
#######################################################
#                                                     #
#                        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  194 ( 1593),  selected  192 , name one
# Molecule2: number of CA atoms  192 ( 1575),  selected  192 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:D  -ch2:D  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    63       1_D - 63_D        4.85    27.10
  LCS_AVERAGE:     22.91

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    22      31_D - 52_D        1.99    30.07
  LCS_AVERAGE:      6.40

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    17      31_D - 47_D        0.90    26.18
  LCS_AVERAGE:      3.43

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  192
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     M     1_D     M     1_D      3    5   63      0    3    3    4   12   14   18   26   30   38   43   50   56   56   57   59   60   60   60   61 
LCS_GDT     N     2_D     N     2_D      4   19   63      1    7   15   19   30   36   41   45   50   53   55   56   57   58   59   59   60   60   61   66 
LCS_GDT     S     3_D     S     3_D      4   19   63      1    4    8   17   24   31   41   45   50   53   55   56   57   58   59   59   60   60   62   66 
LCS_GDT     I     4_D     I     4_D     14   19   63     10   13   20   25   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     T     5_D     T     5_D     14   19   63     10   16   21   25   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     H     6_D     H     6_D     14   19   63     12   16   21   25   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     A     7_D     A     7_D     14   19   63     11   16   21   25   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     E     8_D     E     8_D     14   19   63     10   13   21   25   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     F     9_D     F     9_D     14   19   63     10   13   21   25   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     E    10_D     E    10_D     14   19   63     10   13   21   25   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     F    11_D     F    11_D     14   19   63     10   13   17   25   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     S    12_D     S    12_D     14   19   63     10   13   15   25   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     L    13_D     L    13_D     14   19   63     10   13   15   25   34   36   40   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     L    14_D     L    14_D     14   19   63      5   13   15   25   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     E    15_D     E    15_D     14   19   63      8   13   15   25   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     N    16_D     N    16_D     14   19   63      6   13   15   25   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     V    17_D     V    17_D     14   19   63      5    8   14   25   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     K    18_D     K    18_D      4   19   63      3    4    6   14   18   27   36   44   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     Y    19_D     Y    19_D      4   19   63      3    4    6   10   18   27   36   44   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     E    20_D     E    20_D      4   19   63      3    4    6    9   19   27   36   44   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     T    21_D     T    21_D      4   19   63      3    4    6    8   19   27   36   44   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     E    22_D     E    22_D      4   19   63      3    7   13   25   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     D    23_D     D    23_D      5   10   63      3    5    6   12   20   27   36   44   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     E    24_D     E    24_D      5   15   63      3    5    6   10   15   24   36   44   50   53   55   56   57   58   59   59   60   60   67   72 
LCS_GDT     V    25_D     V    25_D      5   15   63      3    5   13   24   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     P    26_D     P    26_D      5   15   63      3    5    6   11   24   31   41   43   50   53   55   56   57   58   59   59   60   60   67   72 
LCS_GDT     I    27_D     I    27_D      6   15   63      4    7   13   25   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     V    28_D     V    28_D      6   21   63      5    6   13   25   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     L    29_D     L    29_D      6   21   63      5    6   14   25   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     E    30_D     E    30_D      6   21   63      5    6   15   22   30   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     Y    31_D     Y    31_D     17   22   63      5   16   21   25   30   34   39   42   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     K    32_D     K    32_D     17   22   63     12   16   21   25   30   34   39   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     E    33_D     E    33_D     17   22   63     12   16   21   25   30   34   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     E    34_D     E    34_D     17   22   63     12   16   21   25   30   34   39   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     I    35_D     I    35_D     17   22   63     12   16   21   25   30   34   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     I    36_D     I    36_D     17   22   63     12   16   21   25   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     N    37_D     N    37_D     17   22   63     12   16   21   25   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     L    38_D     L    38_D     17   22   63     12   16   21   25   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     I    39_D     I    39_D     17   22   63     12   16   21   25   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     K    40_D     K    40_D     17   22   63     12   16   21   25   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     K    41_D     K    41_D     17   22   63      5   15   20   25   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     F    42_D     F    42_D     17   22   63      5   15   21   25   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     S    43_D     S    43_D     17   22   63      5   16   21   25   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     N    44_D     N    44_D     17   22   63     12   16   21   25   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     S    45_D     S    45_D     17   22   63     12   16   21   25   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     G    46_D     G    46_D     17   22   63      3    5    6   23   29   35   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     Q    47_D     Q    47_D     17   22   63      4   15   21   25   32   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     S    48_D     S    48_D      5   22   63      4    7   15   25   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     G    49_D     G    49_D      5   22   63      3    5    7   10   14   22   33   38   46   52   55   56   56   56   59   59   60   60   61   66 
