
#######################################################
#                                                     #
#                        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  164 ( 1284),  selected  151 , name one
# Molecule2: number of CA atoms  151 ( 1194),  selected  151 , 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:    67      50_A - 116_A       4.97    16.07
  LONGEST_CONTINUOUS_SEGMENT:    67      51_A - 117_A       4.93    16.11
  LCS_AVERAGE:     34.71

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    29      49_A - 77_A        1.94    23.29
  LONGEST_CONTINUOUS_SEGMENT:    29      50_A - 78_A        1.79    22.81
  LCS_AVERAGE:     14.65

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    20      54_A - 73_A        0.94    23.60
  LCS_AVERAGE:      9.77

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  151
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    11_A     Q    11_A      3   17   28      3    3    5   14   23   32   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     A    12_A     A    12_A      4   17   28      3    4    4   14   24   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     V    13_A     V    13_A     14   17   28      3   12   14   18   23   32   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     E    14_A     E    14_A     14   17   28      5   12   14   18   19   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     D    15_A     D    15_A     14   17   28      5   12   14   18   23   33   39   44   47   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     F    16_A     F    16_A     14   17   28      5   12   14   18   19   32   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     L    17_A     L    17_A     14   17   28      5   12   14   18   19   22   28   39   45   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     R    18_A     R    18_A     14   17   28      7   12   14   18   19   22   28   35   44   51   59   60   61   65   70   71   73   76   79   82 
LCS_GDT     V    19_A     V    19_A     14   17   28      7   12   14   18   19   22   30   39   44   52   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     H    20_A     H    20_A     14   17   28      7   12   14   18   19   22   28   32   42   52   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     S    21_A     S    21_A     14   17   28      7   12   14   18   19   22   25   29   35   39   43   50   58   63   70   71   73   76   79   82 
LCS_GDT     E    22_A     E    22_A     14   17   30      7   12   14   18   19   22   25   29   35   39   44   51   58   63   70   71   73   76   79   82 
LCS_GDT     L    23_A     L    23_A     14   17   53      7   12   14   18   19   22   25   29   35   41   52   56   60   64   70   71   73   76   79   82 
LCS_GDT     V    24_A     V    24_A     14   17   53      7   12   14   18   19   22   25   29   35   39   43   47   55   63   70   71   73   76   79   82 
LCS_GDT     H    25_A     H    25_A     14   17   53      4    8   14   18   19   22   24   27   30   34   39   47   50   52   59   65   70   76   77   81 
LCS_GDT     R    26_A     R    26_A     14   17   53      3    6   14   18   19   22   25   29   33   37   43   47   50   52   59   65   70   76   77   81 
LCS_GDT     L    27_A     L    27_A     10   17   53      3    5   11   13   16   20   26   31   34   37   40   44   47   50   59   65   68   74   77   81 
LCS_GDT     A    28_A     A    28_A      4    4   53      3    4    4    8   16   20   26   31   34   36   40   42   44   47   51   54   55   59   62   67 
LCS_GDT     G    29_A     G    29_A      4    4   53      3    4    4    8   16   20   26   29   34   37   40   42   47   50   52   54   55   56   62   67 
LCS_GDT     D    30_A     D    30_A      3    4   53      3    3    4    4    6   20   25   29   33   37   40   42   47   50   52   54   55   56   59   67 
LCS_GDT     P    31_A     P    31_A      3    4   53      3    3    4    6    6    8   15   21   23   27   31   39   44   50   52   54   55   60   64   67 
LCS_GDT     P    32_A     P    32_A      3   20   53      3    3    4    6    6    8   16   19   24   28   34   40   47   50   52   54   55   60   64   69 
LCS_GDT     D    33_A     D    33_A     18   20   53     13   17   17   18   18   19   20   22   28   33   37   42   47   50   52   54   55   56   58   65 
LCS_GDT     E    34_A     E    34_A     18   20   53     13   17   17   18   18   19   20   22   23   28   32   39   45   50   52   54   55   56   62   67 
LCS_GDT     L    35_A     L    35_A     18   20   53     13   17   17   18   18   19   20   22   22   26   31   36   37   45   50   53   55   56   62   67 
LCS_GDT     F    36_A     F    36_A     18   20   53     13   17   17   18   18   19   20   22   24   31   37   42   47   50   52   54   55   56   62   67 
LCS_GDT     Q    37_A     Q    37_A     18   20   53     13   17   17   18   18   20   25   29   33   37   40   42   47   50   52   54   55   56   62   67 
LCS_GDT     R    38_A     R    38_A     18   20   53     13   17   17   18   18   19   20   22   27   33   36   40   47   50   52   54   55   56   62   67 
