
#######################################################
#                                                     #
#                        LGA                          #
#                  ---------------                    #
#                                                     #
#               Local-Global Alignment                #
#        A Method for Finding 3-D Similarities        #
#               in Protein Structures                 #
#                                                     #
#                  ------------ 10/2009               #
#                                                     #
#      Adam Zemla (adamz@llnl.gov)                    #
#      Lawrence Livermore National Laboratory, CA     #
#                                                     #
#######################################################

!!!   License for LGA program has expired  !!!
#   For updated version of the LGA program   #
# please contact Adam Zemla:  adamz@llnl.gov #

# Molecule1: number of CA atoms  160 ( 1276),  selected  160 , name one
# Molecule2: number of CA atoms  222 ( 1756),  selected  160 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:A  -ch2:A  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   105      90_A - 194_A       4.94    14.02
  LCS_AVERAGE:     34.64

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    41     148_A - 188_A       2.00    14.41
  LONGEST_CONTINUOUS_SEGMENT:    41     149_A - 189_A       1.98    14.37
  LONGEST_CONTINUOUS_SEGMENT:    41     150_A - 190_A       1.99    14.25
  LCS_AVERAGE:      9.79

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    14     152_A - 165_A       0.95    14.69
  LONGEST_CONTINUOUS_SEGMENT:    14     158_A - 171_A       0.97    15.41
  LCS_AVERAGE:      3.76

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  160
LCS_GDT     RESIDUE       RESIDUE       SEGMENT_SIZE    GLOBAL DISTANCE TEST COLUMNS: number of residues under the threshold assigned to each residue pair
LCS_GDT   NAME NUMBER   NAME NUMBER    1.0  2.0  5.0    0.5  1.0  1.5  2.0  2.5  3.0  3.5  4.0  4.5  5.0  5.5  6.0  6.5  7.0  7.5  8.0  8.5  9.0  9.5 10.0
LCS_GDT     P    35_A     P    35_A      6   18   22      4   21   39   65   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     F    36_A     F    36_A      6   18   22      4   21   49   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     Y    37_A     Y    37_A      6   18   22     11   25   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     H    38_A     H    38_A      6   18   22     11   22   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     I    39_A     I    39_A      6   18   22     11   22   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     E    40_A     E    40_A      6   18   22      9   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     D    41_A     D    41_A      5   18   22      3    4   15   23   53   73   90   97  103  106  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     S    42_A     S    42_A     10   18   22      9   28   44   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     K    43_A     K    43_A     10   18   22      5   19   47   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     F    44_A     F    44_A     10   18   22     12   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     K    45_A     K    45_A     10   18   22     12   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     H    46_A     H    46_A     10   18   22     12   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     Y    47_A     Y    47_A     10   18   22     12   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     G    48_A     G    48_A     10   18   22     12   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     K    49_A     K    49_A     10   18   22     10   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     V    50_A     V    50_A     10   18   22      9   25   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     I    51_A     I    51_A     10   18   22     11   21   34   58   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     N    52_A     N    52_A      9   18   22     11   18   26   38   63   83   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     E    53_A     E    53_A      6   12   22      4    5   12   24   33   63   84   94  102  107  108  110  111  113  115  115  117  118  119  120 
LCS_GDT     Y    54_A     Y    54_A      4    6   22      4    4    4    5    7    8   11   15   53   58   64   79   93  103  108  109  112  114  116  117 
LCS_GDT     D    55_A     D    55_A      4    6   22      4    4    4    5    6   13   19   22   31   42   45   52   59   92   97  101  107  111  116  117 
LCS_GDT     F    56_A     F    56_A      4    5   22      3    3    4    5    6    9   12   19   31   42   45   52   59   88   97  103  107  111  116  117 
LCS_GDT     N    57_A     N    57_A      4    5   22      3    4    4    5    7   10   15   16   19   20   30   38   45   53   72   80   89   99  107  113 
LCS_GDT     E    58_A     E    58_A      3    8   22      3    4    4    5    7   11   15   16   22   22   30   38   41   53   59   64   79   91  100  106 
LCS_GDT     L    59_A     L    59_A      9    9   22      7    8    8    9    9   11   14   16   19   20   24   28   31   40   56   62   65   77   87   99 