LCS_GDT     M    50_D     M    50_D      3   22   63      1    6   13   20   34   36   41   45   50   53   55   56   57   58   59   59   60   60   62   66 
LCS_GDT     S    51_D     S    51_D      3   22   63      3    5   12   25   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     A    52_D     A    52_D     10   22   63      4    9   10   14   25   32   39   45   50   53   55   56   57   58   59   59   60   60   64   72 
LCS_GDT     P    53_D     P    53_D     10   19   63      4    9   12   20   34   36   41   45   50   53   55   56   57   58   59   59   60   60   61   70 
LCS_GDT     I    54_D     I    54_D     10   16   63      5    9   10   14   21   28   34   40   47   53   55   56   57   58   59   59   60   60   61   65 
LCS_GDT     T    55_D     T    55_D     10   15   63      5    9   10   12   15   18   23   32   41   49   55   56   57   58   59   59   60   60   67   72 
LCS_GDT     A    56_D     A    56_D     10   15   63      5    9   13   22   34   36   41   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     S    57_D     S    57_D     10   15   63      5    9   10   19   28   34   40   45   50   53   55   56   57   58   59   59   60   61   67   72 
LCS_GDT     I    58_D     I    58_D     10   15   63      4    9   10   12   15   17   20   25   31   34   41   49   57   58   59   59   60   60   62   72 
LCS_GDT     I    59_D     I    59_D     10   15   63      5    9   10   12   15   17   20   25   31   35   41   48   56   58   59   59   60   61   67   72 
LCS_GDT     T    60_D     T    60_D     10   15   63      5    9   10   12   15   24   32   38   41   43   48   54   57   58   59   59   60   61   67   72 
LCS_GDT     N    61_D     N    61_D     10   15   63      5    9   10   12   15   16   18   21   24   28   33   39   47   51   55   58   60   60   67   72 
LCS_GDT     C    62_D     C    62_D     10   15   63      5    9   10   12   15   16   18   21   24   26   28   30   32   35   40   43   48   52   58   63 
LCS_GDT     I    63_D     I    63_D     10   15   63      5    8   10   12   15   16   18   21   24   26   28   30   32   36   47   53   56   60   62   69 
LCS_GDT     K    64_D     K    64_D     10   15   35      5    9   10   12   15   16   18   20   23   28   36   38   46   48   50   53   56   60   66   72 
LCS_GDT     N    65_D     N    65_D     10   15   34      5    9   10   11   15   16   18   20   23   24   28   32   37   42   47   53   57   61   65   71 
LCS_GDT     L    66_D     L    66_D     10   15   33      5    9   10   11   15   16   18   19   23   26   30   33   39   45   47   53   61   67   73   79 
LCS_GDT     M    67_D     M    67_D     10   15   32      5    9   10   11   15   16   18   19   23   24   24   27   32   38   44   51   57   63   68   77 
LCS_GDT     A    68_D     A    68_D     10   15   32      5    9   10   11   15   16   18   24   27   31   38   41   47   53   62   70   78   85   94   97 
LCS_GDT     F    69_D     F    69_D      3   12   30      3    4    7    8   11   15   18   24   30   33   38   43   50   60   68   79   82   90   95   98 
LCS_GDT     K    70_D     K    70_D      3    7   27      3    3    5    7   11   15   18   24   30   33   38   43   51   62   73   80   82   90   95   98 
LCS_GDT     P    71_D     P    71_D      5    7   27      3    4    5    7   11   15   18   24   27   31   38   41   50   60   69   79   82   90   95   98 
LCS_GDT     I    72_D     I    72_D      5    7   27      3    4    5    7    7   12   15   20   25   27   32   38   43   51   59   65   72   81   87   95 
LCS_GDT     G    73_D     G    73_D      5    7   30      3    4    6    7   11   13   16   19   24   27   30   37   41   49   58   65   70   77   85   90 
LCS_GDT     P    74_D     P    74_D      5    7   30      3    5    7    7   11   13   16   19   24   27   31   38   45   50   59   65   77   82   90   95 
LCS_GDT     L    75_D     L    75_D      5    7   30      3    5    7    7   11   15   17   24   27   31   36   41   50   60   69   79   82   90   95   98 
LCS_GDT     V    76_D     V    76_D      4    7   30      3    5    7    7   11   15   18   24   27   31   35   39   46   52   60   68   80   84   90   95 
LCS_GDT     G    77_D     G    77_D      4    6   30      3    4    6    7   10   12   16   20   23   27   30   32   35   46   50   59   67   74   80   90 
LCS_GDT     N    78_D     N    78_D      4    6   30      3    4    6    7   10   12   15   19   23   27   30   32   34   38   40   50   57   67   70   78 
LCS_GDT     E    79_D     E    79_D      4    6   34      3    4    6    7   10   12   15   19   22   27   30   32   33   46   49   59   65   70   77   85 
LCS_GDT     E    80_D     E    80_D      4   12   37      3    3    5    8   12   14   18   22   27   31   36   41   48   56   66   73   82   90   95   98 
LCS_GDT     E    81_D     E    81_D      4   12   41      3    4    7   10   12   15   18   24   27   33   41   49   57   64   73   80   82   90   95   98 
LCS_GDT     W    82_D     W    82_D      4   12   41      0    3    4    7   11   14   16   21   26   32   41   47   57   64   73   80   82   90   95   98 
LCS_GDT     N    83_D     N    83_D      4   13   42      3    3    7   10   12   14   19   26   30   40   50   55   63   68   75   80   82   90   95   98 
LCS_GDT     Y    84_D     Y    84_D      4   13   42      3    4    7   10   12   14   17   24   27   36   44   54   60   68   75   80   82   90   95   98 