LCS_GDT     L    39_A     L    39_A     18   20   53     13   17   17   18   18   19   20   22   23   28   32   39   47   50   52   54   55   59   64   67 
LCS_GDT     D    40_A     D    40_A     18   20   53     13   17   17   18   18   24   26   31   34   37   40   42   47   50   52   54   55   60   64   67 
LCS_GDT     R    41_A     R    41_A     18   20   53     13   17   17   18   18   20   25   29   33   37   40   42   47   50   52   54   55   60   64   68 
LCS_GDT     F    42_A     F    42_A     18   20   53     13   17   17   18   18   19   20   28   32   36   40   42   47   50   52   54   55   60   64   73 
LCS_GDT     V    43_A     V    43_A     18   20   53     13   17   17   18   18   19   22   31   34   37   40   42   47   50   52   54   59   67   74   78 
LCS_GDT     T    44_A     T    44_A     18   20   53     13   17   17   18   18   19   27   31   34   37   40   42   47   50   52   54   60   67   74   78 
LCS_GDT     D    45_A     D    45_A     18   20   53     13   17   17   18   18   20   26   31   34   37   40   42   47   50   52   54   61   69   74   78 
LCS_GDT     A    46_A     A    46_A     18   20   53     13   17   17   18   18   21   27   31   34   37   40   42   47   50   54   62   67   70   75   80 
LCS_GDT     I    47_A     I    47_A     18   20   53      4   17   17   25   26   29   30   30   31   32   36   38   50   60   64   69   72   75   79   82 
LCS_GDT     I    48_A     I    48_A     18   20   53     10   17   17   18   18   19   20   22   26   32   36   42   47   56   63   68   71   74   77   81 
LCS_GDT     E    49_A     E    49_A     18   29   60      3   17   17   18   22   26   28   31   34   37   40   45   54   60   64   69   72   74   77   82 
LCS_GDT     G    50_A     G    50_A     18   29   67      3    5   17   18   23   29   30   30   31   39   45   52   58   61   64   69   72   75   79   82 
LCS_GDT     N    51_A     N    51_A      6   29   67      3    5   11   21   25   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     P    52_A     P    52_A      6   29   67      4    6   18   25   26   29   30   31   45   52   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     E    53_A     E    53_A      6   29   67      4    5    6    9   17   29   30   37   44   51   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     R    54_A     R    54_A     20   29   67      6   17   20   25   26   29   37   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     R    55_A     R    55_A     20   29   67      7   17   20   24   26   29   30   32   45   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     D    56_A     D    56_A     20   29   67      8   17   20   25   26   29   30   31   38   43   51   57   60   65   70   71   73   76   79   82 
LCS_GDT     E    57_A     E    57_A     20   29   67      8   17   20   25   26   29   30   37   44   47   54   57   61   65   70   71   73   76   79   82 
LCS_GDT     I    58_A     I    58_A     20   29   67      7   17   20   25   26   29   37   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     K    59_A     K    59_A     20   29   67      7   17   20   25   26   29   30   31   38   46   54   58   62   65   70   71   73   76   79   82 
LCS_GDT     A    60_A     A    60_A     20   29   67      7   17   20   25   26   29   30   31   38   43   51   56   60   65   68   70   73   74   77   80 
LCS_GDT     D    61_A     D    61_A     20   29   67      8   17   20   25   26   29   30   37   44   47   54   57   62   65   70   71   73   76   79   82 
LCS_GDT     L    62_A     L    62_A     20   29   67      8   17   20   25   26   29   37   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     A    63_A     A    63_A     20   29   67      8   17   20   25   26   29   30   31   35   42   47   53   60   62   68   70   72   74   77   80 
LCS_GDT     R    64_A     R    64_A     20   29   67      8   17   20   25   26   29   30   31   34   39   45   52   59   61   67   70   72   74   77   78 
LCS_GDT     A    65_A     A    65_A     20   29   67      8   17   20   25   26   29   36   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     A    66_A     A    66_A     20   29   67      8   17   20   25   26   29   30   31   38   44   54   56   60   65   68   70   72   74   79   82 
LCS_GDT     R    67_A     R    67_A     20   29   67      8   16   20   25   26   29   30   31   34   37   44   49   54   61   63   69   72   73   76   78 
LCS_GDT     V    68_A     V    68_A     20   29   67      8   17   20   25   26   29   30   31   41   47   54   56   60   65   68   70   72   74   79   82 
LCS_GDT     F    69_A     F    69_A     20   29   67      8   17   20   25   26   29   37   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     G    70_A     G    70_A     20   29   67      4   17   20   25   26   29   30   31   38   44   54   56   60   65   68   70   72   74   77   80 
LCS_GDT     E    71_A     E    71_A     20   29   67      4   12   20   25   26   29   30   31   38   46   54   56   60   65   68   70   72   74   77   80 