LCS_GDT     E    60_A     E    60_A      9    9   22      7    8    8    9    9    9   11   15   16   21   27   30   36   40   48   55   60   66   76   92 
LCS_GDT     T    61_A     T    61_A      9    9   22      7    8    8    9    9   10   13   16   21   25   29   34   40   47   52   61   72   82   93  106 
LCS_GDT     Y    62_A     Y    62_A      9    9   22      7    8    8    9    9    9   14   16   19   22   28   34   37   45   51   62   66   80   90  104 
LCS_GDT     M    63_A     M    63_A      9    9   22      7    8    8    9    9    9   12   13   16   20   23   27   33   33   39   52   59   64   69   76 
LCS_GDT     D    64_A     D    64_A      9    9   22      7    8    8    9    9   12   16   17   18   21   27   30   36   39   47   54   59   65   69   77 
LCS_GDT     S    65_A     S    65_A      9    9   22      7    8    8    9    9   12   16   17   18   22   27   33   36   42   50   55   61   74   84   93 
LCS_GDT     L    66_A     L    66_A      9    9   22      3    8    8    9    9   12   16   16   18   22   27   30   36   39   47   54   59   64   69   76 
LCS_GDT     T    67_A     T    67_A      9    9   24      0    3    3    9    9    9   10   12   14   18   22   24   31   33   37   40   42   48   53   60 
LCS_GDT     I    68_A     I    68_A      5   11   25      3    5    6    8   10   11   13   15   17   21   21   23   26   27   29   33   40   44   47   51 
LCS_GDT     P    69_A     P    69_A      5   11   25      3    4    6    8   10   11   13   15   17   21   21   23   27   30   34   35   41   44   47   53 
LCS_GDT     Q    70_A     Q    70_A      5   11   25      3    5    6    8   10   11   13   15   17   21   21   22   22   24   29   33   40   44   46   51 
LCS_GDT     D    71_A     D    71_A      5   11   25      3    5    6    8   10   11   13   15   17   21   21   22   22   24   29   33   40   44   47   51 
LCS_GDT     Q    72_A     Q    72_A      5   11   25      5    5    6    8   10   11   13   15   17   21   21   22   22   24   25   26   29   31   42   44 
LCS_GDT     N    73_A     N    73_A      5   11   25      5    5    6    7   10   11   13   15   17   21   21   22   22   24   25   33   40   44   47   51 
LCS_GDT     V    74_A     V    74_A      5   11   25      5    5    6    8   10   11   13   15   17   21   21   22   22   24   29   33   39   44   47   51 
LCS_GDT     Y    75_A     Y    75_A      6   11   25      5    5    6    7    9   11   12   15   17   21   21   22   22   24   29   35   40   44   47   51 
LCS_GDT     V    76_A     V    76_A      6   11   25      5    5    6    8   10   11   13   15   17   21   21   22   22   24   25   28   36   41   46   55 
LCS_GDT     A    77_A     A    77_A      6   11   25      3    5    6    6   10   11   12   14   17   21   21   22   22   24   39   45   51   61   67   72 
LCS_GDT     S    78_A     S    78_A      6   11   25      1    5    6    7   10   11   13   15   17   28   31   34   47   52   56   59   65   87   90   97 
LCS_GDT     V    79_A     V    79_A      6    8   25      1    5    6    8   10   11   13   15   17   21   21   22   24   41   45   51   54   62   67   81 
LCS_GDT     T    80_A     T    80_A      6    8   25      0    4    6    8   10   11   13   15   17   21   21   22   24   26   28   31   34   62   66   74 
LCS_GDT     E    81_A     E    81_A      3    7   25      3    3    5    8   10   11   12   15   17   21   21   22   24   26   29   35   41   50   61   69 
LCS_GDT     M    82_A     M    82_A      3    5   25      3    4    4    4    5    7   10   15   17   21   21   22   25   36   51   64   84  111  113  119 
LCS_GDT     E    83_A     E    83_A      4    5   25      3    4    4    4    6    6    8   14   16   21   21   22   24   26   32   36   44   72   85  114 
LCS_GDT     N    84_A     N    84_A      4    6   25      3    4    4    6    7    8    9    9   16   21   21   22   22   24   25   27   32   37   80   84 
LCS_GDT     T    85_A     T    85_A      5    6   25      4    4    5    6    7    8    9    9   15   21   21   22   22   24   31   34   40   53   55   63 
LCS_GDT     I    86_A     I    86_A      5    6   25      4    4    5    6    7    8    9    9   15   21   21   22   22   25   28   31   34   38   46   63 
LCS_GDT     I    87_A     I    87_A      5    6   25      4    4    5    6    7    8    9    9   11   14   15   18   23   27   31   34   40   48   55   63 
LCS_GDT     K    88_A     K    88_A      5    6   25      4    5    5    7    7    7    9   11   21   22   24   25   32   35   41   43   46   53   78   83 
LCS_GDT     N    89_A     N    89_A      5    6   25      4    5    5    7    7   10   13   15   17   21   21   26   31   33   41   54   67   74   85   93 
LCS_GDT     Q    90_A     Q    90_A      4    5  105      4    5    5    7   10   12   14   16   21   22   25   32   36   53   57   66   73   92  104  112 
LCS_GDT     L    91_A     L    91_A      4    5  105      4    5    5    7    7    8    9   12   15   22   37   44   46   53   57   73   84  108  114  119 
LCS_GDT     Q    92_A     Q    92_A      3    6  105      3    3    3    5    7    8    9    9   11   19   25   44   46   53   80   88  105  118  119  119 
LCS_GDT     E    93_A     E    93_A      5    6  105      3    4    5    9   11   23   31   45   55   86   97  106  111  113  116  116  117  118  119  120 