LCS_GDT     N    85_D     N    85_D      4   13   42      3    3    7   10   12   14   17   21   24   26   30   34   47   53   65   72   81   90   95   98 
LCS_GDT     S    86_D     S    86_D      4   13   42      3    3    7   10   12   15   21   24   27   34   43   48   55   66   75   80   82   90   95   98 
LCS_GDT     D    87_D     D    87_D      5   13   42      3    5    7   10   12   14   21   23   27   30   39   45   53   61   69   74   82   90   95   98 
LCS_GDT     D    88_D     D    88_D      5   13   42      3    5    9   11   15   19   23   29   37   43   52   55   63   68   75   80   82   90   95   98 
LCS_GDT     S    89_D     S    89_D      5   13   42      3    5    9   10   15   19   28   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     F    90_D     F    90_D      5   13   42      3    5    7   10   15   19   23   29   35   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     Q    91_D     Q    91_D      5   13   42      3    5    9   12   15   22   28   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     N    92_D     N    92_D      4   13   42      3    4    9   12   16   22   28   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     N    93_D     N    93_D      4   13   42      1    6    9   12   15   19   24   31   36   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     R    94_D     R    94_D      3   13   42      1    3    9   12   15   19   22   28   35   43   52   55   63   68   75   80   82   90   95   98 
LCS_GDT     L    95_D     L    95_D      3   13   42      2    4    9   12   16   22   29   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     S    96_D     S    96_D      3    7   42      2    3    4   13   19   23   30   34   40   42   50   57   63   68   75   78   82   90   94   98 
LCS_GDT     A    97_D     A    97_D      4    7   42      1    3    5   13   19   24   30   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     V    98_D     V    98_D      5    7   42      4    4    5    8   12   20   28   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     F    99_D     F    99_D      5    7   42      4    4    7   13   19   24   30   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     K   100_D     K   100_D      5    7   42      4    4    7   13   19   23   30   36   40   43   52   55   63   68   75   80   82   90   95   98 
LCS_GDT     T   101_D     T   101_D      5    7   42      4    4    7    9   17   24   30   36   40   43   52   55   60   67   75   78   82   90   94   98 
LCS_GDT     G   102_D     G   102_D      5    7   42      3    4    5    8   14   24   30   34   40   43   52   55   58   65   70   78   82   88   92   96 
LCS_GDT     L   103_D     L   103_D      4    9   42      3    4    8   12   16   22   30   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     N   104_D     N   104_D      4    9   42      3    4    5    8   14   23   30   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     G   105_D     G   105_D      7   12   42      3    6    9   12   16   24   30   36   40   43   52   55   60   67   75   78   82   90   95   98 
LCS_GDT     K   106_D     K   106_D      7   12   42      3    5    9   13   19   24   30   36   40   43   52   55   63   68   75   80   82   90   95   98 
LCS_GDT     P   107_D     P   107_D      7   12   42      3    6    9   13   19   24   30   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     Y   108_D     Y   108_D      7   12   42      3    6    9   12   19   24   30   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     Y   109_D     Y   109_D      7   12   42      3    6    9   13   19   24   30   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     L   110_D     L   110_D      7   12   42      3    6    9   12   16   24   30   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     D   111_D     D   111_D      7   12   42      3    4    9   12   19   24   30   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     A   112_D     A   112_D      3   12   42      3    5    7    7   15   24   30   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     I   113_D     I   113_D      4   12   42      3    5    8   12   19   24   30   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     T   114_D     T   114_D      4   12   42      3    5    9   13   19   24   30   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     F   115_D     F   115_D      4   12   42      3    5    8   13   19   24   30   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     V   116_D     V   116_D      4   12   42      3    5    6   12   17   24   30   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     G   117_D     G   117_D      4   10   42      3    4    7    9   14   23   30   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     E   118_D     E   118_D      4    8   42      3    4    5    6   12   14   23   33   38   42   52   55   62   65   72   78   82   90   95   98 
LCS_GDT     E   119_D     E   119_D      3    8   42      3    4    7    9   14   23   30   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     E   120_D     E   120_D      3    8   42      3    3    7    9   14   23   30   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     Y   121_D     Y   121_D      3    5   42      3    4    8   11   15   19   21   26   31   40   47   57   63   68   75   80   82   90   95   98 
LCS_GDT     D   122_D     D   122_D      3    6   42      3    4    5    8   13   19   21   24   30   36   43   51   59   68   75   80   82   90   95   98 
LCS_GDT     T   123_D     T   123_D      3    6   42      3    4    4    5   10   14   18   25   31   36   41   53   59   68   75   80   82   90   95   98 
LCS_GDT     F   124_D     F   124_D      3    6   42      1    3    6    7    9   11   17   20   27   36   44   53   59   68   75   80   82   90   95   98 
LCS_GDT     H   125_D     H   125_D      3    6   41      0    3    3    5    5    6    9   17   17   23   29   37   45   52   62   73   81   90   95   98 
LCS_GDT     G   126_D     G   126_D      3    6   36      1    3    4    5    7    7    9   17   21   27   32   38   46   55   64   70   77   83   88   96 
LCS_GDT     H   127_D     H   127_D      3    6   36      0    3    4    4    5    6    8   11   14   16   21   25   35   39   53   61   70   75   83   87 