LCS_GDT     A    72_A     A    72_A     20   29   67      4   17   20   25   26   29   36   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     L    73_A     L    73_A     20   29   67      3   12   18   25   26   29   30   41   48   50   56   59   62   65   68   70   73   75   79   82 
LCS_GDT     E    74_A     E    74_A     17   29   67      3   12   18   25   26   29   30   31   34   42   50   56   60   65   68   70   72   74   77   80 
LCS_GDT     R    75_A     R    75_A     17   29   67      8   15   20   25   26   29   30   38   45   49   54   56   61   65   68   70   72   74   79   82 
LCS_GDT     D    76_A     D    76_A      6   29   67      4    7   12   25   26   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     I    77_A     I    77_A     15   29   67      5   12   20   25   26   29   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     T    78_A     T    78_A     15   29   67      5   13   14   16   23   26   30   34   46   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     T    79_A     T    79_A     15   18   67      8   13   14   16   19   21   27   32   44   52   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     P    80_A     P    80_A     15   18   67      9   13   14   16   19   21   27   31   44   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     E    81_A     E    81_A     15   18   67      9   13   14   16   19   21   28   43   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     D    82_A     D    82_A     15   18   67      9   13   14   16   19   24   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     F    83_A     F    83_A     15   18   67      9   13   14   16   19   24   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     N    84_A     N    84_A     15   27   67      9   13   14   16   19   25   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     A    85_A     A    85_A     15   28   67      9   13   14   18   25   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     F    86_A     F    86_A     15   28   67      9   13   14   21   25   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     L    87_A     L    87_A     15   28   67      9   13   14   18   25   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     R    88_A     R    88_A     15   28   67      8   13   18   21   25   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     E    89_A     E    89_A     15   28   67      5   13   18   21   25   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     L    90_A     L    90_A     15   28   67      9   13   14   16   23   27   36   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     G    91_A     G    91_A     15   28   67      4   10   14   19   25   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     P    92_A     P    92_A     14   28   67      4   10   18   21   25   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     E    93_A     E    93_A     15   28   67      4   10   18   21   25   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     A    94_A     A    94_A     16   28   67      6   13   18   21   25   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     V    95_A     V    95_A     16   28   67      4   10   18   21   25   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     E    96_A     E    96_A     16   28   67      5   12   18   21   25   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     L    97_A     L    97_A     16   28   67      8   13   18   21   25   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     V    98_A     V    98_A     16   28   67      8   13   18   21   25   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     S    99_A     S    99_A     16   28   67      8   13   18   21   25   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     T   100_A     T   100_A     16   28   67      8   13   18   21   25   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     F   101_A     F   101_A     16   28   67      8   13   18   21   25   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     T   102_A     T   102_A     16   28   67      8   13   18   21   25   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     Q   103_A     Q   103_A     16   28   67      4   13   18   21   25   33   38   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     Q   104_A     Q   104_A     16   28   67      4   13   18   21   25   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     F   105_A     F   105_A     16   28   67      8   13   18   21   25   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     V   106_A     V   106_A     16   28   67      4   13   18   21   25   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     D   107_A     D   107_A     16   28   67      8   13   18   21   25   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     V   108_A     V   108_A     16   28   67      4   13   17   21   25   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     I   109_A     I   109_A     16   28   67      3   12   15   21   25   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     R   110_A     R   110_A     14   28   67      3    9   15   21   25   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     G   111_A     G   111_A     12   28   67      3    9   13   18   25   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     D   112_A     D   112_A     12   28   67      3    9   15   18   25   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     P   113_A     P   113_A     11   23   67      3    9   10   16   22   33   39   44   48   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     Q   114_A     Q   114_A      9   14   67      7    9    9   10   10   14   18   23   29   47   58   60   62   65   70   71   73   76   79   82 