LCS_GDT     A    94_A     A    94_A      5    6  105      4    4    6   11   16   19   26   48   55   92   99  108  111  113  116  116  117  118  119  120 
LCS_GDT     F    95_A     F    95_A      5    6  105      4    4    5    5    6    6    8   10   12   14   21   26   31   53   94  102  107  115  117  120 
LCS_GDT     Y    96_A     Y    96_A      5    6  105      4    4    5    7    7    7    9   12   16   22   39   60   81  104  110  116  117  118  119  120 
LCS_GDT     G    97_A     G    97_A      5   13  105      4   11   15   19   29   36   46   71   88   98  104  109  111  113  116  116  117  118  119  120 
LCS_GDT     E    98_A     E    98_A      5   13  105      3   11   15   21   29   36   46   71   85   96  104  109  111  113  116  116  117  118  119  120 
LCS_GDT     M    99_A     M    99_A      5   13  105      3   11   22   36   55   68   86   95  100  105  107  110  112  113  116  116  117  118  119  120 
LCS_GDT     S   100_A     S   100_A      8   13  105      3    9   43   64   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     I   101_A     I   101_A      8   13  105      8   24   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     Q   102_A     Q   102_A      9   13  105      8   28   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     I   103_A     I   103_A      9   13  105      9   28   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     G   104_A     G   104_A      9   13  105      9   28   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     Y   105_A     Y   105_A      9   13  105      7   20   39   65   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     C   106_A     C   106_A      9   13  105      7   21   39   65   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     N   107_A     N   107_A      9   13  105      7   25   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     G   108_A     G   108_A      9   13  105      9   25   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     P   109_A     P   109_A      9   13  105      7   21   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     N   110_A     N   110_A      9   13  105      7   27   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     S   111_A     S   111_A      4   13  105      3    4    8   21   34   57   75   91  101  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     T   112_A     T   112_A      5   13  105      7   10   18   38   63   78   92  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     L   113_A     L   113_A      5   13  105      7   10   18   35   55   77   87   95  102  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     N   114_A     N   114_A      5   13  105      3    4   21   38   75   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     G   115_A     G   115_A      6   13  105      3    5   20   29   45   74   90  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     L   116_A     L   116_A      6   21  105      3    5   17   40   59   79   92  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     E   117_A     E   117_A      6   23  105      3    5    8   24   36   63   84  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     Y   118_A     Y   118_A      6   23  105      3    6   36   59   76   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     H   119_A     H   119_A      6   23  105      3    5   18   39   72   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     K   120_A     K   120_A      8   23  105      4   18   42   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     S   121_A     S   121_A     13   23  105     12   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     S   122_A     S   122_A     13   23  105      9   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     E   123_A     E   123_A     13   23  105     11   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     I   124_A     I   124_A     13   23  105     11   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     N   125_A     N   125_A     13   23  105      9   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     I   126_A     I   126_A     13   23  105     12   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     A   127_A     A   127_A     13   23  105      8   21   43   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     I   128_A     I   128_A     13   23  105      7   22   27   56   75   84   93  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     T   129_A     T   129_A     13   23  105      7   28   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     D   130_A     D   130_A     13   23  105     11   28   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     M   131_A     M   131_A     13   23  105     12   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     V   132_A     V   132_A     13   23  105     11   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     L   133_A     L   133_A     13   23  105     12   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     L   134_A     L   134_A     11   23  105     11   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     L   135_A     L   135_A     11   23  105     11   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     G   136_A     G   136_A     11   23  105     11   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     K   137_A     K   137_A     11   23  105      5   22   47   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     