LCS_GDT     V   128_D     V   128_D      3    5   36      1    3    4    7   11   14   16   21   29   33   41   53   57   63   68   72   80   85   92   96 
LCS_GDT     E   129_D     E   129_D      3    9   36      3    3    3    6    8   12   17   20   23   28   30   34   40   49   53   59   66   72   76   79 
LCS_GDT     G   130_D     G   130_D      3    9   36      3    3    6    9   11   15   17   20   23   28   32   39   46   51   55   64   69   74   78   83 
LCS_GDT     I   131_D     I   131_D      3    9   36      3    4    6    9   12   15   17   21   29   33   40   47   56   63   66   71   75   83   87   92 
LCS_GDT     S   132_D     S   132_D      3   12   36      3    3    5    9   12   15   17   21   29   33   41   47   55   63   67   72   80   85   92   98 
LCS_GDT     S   133_D     S   133_D      5   12   36      1    3    6    9   11   15   19   27   36   43   51   57   63   68   75   80   82   90   95   98 
LCS_GDT     R   134_D     R   134_D      5   12   36      2    4    6    9   12   15   19   27   31   40   49   57   63   68   75   80   82   90   95   98 
LCS_GDT     Q   135_D     Q   135_D      5   12   36      3    4    6    9   12   15   19   27   31   40   51   57   63   68   75   80   82   90   95   98 
LCS_GDT     Y   136_D     Y   136_D      5   12   36      3    4    6    9   12   15   19   27   31   40   51   57   63   68   75   80   82   90   95   98 
LCS_GDT     L   137_D     L   137_D      5   12   36      3    4    6    9   11   15   17   21   31   39   51   57   63   68   75   80   82   90   95   98 
LCS_GDT     K   138_D     K   138_D      4   12   36      3    4    6    9   12   15   19   27   31   42   51   57   63   68   75   80   82   90   95   98 
LCS_GDT     G   139_D     G   139_D      4   12   36      3    4    6    9   12   15   19   26   34   43   51   57   63   68   75   80   82   90   95   98 
LCS_GDT     F   140_D     F   140_D      4   12   36      3    4    6    9   12   15   18   27   31   42   51   57   63   68   75   80   82   90   95   98 
LCS_GDT     P   141_D     P   141_D      4   12   36      3    4    6    9   11   15   19   27   31   43   51   57   63   68   75   80   82   90   95   98 
LCS_GDT     F   142_D     F   142_D      4   12   36      3    4    6    9   11   15   26   33   38   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     F   143_D     F   143_D      4   12   36      2    4    6    9   12   16   28   32   36   43   51   57   63   68   75   80   82   90   95   98 
LCS_GDT     P   144_D     P   144_D      4   12   36      2    4    6    9   15   24   29   34   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     K   145_D     K   145_D      6   10   36      3    6    7    9   15   23   30   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     T   146_D     T   146_D      6   10   36      3    6    7    9   12   23   30   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     F   147_D     F   147_D      6   10   36      3    6    7   13   19   24   30   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     Y   148_D     Y   148_D      6   10   36      3    6    7   13   19   24   30   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     I   149_D     I   149_D      6   10   36      4    6    9   13   19   24   30   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     N   150_D     N   150_D      6   10   36      4    5    7    9   17   24   30   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     V   151_D     V   151_D      6   10   36      3    5    7   13   19   24   30   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     Y   152_D     Y   152_D      6   10   36      4    5    7   10   19   24   30   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     K   153_D     K   153_D      6   10   36      4    5    6   11   19   24   30   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     D   154_D     D   154_D      6    8   36      3    4    6    6    9   16   22   36   40   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     F   155_D     F   155_D      3    8   36      3    3    4    5   11   13   22   29   32   43   52   57   63   68   75   80   82   90   95   98 
LCS_GDT     E   156_D     E   156_D      3    8   36      3    3    4    5    7   13   18   26   32   41   52   55   60   68   75   80   82   90   95   98 
LCS_GDT     N   157_D     N   157_D      3    7   30      1    3    3    5    8    9   14   19   24   35   40   44   54   63   68   75   81   90   95   98 
LCS_GDT     K   158_D     K   158_D      3    6   30      3    3    4    5    7    9   10   14   18   20   24   28   41   45   56   63   75   81   87   95 
LCS_GDT     D   159_D     D   159_D      3    6   30      3    3    4    5    7   10   14   15   18   20   24   28   32   37   38   39   44   56   62   70 
LCS_GDT     E   160_D     E   160_D      3    6   30      3    3    4    5    7   10   14   15   17   21   24   28   32   37   38   39   43   52   57   66 
LCS_GDT     N   161_D     N   161_D      3    6   30      3    3    3    4    7   10   14   15   18   20   24   28   32   33   34   38   44   49   62   70 
LCS_GDT     N   162_D     N   162_D      4    7   30      3    4    4    5    7   10   14   15   18   20   24   28   32   33   35   39   45   65   71   77 
LCS_GDT     L   163_D     L   163_D      4    7   30      3    4    5    6   10   14   21   23   27   29   32   37   47   53   56   63   74   82   90   93 
LCS_GDT     C   164_D     C   164_D      4    7   30      3    4    5    6    8   11   17   24   27   30   35   41   51   55   62   72   81   90   95   98 
LCS_GDT     S   165_D     S   165_D      4    7   30      3    4    8   10   15   19   21   26   31   35   43   46   53   60   68   74   81   90   95   98 
LCS_GDT     G   166_D     G   166_D      4    7   30      3    6    8   11   13   15   19   24   30   34   41   46   53   60   68   74   80   85   92   97 
LCS_GDT     D   167_D     D   167_D      4    7   30      3    4    5   10   10   15   19   25   30   34   38   46   53   59   68   74   80   85   91   95 
LCS_GDT     D   168_D     D   168_D      4    8   30      3    4    4    8    9   19   22   26   35   42   47   50   58   67   75   80   82   90   95   98 
LCS_GDT     G   169_D     G   169_D      4    8   30      3    4    5    6    7   17   22   27   35   42   47   52   58   67   75   80   82   90   95   98 