LCS_GDT     A   115_A     A   115_A      9   11   67      7    9    9   10   10   14   18   23   26   33   47   59   61   65   70   71   73   76   79   82 
LCS_GDT     V   116_A     V   116_A      9   11   67      7    9    9   10   13   17   20   32   47   53   59   60   62   65   70   71   73   76   79   82 
LCS_GDT     A   117_A     A   117_A      9   11   67      7    9    9   10   10   12   14   14   18   22   33   53   59   64   66   69   72   75   79   82 
LCS_GDT     E   118_A     E   118_A      9   11   54      7    9    9   10   10   12   14   16   18   20   24   31   40   44   51   58   70   75   77   82 
LCS_GDT     H   119_A     H   119_A      9   11   49      7    9    9   10   10   12   15   16   18   22   27   36   45   52   62   68   72   75   79   82 
LCS_GDT     L   120_A     L   120_A      9   15   46      7    9   10   12   13   15   15   17   25   26   28   29   31   34   40   48   59   74   77   82 
LCS_GDT     N   121_A     N   121_A      9   15   34      7    9    9   10   10   12   14   14   16   17   20   22   28   30   33   36   38   40   46   53 
LCS_GDT     I   122_A     I   122_A     12   19   35      5   10   13   14   18   20   22   24   25   27   28   29   32   37   40   44   46   49   51   53 
LCS_GDT     S   123_A     S   123_A     12   19   35      5   10   13   14   18   20   22   24   25   27   28   29   32   37   40   44   46   49   51   53 
LCS_GDT     L   124_A     L   124_A     12   19   35      5   10   13   14   18   20   22   24   25   27   28   29   33   37   40   44   46   49   51   53 
LCS_GDT     E   125_A     E   125_A     12   19   35      5   10   13   15   18   20   22   24   25   27   28   29   32   35   37   41   45   49   51   53 
LCS_GDT     D   126_A     D   126_A     12   19   35      5   10   13   15   18   20   22   24   25   27   28   29   32   36   38   44   48   53   56   61 
LCS_GDT     V   127_A     V   127_A     12   19   35      4   10   13   15   18   20   22   24   25   27   28   29   33   37   40   44   46   53   56   59 
LCS_GDT     A   128_A     A   128_A     12   19   35      5   10   13   15   18   20   22   24   25   27   28   29   32   36   39   44   45   49   51   53 
LCS_GDT     R   129_A     R   129_A     12   19   35      5   10   13   15   18   20   22   24   25   27   28   29   32   38   46   51   59   66   76   81 
LCS_GDT     L   130_A     L   130_A     12   19   35      4   10   13   15   18   20   22   24   25   27   28   32   43   55   63   68   72   75   79   82 
LCS_GDT     A   131_A     A   131_A     12   19   35      4   10   13   15   18   20   22   24   25   27   28   31   33   37   40   45   53   67   72   76 
LCS_GDT     E   132_A     E   132_A     12   19   35      5   10   13   15   18   20   22   24   25   27   28   30   33   43   46   50   60   67   72   76 
LCS_GDT     A   133_A     A   133_A     12   19   35      5   10   13   15   18   20   22   27   35   39   43   51   57   63   70   71   73   76   79   82 
LCS_GDT     G   134_A     G   134_A     12   19   35      5   10   12   15   18   20   22   29   35   39   43   47   54   63   67   71   73   76   77   81 
LCS_GDT     E   135_A     E   135_A     12   19   35      5   10   13   15   18   20   22   24   25   27   28   33   46   47   53   55   59   64   66   74 
LCS_GDT     A   136_A     A   136_A     12   19   35      5   10   12   15   18   20   22   24   30   34   39   44   48   52   55   59   66   74   77   80 
LCS_GDT     A   137_A     A   137_A     12   19   35      5   10   12   15   18   20   22   24   25   31   38   43   48   52   58   68   71   76   77   80 
LCS_GDT     I   138_A     I   138_A     12   19   35      5    9   12   16   18   20   22   24   25   27   28   35   40   42   53   55   58   64   66   71 
LCS_GDT     E   139_A     E   139_A     12   19   35      5    9   12   15   18   20   22   24   25   27   28   31   35   37   40   44   47   57   62   67 
LCS_GDT     R   140_A     R   140_A     12   19   35      4    9   12   15   18   20   22   24   25   27   28   31   35   37   40   44   53   58   64   70 
LCS_GDT     G   141_A     G   141_A     12   21   35      3    6   12   13   16   19   22   24   25   27   28   32   36   42   47   52   55   56   59   67 
LCS_GDT     E   142_A     E   142_A      3   21   35      3    3    7   16   19   20   22   24   25   27   28   31   33   37   40   44   48   51   53   58 
