.718     4.841   51.786   45.185
LGA    N   152_A      N   152_A     1.586     0    0.025   1.209     4.755   79.405   66.310
LGA    V   153_A      V   153_A     1.569     0    0.058   0.840     4.618   71.071   60.544
LGA    P   154_A      P   154_A     1.591     0    0.072   0.188     2.064   72.857   71.701
LGA    I   155_A      I   155_A     2.021     0    0.063   0.241     3.723   68.810   61.310
LGA    V   156_A      V   156_A     1.736     0    0.083   0.093     2.053   70.833   74.150
LGA    I   157_A      I   157_A     3.179     0    0.048   1.174     7.196   51.786   40.119
LGA    I   158_A      I   158_A     3.397     0    0.646   1.086     7.490   34.048   40.714
LGA    G   159_A      G   159_A     6.118     0    0.074   0.074     6.118   26.786   26.786
LGA    N   160_A      N   160_A     7.208     0    0.695   1.174    10.622   19.405   12.381
LGA    P   161_A      P   161_A     2.026     0    0.180   0.194     4.029   52.262   53.333
LGA    D   162_A      D   162_A     7.259     0    0.063   0.942    13.593   14.048    7.202
LGA    G   163_A      G   163_A     6.950     0    0.247   0.247     6.950   22.381   22.381
LGA    F   164_A      F   164_A     1.682     0    0.061   0.133     8.230   63.095   38.139
LGA    A   165_A      A   165_A     6.341     0    0.045   0.050     8.736   21.190   17.524
LGA    Q   166_A      Q   166_A     7.345     0    0.120   1.003    14.572   18.929    8.571
LGA    H   167_A      H   167_A     3.380     0    0.140   0.291    10.085   58.214   29.524
LGA    R   168_A      R   168_A     3.982     0    0.040   1.429    13.719   41.190   17.879
LGA    K   169_A      K   169_A     6.524     0    0.151   0.574    15.611   22.024   10.370
LGA    L   170_A      L   170_A     2.302     0    0.625   0.590     5.543   65.238   51.310
LGA    K   171_A      K   171_A     4.002     0    0.361   0.372     5.625   38.690   35.344
LGA    A   172_A      A   172_A     6.421     0    0.448   0.414     9.225   20.714   16.857
LGA    H   173_A      H   173_A     4.743     0    0.693   1.548     8.311   37.262   23.095
LGA    A   174_A      A   174_A     4.107     0    0.232   0.347     4.682   41.905   39.810
LGA    D   175_A      D   175_A     3.907     0    0.651   0.968     8.605   45.238   28.571
LGA    E   176_A      E   176_A     2.423     0    0.035   1.492     8.689   50.833   34.021
LGA    Y   177_A      Y   177_A     5.367     0    0.038   1.160    12.622   37.500   13.770
LGA    V   178_A      V   178_A     4.379     0    0.089   1.056     8.124   22.381   23.265
LGA    A   179_A      A   179_A     7.120     0    0.012   0.031     7.418   14.643   13.714
LGA    K   180_A      K   180_A    10.946     0    0.579   0.846    20.619    0.238    0.106
LGA    P   181_A      P   181_A     7.930     0    0.101   0.345    10.695   13.810    8.776
LGA    V   182_A      V   182_A     3.021     0    0.392   1.125     6.641   49.048   37.483
LGA    D   183_A      D   183_A     2.472     0    0.144   0.483     3.025   61.190   61.071
LGA    A   184_A      A   184_A     3.438     0    0.028   0.036     4.186   50.000   47.429
LGA    D   185_A      D   185_A     3.487     0    0.077   0.523     5.664   51.786   44.048
LGA    Q   186_A      Q   186_A     2.067     0    0.051   0.461     3.340   69.048   67.778
LGA    L   187_A      L   187_A     1.456     0    0.018   1.385     3.780   77.143   68.333
LGA    V   188_A      V   188_A     2.348     0    0.025   0.129     3.930   66.786   57.687
LGA    E   189_A      E   189_A     2.518     0    0.040   0.137     3.971   62.857   54.286
LGA    R   190_A      R   190_A     1.456     0    0.032   0.962     2.479   77.143   76.190
LGA    A   191_A      A   191_A     0.659     0    0.045   0.048     1.263   85.952   86.857
LGA    G   192_A      G   192_A     2.668     0    0.034   0.034     3.520   55.833   55.833
LGA    A   193_A      A   193_A     3.564     0    0.185   0.192     3.762   48.333   47.333
LGA    L   194_A      L   194_A     3.130     0    0.297   0.309     4.208   55.476   52.024
LGA    I   195_A      I   195_A     2.498     0    0.131   1.158     5.227   57.262   52.500

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      160     640    640  100.00    1234   1234  100.00               222
SUMMARY(RMSD_GDC):    17.744         17.625                 18.224           15.156   13.094

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  160  222    4.0     46    2.79    18.356    15.426     1.593

LGA_LOCAL      RMSD:   2.788  Number of atoms:   46  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  36.073  Number of assigned atoms:  160 
Std_ASGN_ATOMS RMSD:  17.744  Standard rmsd on all 160 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.499588 * X  +   0.845805 * Y  +  -0.187151 * Z  +  17.163988
  Y_new =  -0.298957 * X  +  -0.371112 * Y  +  -0.879148 * Z  +  59.774151
  Z_new =  -0.813041 * X  +  -0.383262 * Y  +   0.438263 * Z  +  49.721828 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -2.602345  0.949357 -0.718548   [DEG: -149.1034   54.3941  -41.1698 ]
ZXZ: -0.209746  1.117131 -2.011297   [DEG:  -12.0176   64.0069 -115.2388 ]
 
# END of job