LCS_GDT     E   170_D     E   170_D      4    8   30      3    4    6    6    8   10   21   27   35   42   51   55   60   67   75   80   82   90   95   98 
LCS_GDT     Y   171_D     Y   171_D      5    8   30      3    4    6    6    7   10   12   17   32   43   52   55   60   67   75   80   82   90   95   98 
LCS_GDT     T   172_D     T   172_D      5    8   30      3    4    6    6   10   17   22   27   35   43   52   55   60   68   75   80   82   90   95   98 
LCS_GDT     Y   173_D     Y   173_D      5    8   30      3    4    6    8   11   18   22   27   35   43   52   55   60   68   75   80   82   90   95   98 
LCS_GDT     R   174_D     R   174_D      5    8   30      3    4    6    8    9   11   22   27   35   43   52   55   60   68   75   80   82   90   95   98 
LCS_GDT     I   175_D     I   175_D      5    8   29      3    4    6    6    7   10   22   27   35   43   52   55   60   68   75   80   82   90   95   98 
LCS_GDT     K   176_D     K   176_D      4    8   24      3    4    4    6    7   10   12   17   22   33   37   45   53   60   68   74   81   90   95   98 
LCS_GDT     Y   177_D     Y   177_D      4    8   24      3    4    5    6    8   10   12   17   22   24   28   31   37   49   63   74   80   90   95   98 
LCS_GDT     P   178_D     P   178_D      3    7   24      3    3    5    5    7   10   12   17   22   27   37   46   53   60   68   74   81   90   95   98 
LCS_GDT     E   179_D     E   179_D      3    5   24      3    3    5    6    8   13   16   22   30   33   42   52   60   68   75   80   82   90   95   98 
LCS_GDT     Q   180_D     Q   180_D      3    5   24      3    3    7    8   14   17   27   29   38   43   50   57   63   68   75   80   82   90   95   98 
LCS_GDT     L   181_D     L   181_D      3    4   24      3    4    5    6   14   16   24   29   40   43   52   55   63   68   75   80   82   90   95   98 
LCS_GDT     E   182_D     E   182_D      3    4   24      3    6    7    9   19   23   27   30   36   43   50   57   63   68   75   80   82   90   95   98 
LCS_GDT     E   183_D     E   183_D      3    4   21      3    4    6    8   13   18   27   34   36   40   47   53   61   64   69   75   80   87   88   94 
LCS_GDT     V   184_D     V   184_D      3    4   21      3    4    6    9   14   23   28   34   36   43   51   57   63   68   73   80   82   90   95   98 
LCS_GDT     F   185_D     F   185_D      3    4   21      3    4    7    8   17   23   30   34   36   43   51   57   63   68   75   80   82   90   95   98 
LCS_GDT     N   186_D     N   186_D      3    4   21      3    4    7    8   14   18   25   31   33   37   47   53   57   63   68   70   76   81   84   87 
LCS_GDT     Y   187_D     Y   187_D      3    4   21      3    3    5    5    9   11   14   18   21   29   37   43   50   57   59   66   70   75   77   83 
LCS_GDT     Y   188_D     Y   188_D      3    5   21      3    3    5    7    9   12   19   23   30   36   47   53   57   63   69   72   80   84   91   96 
LCS_GDT     D   189_D     D   189_D      3    5   21      3    3    7    9   14   18   25   31   33   40   51   57   63   68   72   80   82   90   95   98 
LCS_GDT     K   190_D     K   190_D      3    5   21      3    3    5    8   12   17   23   25   30   38   51   57   63   68   72   80   82   90   95   98 
LCS_GDT     F   191_D     F   191_D      3    5   21      0    3    7    8   12   17   21   25   30   42   51   57   63   68   73   80   82   90   95   98 
LCS_GDT     T   192_D     T   192_D      3    5   21      0    3    4    8   12   17   21   25   31   42   51   57   63   68   72   80   82   90   95   98 
LCS_AVERAGE  LCS_A:  10.92  (   3.43    6.40   22.91 )

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     12     16     21     25     34     36     41     45     50     53     55     57     63     68     75     80     82     90     95     98 
GDT PERCENT_AT   6.25   8.33  10.94  13.02  17.71  18.75  21.35  23.44  26.04  27.60  28.65  29.69  32.81  35.42  39.06  41.67  42.71  46.88  49.48  51.04
GDT RMS_LOCAL    0.34   0.52   0.91   1.20   1.86   1.93   2.28   2.47   2.79   2.95   3.09   4.30   4.53   4.86   5.26   6.67   5.62   6.23   6.49   6.60
GDT RMS_ALL_AT  24.64  24.92  24.48  24.60  28.43  28.65  28.61  28.09  29.10  28.48  28.96  27.92  27.51  27.32  26.53  25.96  26.66  26.07  25.74  25.94

# Checking swapping
#   possible swapping detected:  E     8_D      E     8_D
#   possible swapping detected:  F     9_D      F     9_D
#   possible swapping detected:  F    11_D      F    11_D
#   possible swapping detected:  E    20_D      E    20_D
#   possible swapping detected:  E    22_D      E    22_D
#   possible swapping detected:  E    24_D      E    24_D
#   possible swapping detected:  Y    31_D      Y    31_D
#   possible swapping detected:  E    33_D      E    33_D
#   possible swapping detected:  F    42_D      F    42_D
#   possible swapping detected:  F    69_D      F    69_D
#   possible swapping detected:  E    79_D      E    79_D
#   possible swapping detected:  E    80_D      E    80_D
#   possible swapping detected:  D    87_D      D    87_D
#   possible swapping detected:  F    90_D      F    90_D
#   possible swapping detected:  Y   108_D      Y   108_D
#   possible swapping detected:  Y   121_D      Y   121_D
#   possible swapping detected:  D   122_D      D   122_D
#   possible swapping detected:  F   124_D      F   124_D
#   possible swapping detected:  E   129_D      E   129_D
#   possible swapping detected:  Y   136_D      Y   136_D
#   possible swapping detected:  F   142_D      F   142_D
#   possible swapping detected:  Y   148_D      Y   148_D
#   possible swapping detected:  Y   152_D      Y   152_D
#   possible swapping detected:  D   154_D      D   154_D
#   possible swapping detected:  E   156_D      E   156_D
#   possible swapping detected:  D   159_D      D   159_D
#   possible swapping detected:  D   167_D      D   167_D
#   possible swapping detected:  E   170_D      E   170_D
#   possible swapping detected:  Y   177_D      Y   177_D
#   possible swapping detected:  E   182_D      E   182_D
#   possible swapping detected:  Y   187_D      Y   187_D
#   possible swapping detected:  Y   188_D      Y   188_D
#   possible swapping detected:  D   189_D      D   189_D
#   possible swapping detected:  F   191_D      F   191_D

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    M     1_D      M     1_D     8.995     0    0.621   1.535    17.186   11.071    5.536