LCS_GDT     G   143_A     G   143_A     17   21   35      3    9   11   17   19   20   21   24   25   27   28   32   35   37   40   44   46   49   53   61 
LCS_GDT     A   144_A     A   144_A     18   21   35      9   16   17   18   19   20   22   24   25   27   33   43   48   52   55   63   68   71   77   80 
LCS_GDT     S   145_A     S   145_A     18   21   35      9   16   17   18   19   20   22   24   25   27   31   39   48   52   58   68   71   76   77   80 
LCS_GDT     L   146_A     L   146_A     18   21   35      9   16   17   18   19   20   21   24   25   27   28   31   33   37   40   44   58   71   74   80 
LCS_GDT     G   147_A     G   147_A     18   21   35      9   16   17   18   19   20   21   23   25   27   28   35   41   50   54   63   68   71   75   80 
LCS_GDT     V   148_A     V   148_A     18   21   35      9   16   17   18   19   20   21   23   25   27   38   48   53   59   63   68   71   76   77   80 
LCS_GDT     H   149_A     H   149_A     18   21   35      9   16   17   18   19   20   21   23   25   28   32   37   46   51   55   62   68   71   76   80 
LCS_GDT     R   150_A     R   150_A     18   21   35      9   16   17   18   19   20   21   24   26   28   30   35   41   49   54   57   64   68   74   77 
LCS_GDT     E   151_A     E   151_A     18   21   35      9   16   17   18   19   20   21   24   26   28   32   37   41   50   54   60   64   69   74   78 
LCS_GDT     L   152_A     L   152_A     18   21   35      9   16   17   18   19   20   21   23   26   28   31   34   41   45   54   59   64   69   74   78 
LCS_GDT     R   153_A     R   153_A     18   21   35      9   16   17   18   19   20   21   24   26   28   30   34   37   41   48   53   58   62   68   72 
LCS_GDT     R   154_A     R   154_A     18   21   35      9   16   17   18   19   20   21   23   25   28   30   34   37   41   48   51   58   62   66   72 
LCS_GDT     I   155_A     I   155_A     18   21   35      9   16   17   18   19   20   21   23   25   27   28   33   37   41   46   49   57   62   66   68 
LCS_GDT     E   156_A     E   156_A     18   21   35      9   16   17   18   19   20   21   23   25   27   28   31   37   41   46   49   52   55   60   62 
LCS_GDT     A   157_A     A   157_A     18   21   35      9   16   17   18   19   20   21   23   25   27   28   31   33   37   44   46   52   55   60   62 
LCS_GDT     R   158_A     R   158_A     18   21   35      9   16   17   18   19   20   21   23   25   27   28   31   33   37   40   44   47   55   59   62 
LCS_GDT     R   159_A     R   159_A     18   21   35      9   16   17   18   19   20   21   23   25   27   28   31   33   36   40   44   46   49   51   53 
LCS_GDT     N   160_A     N   160_A     18   21   35      3    8   17   18   19   20   21   23   25   27   28   31   33   36   40   44   46   49   51   53 
LCS_GDT     S   161_A     S   161_A     18   21   35      3    7   17   18   19   20   21   23   25   27   28   31   33   37   40   44   46   49   51   53 
LCS_AVERAGE  LCS_A:  19.71  (   9.77   14.65   34.71 )

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     17     20     25     26     33     39     44     48     53     59     60     62     65     70     71     73     76     79     82 
GDT PERCENT_AT   8.61  11.26  13.25  16.56  17.22  21.85  25.83  29.14  31.79  35.10  39.07  39.74  41.06  43.05  46.36  47.02  48.34  50.33  52.32  54.30
GDT RMS_LOCAL    0.20   0.46   0.86   1.32   1.35   2.22   2.62   2.79   3.05   3.41   3.76   3.83   3.96   4.16   4.74   4.85   4.98   5.54   5.58   5.95
GDT RMS_ALL_AT  18.77  18.71  23.45  23.16  23.22  14.28  14.28  14.57  14.73  14.41  14.18  14.20  14.43  14.44  14.08  14.04  14.15  13.79  14.11  14.06

# Checking swapping
#   possible swapping detected:  E    14_A      E    14_A
#   possible swapping detected:  F    16_A      F    16_A
#   possible swapping detected:  E    22_A      E    22_A
#   possible swapping detected:  E    34_A      E    34_A
#   possible swapping detected:  F    36_A      F    36_A
#   possible swapping detected:  D    40_A      D    40_A
#   possible swapping detected:  F    42_A      F    42_A
#   possible swapping detected:  D    45_A      D    45_A
#   possible swapping detected:  D    56_A      D    56_A
#   possible swapping detected:  F    69_A      F    69_A
#   possible swapping detected:  E    71_A      E    71_A
#   possible swapping detected:  E    74_A      E    74_A
#   possible swapping detected:  E    81_A      E    81_A
#   possible swapping detected:  D    82_A      D    82_A
#   possible swapping detected:  E    89_A      E    89_A
#   possible swapping detected:  E    93_A      E    93_A
#   possible swapping detected:  F   101_A      F   101_A
#   possible swapping detected:  F   105_A      F   105_A
#   possible swapping detected:  D   107_A      D   107_A
#   possible swapping detected:  D   112_A      D   112_A
#   possible swapping detected:  E   125_A      E   125_A
#   possible swapping detected:  E   142_A      E   142_A
#   possible swapping detected:  E   151_A      E   151_A
#   possible swapping detected:  E   156_A      E   156_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    Q    11_A      Q    11_A     2.553     0    0.454   0.437     7.031   61.071   43.386
LGA    A    12_A      A    12_A     2.533     0    0.373   0.363     4.958   68.929   61.429