V   138_A     V   138_A     11   23  105      7   14   40   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     Q   139_A     Q   139_A      4   23  105      3    4   19   53   75   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     E   140_A     E   140_A      4   23  105      4    4    7   22   41   71   89   98  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     V   141_A     V   141_A      4   20  105      3    4    5   17   30   52   79   91   99  104  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     E   142_A     E   142_A      3   20  105      3    3    5   10   40   72   88   98  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     N   143_A     N   143_A      4   20  105      3    3    5    8   11   34   59   68   93  100  106  110  112  113  115  116  116  118  119  120 
LCS_GDT     N   144_A     N   144_A      9   33  105      3   11   26   40   55   83   92   99  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     V   145_A     V   145_A     10   35  105      3    7   23   39   66   85   93  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     F   146_A     F   146_A     10   35  105      3   10   26   47   75   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     H   147_A     H   147_A     10   35  105      3   13   26   48   75   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     S   148_A     S   148_A     10   41  105      3   15   39   57   75   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     N   149_A     N   149_A     11   41  105      3   19   40   57   75   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     D   150_A     D   150_A     11   41  105      6   19   40   61   75   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     V   151_A     V   151_A     11   41  105      8   28   47   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     I   152_A     I   152_A     14   41  105     12   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     A   153_A     A   153_A     14   41  105     12   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     F   154_A     F   154_A     14   41  105     11   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     F   155_A     F   155_A     14   41  105     11   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     V   156_A     V   156_A     14   41  105     11   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     P   157_A     P   157_A     14   41  105      3   28   42   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     K   158_A     K   158_A     14   41  105      8   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     G   159_A     G   159_A     14   41  105      3   22   39   57   75   84   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     T   160_A     T   160_A     14   41  105      9   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     A   161_A     A   161_A     14   41  105      8   21   42   64   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     V   162_A     V   162_A     14   41  105     11   21   42   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     E   163_A     E   163_A     14   41  105     11   28   49   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     L   164_A     L   164_A     14   41  105     11   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     Y   165_A     Y   165_A     14   41  105     12   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     S   166_A     S   166_A     14   41  105     11   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     T   167_A     T   167_A     14   41  105      4    9   40   60   76   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     T   168_A     T   168_A     14   41  105     11   28   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     L   169_A     L   169_A     14   41  105      9   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     H   170_A     H   170_A     14   41  105      8   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     F   171_A     F   171_A     14   41  105      5   19   40   53   73   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     A   172_A     A   172_A      7   41  105      7   22   47   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     P   173_A     P   173_A      7   41  105      4   18   45   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     C   174_A     C   174_A      7   41  105      7   22   47   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     K   175_A     K   175_A      6   41  105      4   22   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     V   176_A     V   176_A      6   41  105      8   27   48   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     N   177_A     N   177_A      6   41  105      4   15   36   54   75   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     N   178_A     N   178_A      6   41  105      4   13   30   49   74   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     E   179_A     E   179_A      6   41  105      6   19   47   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     G   180_A     G   180_A     10   41  105      5   13   32   65   73   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     F   181_A     F   181_A     10   41  105      8   21   29   65   76   