LGA    N     2_D      N     2_D     3.442     0    0.435   0.986     5.407   40.714   44.524
LGA    S     3_D      S     3_D     4.098     0    0.134   0.803     7.218   46.905   36.508
LGA    I     4_D      I     4_D     0.905     0    0.259   0.330     4.205   86.071   70.119
LGA    T     5_D      T     5_D     1.252     0    0.034   0.080     2.737   83.690   75.646
LGA    H     6_D      H     6_D     1.908     0    0.019   0.499     3.240   72.857   64.238
LGA    A     7_D      A     7_D     1.519     0    0.014   0.017     1.887   77.143   76.286
LGA    E     8_D      E     8_D     1.024     0    0.047   1.111     6.566   83.690   59.683
LGA    F     9_D      F     9_D     2.182     0    0.035   1.695     9.677   66.786   37.229
LGA    E    10_D      E    10_D     2.090     0    0.044   1.458     4.566   68.810   64.709
LGA    F    11_D      F    11_D     1.515     0    0.030   1.225     5.279   75.000   60.043
LGA    S    12_D      S    12_D     2.452     0    0.035   0.702     5.444   62.976   55.873
LGA    L    13_D      L    13_D     2.745     0    0.060   1.051     5.962   62.857   52.143
LGA    L    14_D      L    14_D     2.011     0    0.058   1.323     3.951   68.810   62.321
LGA    E    15_D      E    15_D     2.135     0    0.144   0.821     2.690   64.881   66.772
LGA    N    16_D      N    16_D     2.258     0    0.032   0.291     4.398   66.786   56.845
LGA    V    17_D      V    17_D     2.111     0    0.360   1.167     4.719   59.405   54.830
LGA    K    18_D      K    18_D     5.209     0    0.095   1.044    12.851   28.929   16.190
LGA    Y    19_D      Y    19_D     5.765     0    0.074   0.849    10.165   22.619   13.214
LGA    E    20_D      E    20_D     5.220     0    0.579   1.085     5.512   25.000   29.259
LGA    T    21_D      T    21_D     5.960     0    0.451   0.959     9.873   25.357   15.034
LGA    E    22_D      E    22_D     1.470     0    0.279   1.194     7.755   67.024   46.190
LGA    D    23_D      D    23_D     5.810     0    0.328   0.795    10.624   23.333   12.619
LGA    E    24_D      E    24_D     5.596     0    0.251   0.847    11.361   30.357   16.931
LGA    V    25_D      V    25_D     2.616     0    0.112   0.916     3.482   51.786   58.776
LGA    P    26_D      P    26_D     4.353     0    0.417   0.507     5.470   40.357   35.034
LGA    I    27_D      I    27_D     2.568     0    0.354   0.859     7.878   65.357   48.036
LGA    V    28_D      V    28_D     1.427     0    0.062   0.190     4.464   81.548   65.238
LGA    L    29_D      L    29_D     1.467     0    0.062   1.108     5.840   75.119   59.048
LGA    E    30_D      E    30_D     3.451     0    0.122   0.929     6.474   47.381   38.942
LGA    Y    31_D      Y    31_D     4.478     0    0.300   1.315    11.377   40.357   19.683
LGA    K    32_D      K    32_D     3.842     0    0.028   0.931     5.194   43.452   39.471
LGA    E    33_D      E    33_D     3.564     0    0.055   0.368     4.940   48.452   40.317
LGA    E    34_D      E    34_D     4.026     0    0.081   1.053     8.667   43.452   26.138
LGA    I    35_D      I    35_D     3.393     0    0.048   1.459     5.851   53.810   46.071
LGA    I    36_D      I    36_D     1.997     0    0.042   1.601     3.905   71.071   67.500
LGA    N    37_D      N    37_D     1.937     0    0.029   0.993     6.052   72.976   53.333
LGA    L    38_D      L    38_D     1.884     0    0.032   0.981     3.145   75.000   71.131
LGA    I    39_D      I    39_D     1.405     0    0.044   0.688     2.939   81.429   75.238
LGA    K    40_D      K    40_D     1.086     0    0.041   1.307     5.835   81.429   66.984
LGA    K    41_D      K    41_D     1.633     0    0.010   1.055     2.708   72.976   68.519
LGA    F    42_D      F    42_D     1.507     0    0.076   1.162     7.687   77.143   49.351
LGA    S    43_D      S    43_D     1.180     0    0.052   0.244     1.818   79.286   80.079
LGA    N    44_D      N    44_D     1.999     0    0.197   1.084     5.203   72.857   59.702
LGA    S    45_D      S    45_D     1.787     0    0.216   0.316     3.177   65.119   67.698
LGA    G    46_D      G    46_D     3.193     0    0.091   0.091     3.590   53.810   53.810
LGA    Q    47_D      Q    47_D     2.155     0    0.129   1.492     3.619   75.119   63.757
LGA    S    48_D      S    48_D     1.604     0    0.046   0.814     4.630   55.119   58.651
LGA    G    49_D      G    49_D     6.132     0    0.516   0.516     6.132   26.786   26.786
LGA    M    50_D      M    50_D     2.747     0    0.458   0.847     5.676   55.357   45.060
LGA    S    51_D      S    51_D     2.319     0    0.637   0.900     2.717   64.881   66.349
LGA    A    52_D      A    52_D     4.313     0    0.364   0.377     5.710   41.786   37.714
LGA    P    53_D      P    53_D     3.109     0    0.085   0.404     5.952   46.667   39.660
LGA    I    54_D      I    54_D     5.562     0    0.092   1.119    10.456   23.929   16.905
LGA    T    55_D      T    55_D     5.833     0    0.077   0.778     5.833   23.929   22.857
LGA    A    56_D      A    56_D     2.160     0    0.099   0.147     4.424   50.476   60.381
LGA    S    57_D      S    57_D     3.858     0    0.123   0.610     6.473   32.976   37.540
LGA    I    58_D      I    58_D     8.337     0    0.083   1.019    10.932    5.238    3.036
LGA    I    59_D      I    59_D     8.618     0    0.127   0.709    10.660    2.619    4.940
LGA    T    60_D      T    60_D     8.166     0    0.188   1.198    11.493    2.976    8.639
LGA    N    61_D      N    61_D    12.465     0    0.073   0.917    16.210    0.000    0.000
LGA    C    62_D      C    62_D    16.527     0    0.037   0.106    19.085    0.000    0.000
LGA    I    63_D      I    63_D    16.176     0    0.135   1.412    19.250    0.000    0.000
LGA    K    64_D      K    64_D    16.878     0    0.100   0.690    21.082    0.000    0.000
LGA    N    65_D      N    65_D    22.099     0    0.105   0.800    25.749    0.000    0.000
LGA    L    66_D      L    66_D    25.119     0    0.162   1.238    28.132    0.000    0.000
LGA    M    67_D      M    67_D    25.082     0    0.107   0.485    27.927    0.000    0.000