LGA    V    13_A      V    13_A     2.314     0    0.254   1.224     6.911   66.905   52.585
LGA    E    14_A      E    14_A     2.882     0    0.193   0.527     3.881   55.833   50.370
LGA    D    15_A      D    15_A     3.607     0    0.029   0.861     4.736   43.810   43.631
LGA    F    16_A      F    16_A     3.424     0    0.074   1.444     7.697   42.143   32.468
LGA    L    17_A      L    17_A     5.731     0    0.074   0.101     7.580   19.762   19.583
LGA    R    18_A      R    18_A     7.469     0    0.130   1.073     9.028    8.929    8.052
LGA    V    19_A      V    19_A     6.626     0    0.059   1.164     7.812   12.738   17.279
LGA    H    20_A      H    20_A     7.082     0    0.113   1.153    12.667    7.857    4.810
LGA    S    21_A      S    21_A    11.356     0    0.056   0.747    13.048    0.119    0.079
LGA    E    22_A      E    22_A    11.887     0    0.049   0.623    13.025    0.000    0.000
LGA    L    23_A      L    23_A    10.052     0    0.040   0.157    11.694    0.000    4.762
LGA    V    24_A      V    24_A    12.609     0    0.060   0.136    15.128    0.000    0.000
LGA    H    25_A      H    25_A    17.140     0    0.644   1.180    18.202    0.000    0.000
LGA    R    26_A      R    26_A    17.179     0    0.115   1.064    19.107    0.000    0.000
LGA    L    27_A      L    27_A    16.714     0    0.209   1.163    19.006    0.000    0.000
LGA    A    28_A      A    28_A    23.535     0    0.234   0.223    27.837    0.000    0.000
LGA    G    29_A      G    29_A    27.296     0    0.278   0.278    31.373    0.000    0.000
LGA    D    30_A      D    30_A    29.694     0    0.621   1.413    34.742    0.000    0.000
LGA    P    31_A      P    31_A    27.150     0    0.604   0.815    29.562    0.000    0.000
LGA    P    32_A      P    32_A    23.312     0    0.642   0.942    25.880    0.000    0.000
LGA    D    33_A      D    33_A    28.432     0    0.615   1.417    33.006    0.000    0.000
LGA    E    34_A      E    34_A    29.389     0    0.062   0.933    30.756    0.000    0.000
LGA    L    35_A      L    35_A    26.894     0    0.031   0.208    29.063    0.000    0.000
LGA    F    36_A      F    36_A    23.592     0    0.043   1.253    24.977    0.000    0.000
LGA    Q    37_A      Q    37_A    24.597     0    0.032   0.223    29.021    0.000    0.000
LGA    R    38_A      R    38_A    24.587     0    0.032   1.422    26.549    0.000    0.000
LGA    L    39_A      L    39_A    21.007     0    0.030   0.077    22.478    0.000    0.000
LGA    D    40_A      D    40_A    19.692     0    0.028   0.534    20.485    0.000    0.000
LGA    R    41_A      R    41_A    20.949     0    0.019   1.551    26.612    0.000    0.000
LGA    F    42_A      F    42_A    19.072     0    0.035   0.459    19.990    0.000    0.000
LGA    V    43_A      V    43_A    15.888     0    0.084   0.095    17.103    0.000    0.000
LGA    T    44_A      T    44_A    16.322     0    0.075   1.026    19.283    0.000    0.000
LGA    D    45_A      D    45_A    16.715     0    0.090   0.132    20.129    0.000    0.000
LGA    A    46_A      A    46_A    13.619     0    0.072   0.082    14.837    0.000    0.000
LGA    I    47_A      I    47_A    10.975     0    0.091   1.324    12.154    0.000    0.000
LGA    I    48_A      I    48_A    12.632     0    0.072   0.087    16.895    0.000    0.000
LGA    E    49_A      E    49_A    11.477     0    0.054   0.493    14.551    0.000    0.000
LGA    G    50_A      G    50_A     9.423     0    0.149   0.149    10.077    9.048    9.048
LGA    N    51_A      N    51_A     2.930     0    0.135   0.351     5.585   48.214   48.810
LGA    P    52_A      P    52_A     6.119     0    0.051   0.416     8.027   19.048   19.524
LGA    E    53_A      E    53_A     7.149     0    0.155   1.130    12.882   10.714    6.032
LGA    R    54_A      R    54_A     4.663     0    0.364   1.506    13.628   35.833   18.658
LGA    R    55_A      R    55_A     5.716     0    0.128   1.390    16.554   20.833    8.485
LGA    D    56_A      D    56_A     9.169     0    0.081   0.506    13.126    3.214    1.607
LGA    E    57_A      E    57_A     8.055     0    0.030   0.233    12.444    8.810    4.497
LGA    I    58_A      I    58_A     4.230     0    0.080   0.863     6.733   32.857   31.131
LGA    K    59_A      K    59_A     7.526     0    0.132   1.099    11.910    8.452    3.915
LGA    A    60_A      A    60_A     9.985     0    0.130   0.143    11.565    1.190    0.952
LGA    D    61_A      D    61_A     7.158     0    0.045   1.135    10.832   15.000    9.524
LGA    L    62_A      L    62_A     4.212     0    0.099   1.076     7.131   27.143   26.607
LGA    A    63_A      A    63_A    10.247     0    0.042   0.044    12.396    1.190    0.952