LGA    A    68_D      A    68_D    27.827     0    0.050   0.076    32.278    0.000    0.000
LGA    F    69_D      F    69_D    34.153     0    0.508   1.463    35.071    0.000    0.000
LGA    K    70_D      K    70_D    33.615     0    0.637   1.812    34.815    0.000    0.000
LGA    P    71_D      P    71_D    36.971     0    0.336   0.350    39.543    0.000    0.000
LGA    I    72_D      I    72_D    34.306     0    0.637   1.337    35.696    0.000    0.000
LGA    G    73_D      G    73_D    39.157     0    0.212   0.212    39.636    0.000    0.000
LGA    P    74_D      P    74_D    41.791     0    0.206   0.559    43.744    0.000    0.000
LGA    L    75_D      L    75_D    43.118     0    0.508   0.654    44.941    0.000    0.000
LGA    V    76_D      V    76_D    49.021     0    0.127   1.065    52.364    0.000    0.000
LGA    G    77_D      G    77_D    53.422     0    0.143   0.143    57.596    0.000    0.000
LGA    N    78_D      N    78_D    55.935     0    0.181   1.087    55.935    0.000    0.000
LGA    E    79_D      E    79_D    55.902     0    0.456   1.256    59.125    0.000    0.000
LGA    E    80_D      E    80_D    53.490     0    0.241   1.023    53.977    0.000    0.000
LGA    E    81_D      E    81_D    48.250     0    0.404   1.150    50.008    0.000    0.000
LGA    W    82_D      W    82_D    48.349     0    0.330   0.408    51.153    0.000    0.000
LGA    N    83_D      N    83_D    47.655     0    0.393   1.477    51.042    0.000    0.000
LGA    Y    84_D      Y    84_D    48.018     0    0.354   0.908    48.845    0.000    0.000
LGA    N    85_D      N    85_D    46.468     0    0.256   1.197    49.518    0.000    0.000
LGA    S    86_D      S    86_D    44.835     0    0.223   0.487    45.307    0.000    0.000
LGA    D    87_D      D    87_D    44.878     0    0.131   1.200    48.824    0.000    0.000
LGA    D    88_D      D    88_D    45.520     0    0.182   1.089    46.264    0.000    0.000
LGA    S    89_D      S    89_D    44.745     0    0.163   0.704    44.862    0.000    0.000
LGA    F    90_D      F    90_D    45.118     0    0.248   0.991    51.600    0.000    0.000
LGA    Q    91_D      Q    91_D    44.464     0    0.245   1.154    45.402    0.000    0.000
LGA    N    92_D      N    92_D    44.489     0    0.356   1.152    45.866    0.000    0.000
LGA    N    93_D      N    93_D    44.773     0    0.243   0.878    48.647    0.000    0.000
LGA    R    94_D      R    94_D    41.762     0    0.643   1.177    43.260    0.000    0.000
LGA    L    95_D      L    95_D    42.418     0    0.362   0.578    45.080    0.000    0.000
LGA    S    96_D      S    96_D    47.339     0    0.327   0.772    48.116    0.000    0.000
LGA    A    97_D      A    97_D    43.662     0    0.388   0.399    44.471    0.000    0.000
LGA    V    98_D      V    98_D    42.445     0    0.564   1.294    44.165    0.000    0.000
LGA    F    99_D      F    99_D    44.955     0    0.129   1.279    45.761    0.000    0.000
LGA    K   100_D      K   100_D    47.464     0    0.126   1.243    50.894    0.000    0.000
LGA    T   101_D      T   101_D    48.252     0    0.123   0.763    48.984    0.000    0.000
LGA    G   102_D      G   102_D    50.244     0    0.726   0.726    50.244    0.000    0.000
LGA    L   103_D      L   103_D    46.441     0    0.060   1.037    48.067    0.000    0.000
LGA    N   104_D      N   104_D    42.817     0    0.229   0.879    44.493    0.000    0.000
LGA    G   105_D      G   105_D    45.341     0    0.729   0.729    45.341    0.000    0.000
LGA    K   106_D      K   106_D    41.965     0    0.044   0.865    43.048    0.000    0.000
LGA    P   107_D      P   107_D    41.621     0    0.182   0.261    42.745    0.000    0.000
LGA    Y   108_D      Y   108_D    38.655     0    0.132   1.439    46.147    0.000    0.000
LGA    Y   109_D      Y   109_D    36.496     0    0.185   0.578    37.487    0.000    0.000
LGA    L   110_D      L   110_D    35.524     0    0.536   1.092    37.056    0.000    0.000
LGA    D   111_D      D   111_D    33.888     0    0.134   1.253    36.575    0.000    0.000
LGA    A   112_D      A   112_D    30.814     0    0.559   0.534    32.994    0.000    0.000
LGA    I   113_D      I   113_D    26.859     0    0.219   0.212    28.568    0.000    0.000
LGA    T   114_D      T   114_D    26.943     0    0.209   0.223    28.625    0.000    0.000
LGA    F   115_D      F   115_D    24.695     0    0.201   0.858    26.387    0.000    0.000
LGA    V   116_D      V   116_D    23.432     0    0.244   1.104    24.296    0.000    0.000
LGA    G   117_D      G   117_D    25.360     0    0.186   0.186    25.360    0.000    0.000
LGA    E   118_D      E   118_D    24.396     0    0.207   1.133    24.818    0.000    0.000
LGA    E   119_D      E   119_D    24.463     0    0.521   1.404    30.585    0.000    0.000
LGA    E   120_D      E   120_D    25.165     0    0.589   0.961    28.069    0.000    0.000
LGA    Y   121_D      Y   121_D    26.456     0    0.666   1.218    27.570    0.000    0.000
LGA    D   122_D      D   122_D    25.498     0    0.506   1.006    27.681    0.000    0.000
LGA    T   123_D      T   123_D    23.615     0    0.321   0.550    24.220    0.000    0.000
LGA    F   124_D      F   124_D    27.310     0    0.347   1.108    33.132    0.000    0.000
LGA    H   125_D      H   125_D    30.252     0    0.215   1.467    32.252    0.000    0.000
LGA    G   126_D      G   126_D    34.499     0    0.549   0.549    35.429    0.000    0.000
LGA    H   127_D      H   127_D    33.433     0    0.534   1.272    35.089    0.000    0.000
LGA    V   128_D      V   128_D    31.680     0    0.191   1.050    33.767    0.000    0.000
LGA    E   129_D      E   129_D    38.068     0    0.354   0.693    40.880    0.000    0.000
LGA    G   130_D      G   130_D    38.656     0    0.316   0.316    38.883    0.000    0.000
LGA    I   131_D      I   131_D    34.461     0    0.036   1.155    35.663    0.000    0.000
LGA    S   132_D      S   132_D    36.901     0    0.234   0.630    40.685    0.000    0.000
LGA    S   133_D      S   133_D    33.376     0    0.585   0.700    34.550    0.000    0.000
LGA    R   134_D      R   134_D    37.234     0    0.319   0.927    47.154    0.000    0.000
LGA    Q   135_D      Q   135_D    35.042     0    0.257   0.772    35.788    0.000    0.000
LGA    Y   136_D      Y   136_D    35.031     0    0.235   1.305    40.791    0.000    0.000
LGA    L   137_D      L   137_D    31.442     0    0.524   1.516    34.224    0.000    0.000
LGA    K   138_D      K   138_D    32.011     0    0.499   1.045    32.753    0.000    0.000
LGA    G   139_D      G   139_D    33.714     0    0.241   0.241    34.250    0.000    0.000
LGA    F   140_D      F   140_D    35.708     0    0.076   1.153    41.177    0.000    0.000
LGA    P   141_D      P   141_D    35.865     0    0.254   0.293    35.865    0.000    0.000
LGA    F   142_D      F   142_D    36.104     0    0.241   0.893    41.661    0.000    0.000
LGA    F   143_D      F   143_D    32.408     0    0.318   0.821    33.602    0.000    0.000
LGA    P   144_D      P   144_D    33.403     0    0.187   0.226    34.023    0.000    0.000
LGA    K   145_D      K   145_D    31.622     0    0.278   1.324    32.358    0.000    0.000
LGA    T   146_D      T   146_D    30.236     0    0.160   1.221    32.442    0.000    0.000
LGA    F   147_D      F   147_D    25.514     0    0.197   1.555    27.653    0.000    0.000
LGA    Y   148_D      Y   148_D    23.318     0    0.041   1.096    27.276    0.000    0.000
LGA    I   149_D      I   149_D    21.855     0    0.089   0.759    23.204    0.000    0.000
LGA    N   150_D      N   150_D    21.071     0    0.160   1.087    21.177    0.000    0.000
LGA    V   151_D      V   151_D    21.865     0    0.167   0.233    22.904    0.000    0.000
LGA    Y   152_D      Y   152_D    21.700     0    0.180   0.566    24.989    0.000    0.000
LGA    K   153_D      K   153_D    22.281     0    0.135   1.303    23.351    0.000    0.000
LGA    D   154_D      D   154_D    23.792     0    0.306   0.896    26.592    0.000    0.000
LGA    F   155_D      F   155_D    23.007     0    0.659   1.334    25.208    0.000    0.000
LGA    E   156_D      E   156_D    22.278     0    0.501   1.244    25.000    0.000    0.000
LGA    N   157_D      N   157_D    22.585     0    0.418   0.870    23.158    0.000    0.000
LGA    K   158_D      K   158_D    24.941     0    0.624   1.404    28.607    0.000    0.000
LGA    D   159_D      D   159_D    31.235     0    0.191   0.880    36.518    0.000    0.000
LGA    E   160_D      E   160_D    35.096     0    0.505   0.985    39.853    0.000    0.000
LGA    N   161_D      N   161_D    33.187     0    0.518   0.948    33.606    0.000    0.000
LGA    N   162_D      N   162_D    31.904     0    0.441   1.014    33.923    0.000    0.000
LGA    L   163_D      L   163_D    29.221     0    0.259   1.171    32.911    0.000    0.000
LGA    C   164_D      C   164_D    26.753     0    0.139   0.706    27.359    0.000    0.000
LGA    S   165_D      S   165_D    24.729     0    0.144   0.735    25.332    0.000    0.000
LGA    G   166_D      G   166_D    20.273     0    0.141   0.141    22.075    0.000    0.000
LGA    D   167_D      D   167_D    17.266     0    0.254   0.788    18.694    0.000    0.000
LGA    D   168_D      D   168_D    17.781     0    0.181   0.907    21.686    0.000    0.000
LGA    G   169_D      G   169_D    23.758     0    0.348   0.348    24.497    0.000    0.000
LGA    E   170_D      E   170_D    26.299     0    0.186   0.496    30.078    0.000    0.000
LGA    Y   171_D      Y   171_D    27.581     0    0.333   0.569    28.172    0.000    0.000
LGA    T   172_D      T   172_D    26.757     0    0.100   1.128    27.526    0.000    0.000
LGA    Y   173_D      Y   173_D    26.195     0    0.155   1.330    26.569    0.000    0.000
LGA    R   174_D      R   174_D    26.293     0    0.168   1.566    31.291    0.000    0.000
LGA    I   175_D      I   175_D    26.048     0    0.111   1.015    26.382    0.000    0.000
LGA    K   176_D      K   176_D    25.026     0    0.184   1.432    25.392    0.000    0.000
LGA    Y   177_D      Y   177_D    24.580     0    0.335   0.936    25.844    0.000    0.000
LGA    P   178_D      P   178_D    26.121     0    0.211   0.253    29.706    0.000    0.000
LGA    E   179_D      E   179_D    19.122     0    0.390   1.483    21.731    0.000    0.000
LGA    Q   180_D      Q   180_D    17.979     0    0.433   1.157    20.919    0.000    0.000
LGA    L   181_D      L   181_D    23.204     0    0.329   1.050    28.531    0.000    0.000
LGA    E   182_D      E   182_D    19.059     0    0.245   1.433    21.975    0.000    0.000
LGA    E   183_D      E   183_D    13.734     0    0.235   1.221    16.291    0.000    1.640
LGA    V   184_D      V   184_D    18.968     0    0.358   0.519    21.849    0.000    0.000
LGA    F   185_D      F   185_D    22.147     0    0.530   0.799    29.880    0.000    0.000
LGA    N   186_D      N   186_D    16.646     0    0.411   0.944    18.465    0.000    0.000
LGA    Y   187_D      Y   187_D    18.044     0    0.221   1.579    21.694    0.000    0.000
LGA    Y   188_D      Y   188_D    23.939     0    0.461   1.143    25.011    0.000    0.000
LGA    D   189_D      D   189_D    25.699     0    0.460   0.937    26.898    0.000    0.000
LGA    K   190_D      K   190_D    24.632     0    0.494   0.725    28.631    0.000    0.000
LGA    F   191_D      F   191_D    28.320     0    0.424   0.682    30.398    0.000    0.000
LGA    T   192_D      T   192_D    32.159     0    0.525   1.150    35.615    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      192     768    768  100.00    1575   1575  100.00               192
SUMMARY(RMSD_GDC):    16.133         16.026                 16.362           16.787   14.462

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  194  192    4.0     45    2.47    21.615    18.112     1.752

LGA_LOCAL      RMSD:   2.468  Number of atoms:   45  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  28.091  Number of assigned atoms:  192 
Std_ASGN_ATOMS RMSD:  16.133  Standard rmsd on all 192 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.617498 * X  +   0.781652 * Y  +   0.087846 * Z  + -12.034374
  Y_new =   0.007123 * X  +   0.106121 * Y  +  -0.994328 * Z  +  -2.046512
  Z_new =  -0.786541 * X  +   0.614621 * Y  +   0.059961 * Z  + -42.490063 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  0.011535  0.905187  1.473546   [DEG:    0.6609   51.8634   84.4280 ]
ZXZ:  0.088119  1.510799 -0.907486   [DEG:    5.0488   86.5624  -51.9951 ]
 
# END of job