LGA    R    64_A      R    64_A    10.798     0    0.071   1.535    20.338    1.071    0.390
LGA    A    65_A      A    65_A     4.780     0    0.060   0.068     6.565   28.333   32.667
LGA    A    66_A      A    66_A     7.965     0    0.161   0.154     9.961    7.143    5.810
LGA    R    67_A      R    67_A    11.282     0    0.077   1.673    21.012    0.238    0.087
LGA    V    68_A      V    68_A     7.536     0    0.107   0.101     9.761   13.690   10.748
LGA    F    69_A      F    69_A     3.863     0    0.066   0.872     5.503   32.024   38.182
LGA    G    70_A      G    70_A     9.043     0    0.023   0.023     9.043    4.286    4.286
LGA    E    71_A      E    71_A     8.776     0    0.098   0.240    14.237    7.262    3.280
LGA    A    72_A      A    72_A     3.754     0    0.069   0.065     5.227   45.952   46.762
LGA    L    73_A      L    73_A     5.150     0    0.111   0.880     8.522   25.000   16.607
LGA    E    74_A      E    74_A     9.078     0    0.055   0.878    16.794    4.405    1.958
LGA    R    75_A      R    75_A     6.107     0    0.534   1.113    15.201   28.690   11.385
LGA    D    76_A      D    76_A     1.781     0    0.261   0.993     6.951   52.857   37.857
LGA    I    77_A      I    77_A     4.944     0    0.608   0.962     8.849   24.405   31.071
LGA    T    78_A      T    78_A     7.836     0    0.181   1.154     9.601    7.976    5.714
LGA    T    79_A      T    79_A     8.079     0    0.055   0.079     9.559    9.762    7.075
LGA    P    80_A      P    80_A     7.122     0    0.095   0.174     9.303   13.929    9.048
LGA    E    81_A      E    81_A     5.959     0    0.046   1.204     9.486   24.524   14.497
LGA    D    82_A      D    82_A     4.648     0    0.063   0.239     6.624   37.738   28.095
LGA    F    83_A      F    83_A     3.919     0    0.044   0.490     5.872   45.238   33.680
LGA    N    84_A      N    84_A     3.608     0    0.062   0.118     6.237   52.143   38.810
LGA    A    85_A      A    85_A     2.452     0    0.069   0.068     3.284   66.905   63.524
LGA    F    86_A      F    86_A     1.308     0    0.090   0.441     2.154   79.286   78.398
LGA    L    87_A      L    87_A     2.230     0    0.044   1.394     4.411   64.881   62.440
LGA    R    88_A      R    88_A     1.867     0    0.070   1.442     3.317   66.905   70.303
LGA    E    89_A      E    89_A     2.557     0    0.038   0.067     3.746   55.833   56.614
LGA    L    90_A      L    90_A     3.475     0    0.062   0.384     5.066   46.905   42.262
LGA    G    91_A      G    91_A     2.572     0    0.073   0.073     3.005   59.167   59.167
LGA    P    92_A      P    92_A     2.170     0    0.105   0.225     2.980   68.810   64.898
LGA    E    93_A      E    93_A     2.549     0    0.039   0.203     6.448   59.286   42.593
LGA    A    94_A      A    94_A     2.802     0    0.066   0.066     3.307   60.952   58.762
LGA    V    95_A      V    95_A     1.877     0    0.145   0.177     3.325   75.000   66.395
LGA    E    96_A      E    96_A     1.493     0    0.052   1.155     5.400   73.095   55.238
LGA    L    97_A      L    97_A     3.127     0    0.040   1.379     7.698   53.690   41.071
LGA    V    98_A      V    98_A     2.813     0    0.048   0.053     3.039   59.048   57.211
LGA    S    99_A      S    99_A     2.152     0    0.102   0.661     2.191   64.762   67.540
LGA    T   100_A      T   100_A     2.657     0    0.067   0.139     3.181   59.048   58.299
LGA    F   101_A      F   101_A     2.837     0    0.075   1.236    10.130   57.143   30.866
LGA    T   102_A      T   102_A     2.561     0    0.057   1.251     4.697   57.143   54.558
LGA    Q   103_A      Q   103_A     2.839     0    0.044   1.623     6.415   57.143   45.450
LGA    Q   104_A      Q   104_A     2.401     0    0.085   1.370     4.974   62.857   53.280
LGA    F   105_A      F   105_A     2.362     0    0.055   0.551     3.818   64.762   59.567
LGA    V   106_A      V   106_A     2.081     0    0.036   0.045     2.558   70.952   67.211
LGA    D   107_A      D   107_A     1.698     0    0.073   0.183     2.673   75.000   70.952
LGA    V   108_A      V   108_A     1.684     0    0.035   1.233     3.560   79.405   72.449
LGA    I   109_A      I   109_A     0.766     0    0.095   1.190     4.216   85.952   71.964
LGA    R   110_A      R   110_A     1.274     0    0.095   1.865     6.983   75.476   58.788
LGA    G   111_A      G   111_A     2.585     0    0.183   0.183     4.317   56.071   56.071
LGA    D   112_A      D   112_A     2.123     0    0.056   0.332     3.848   72.976   63.393
LGA    P   113_A      P   113_A     3.458     0    0.687   0.882     7.471   38.214   28.776
LGA    Q   114_A      Q   114_A     8.921     0    0.154   1.064    13.415    4.167    1.905
LGA    A   115_A      A   115_A    10.334     0    0.103   0.097    10.580    0.476    0.381
LGA    V   116_A      V   116_A     6.424     0    0.107   0.102     9.574    8.095   19.048
LGA    A   117_A      A   117_A    11.035     0    0.080   0.076    14.541    0.714    0.571
LGA    E   118_A      E   118_A    15.103     0    0.061   1.036    20.366    0.000    0.000
LGA    H   119_A      H   119_A    13.249     0    0.217   0.403    14.809    0.000    0.000
LGA    L   120_A      L   120_A    13.981     0    0.236   1.070    17.503    0.000    0.000
LGA    N   121_A      N   121_A    18.899     0    0.544   0.719    21.892    0.000    0.000
LGA    I   122_A      I   122_A    20.511     0    0.164   1.226    21.368    0.000    0.000
LGA    S   123_A      S   123_A    24.653     0    0.054   0.101    26.064    0.000    0.000
LGA    L   124_A      L   124_A    25.486     0    0.097   1.281    30.940    0.000    0.000
LGA    E   125_A      E   125_A    25.108     0    0.069   0.433    27.733    0.000    0.000
LGA    D   126_A      D   126_A    19.663     0    0.042   0.557    21.656    0.000    0.000
LGA    V   127_A      V   127_A    20.278     0    0.083   0.084    21.774    0.000    0.000
LGA    A   128_A      A   128_A    22.815     0    0.106   0.098    24.831    0.000    0.000
LGA    R   129_A      R   129_A    18.124     0    0.085   0.980    23.210    0.000    0.000
LGA    L   130_A      L   130_A    13.885     0    0.105   1.172    15.735    0.000    0.000
LGA    A   131_A      A   131_A    18.006     0    0.062   0.056    20.298    0.000    0.000
LGA    E   132_A      E   132_A    19.023     0    0.042   1.045    23.357    0.000    0.000
LGA    A   133_A      A   133_A    13.021     0    0.076   0.072    15.074    0.000    0.000
LGA    G   134_A      G   134_A    13.245     0    0.042   0.042    15.710    0.000    0.000
LGA    E   135_A      E   135_A    19.714     0    0.031   1.299    27.601    0.000    0.000
LGA    A   136_A      A   136_A    19.051     0    0.065   0.064    19.562    0.000    0.000
LGA    A   137_A      A   137_A    15.458     0    0.056   0.055    18.179    0.000    0.000
LGA    I   138_A      I   138_A    19.269     0    0.142   1.215    22.737    0.000    0.000
LGA    E   139_A      E   139_A    24.740     0    0.044   1.032    30.270    0.000    0.000
LGA    R   140_A      R   140_A    23.658     0    0.138   0.970    24.912    0.000    0.000
LGA    G   141_A      G   141_A    23.381     0    0.463   0.463    23.381    0.000    0.000
LGA    E   142_A      E   142_A    22.159     0    0.183   0.230    27.154    0.000    0.000
LGA    G   143_A      G   143_A    19.497     0    0.602   0.602    20.791    0.000    0.000
LGA    A   144_A      A   144_A    15.054     0    0.089   0.084    16.703    0.000    0.000
LGA    S   145_A      S   145_A    12.938     0    0.045   0.062    13.925    0.000    0.000
LGA    L   146_A      L   146_A    15.377     0    0.036   1.070    21.023    0.000    0.000
LGA    G   147_A      G   147_A    14.091     0    0.055   0.055    14.568    0.000    0.000
LGA    V   148_A      V   148_A    11.219     0    0.040   0.100    12.168    0.000    0.000
LGA    H   149_A      H   149_A    13.443     0    0.055   1.118    16.434    0.000    0.000
LGA    R   150_A      R   150_A    16.390     0    0.038   1.505    19.981    0.000    0.000
LGA    E   151_A      E   151_A    14.460     0    0.029   0.846    15.977    0.000    0.000
LGA    L   152_A      L   152_A    15.401     0    0.060   0.246    18.200    0.000    0.000
LGA    R   153_A      R   153_A    19.742     0    0.015   1.373    27.324    0.000    0.000
LGA    R   154_A      R   154_A    20.216     0    0.021   1.019    21.556    0.000    0.000
LGA    I   155_A      I   155_A    19.397     0    0.035   0.071    22.179    0.000    0.000
LGA    E   156_A      E   156_A    22.847     0    0.020   1.067    25.916    0.000    0.000
LGA    A   157_A      A   157_A    25.946     0    0.043   0.052    28.214    0.000    0.000
LGA    R   158_A      R   158_A    25.227     0    0.124   0.806    26.921    0.000    0.000
LGA    R   159_A      R   159_A    26.899     0    0.035   1.197    29.889    0.000    0.000
LGA    N   160_A      N   160_A    29.267     0    0.127   0.419    32.367    0.000    0.000
LGA    S   161_A      S   161_A    31.663     0    0.061   0.565    31.663    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      151     604    604  100.00    1194   1194  100.00               151
SUMMARY(RMSD_GDC):    12.413         12.365                 13.018           19.711   17.259

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  164  151    4.0     44    2.79    25.993    23.733     1.522

LGA_LOCAL      RMSD:   2.791  Number of atoms:   44  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  14.574  Number of assigned atoms:  151 
Std_ASGN_ATOMS RMSD:  12.413  Standard rmsd on all 151 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.051528 * X  +  -0.867034 * Y  +   0.495578 * Z  +  29.038525
  Y_new =  -0.782053 * X  +   0.273579 * Y  +   0.559953 * Z  + -13.295833
  Z_new =  -0.621078 * X  +  -0.416421 * Y  +  -0.663970 * Z  +  10.642164 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -1.505004  0.670117 -2.581435   [DEG:  -86.2304   38.3949 -147.9053 ]
ZXZ:  2.417107  2.296912 -2.161435   [DEG:  138.4901  131.6033 -123.8411 ]
 
# END of job