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     K   182_A     K   182_A     10   41  105      8   21   43   65   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     T   183_A     T   183_A     10   41  105      8   21   49   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     I   184_A     I   184_A     10   41  105      8   21   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     V   185_A     V   185_A     10   41  105      8   28   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     I   186_A     I   186_A     10   41  105     10   28   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     L   187_A     L   187_A     10   41  105      8   30   50   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     P   188_A     P   188_A     10   41  105      6   19   45   66   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     K   189_A     K   189_A     10   41  105      3   18   41   64   77   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     G   190_A     G   190_A      3   41  105      3    5   22   53   72   85   95  100  103  107  108  110  112  113  116  116  117  118  119  120 
LCS_GDT     T   191_A     T   191_A      3    5  105      3    3    5    7    7   19   34   58   92   99  106  110  112  113  116  116  117  118  119  120 
LCS_GDT     N   192_A     N   192_A      3    5  105      3    3    4    5    7   18   27   31   37   51   80  103  111  113  116  116  117  118  119  120 
LCS_GDT     D   193_A     D   193_A      3    5  105      3    3    3    4   15   24   30   51   62   90  104  109  112  113  116  116  117  118  119  120 
LCS_GDT     P   194_A     P   194_A      3    5  105      3    3    4    4    4    4   12   16   42   49   93   99  108  113  115  115  117  118  119  120 
LCS_AVERAGE  LCS_A:  16.06  (   3.76    9.79   34.64 )

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     30     50     66     77     85     95    100    103    107    108    110    112    113    116    116    117    118    119    120 
GDT PERCENT_AT   5.41  13.51  22.52  29.73  34.68  38.29  42.79  45.05  46.40  48.20  48.65  49.55  50.45  50.90  52.25  52.25  52.70  53.15  53.60  54.05
GDT RMS_LOCAL    0.31   0.67   1.04   1.28   1.47   1.78   1.99   2.16   2.31   2.48   2.55   2.68   2.87   2.91   3.40   3.32   3.45   3.54   3.60   3.74
GDT RMS_ALL_AT  14.39  14.56  14.09  14.19  14.20  14.40  14.38  14.37  14.46  14.43  14.46  14.50  14.50  14.49  14.35  14.47  14.34  14.33  14.37  14.35

# Checking swapping
#   possible swapping detected:  Y    37_A      Y    37_A
#   possible swapping detected:  E    40_A      E    40_A
#   possible swapping detected:  D    41_A      D    41_A
#   possible swapping detected:  D    55_A      D    55_A
#   possible swapping detected:  F    56_A      F    56_A
#   possible swapping detected:  E    58_A      E    58_A
#   possible swapping detected:  E    60_A      E    60_A
#   possible swapping detected:  D    64_A      D    64_A
#   possible swapping detected:  E    83_A      E    83_A
#   possible swapping detected:  F    95_A      F    95_A
#   possible swapping detected:  Y    96_A      Y    96_A
#   possible swapping detected:  Y   105_A      Y   105_A
#   possible swapping detected:  E   117_A      E   117_A
#   possible swapping detected:  E   140_A      E   140_A
#   possible swapping detected:  F   146_A      F   146_A
#   possible swapping detected:  F   154_A      F   154_A
#   possible swapping detected:  F   155_A      F   155_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    P    35_A      P    35_A     2.999     0    0.119   0.155     4.051   62.976   56.735
LGA    F    36_A      F    36_A     2.335     0    0.073   1.330     5.130   60.952   55.455
LGA    Y    37_A      Y    37_A     1.324     0    0.074   0.197     2.605   83.690   72.460
LGA    H    38_A      H    38_A     1.500     0    0.026   0.140     1.845   77.143   75.429
LGA    I    39_A      I    39_A     1.509     0    0.657   0.554     3.246   71.429   74.286
LGA    E    40_A      E    40_A     1.568     0    0.691   1.123     8.598   63.452   40.370
LGA    D    41_A      D    41_A     5.360     0    0.596   0.834    11.551   39.048   20.536
LGA    S    42_A      S    42_A     1.691     0    0.097   0.661     3.639   78.333   73.016
LGA    K    43_A      K    43_A     1.448     0    0.035   0.979     7.920   81.548   52.487
LGA    F    44_A      F    44_A     0.420     0    0.080   0.200     2.114   92.857   84.978
LGA    K    45_A      K    45_A     1.056     2    0.099   0.697     4.423   83.690   54.233
LGA    H    46_A      H    46_A     1.201     0    0.023   0.176     2.320   81.429   75.571
LGA    Y    47_A      Y    47_A     0.874     0    0.035   0.193     1.211   90.476   87.460
LGA    G    48_A      G    48_A     0.920     0    0.039   0.039     0.978   90.476   90.476
LGA    K    49_A      K    49_A     1.260     4    0.059   0.081     1.735   79.286   43.333
LGA    V    50_A      V    50_A     1.445     0    0.051   0.054     2.299   77.143   74.150
LGA    I    51_A      I    51_A     2.366     0    0.073   0.088     3.057   62.976   63.036
LGA    N    52_A      N    52_A     3.418     0    0.699   1.449     4.615   46.667   46.905
LGA    E    53_A      E    53_A     5.681     0    0.252   1.206     8.954   13.810   14.021
LGA    Y    54_A      Y    54_A    11.977     0    0.155   1.233    22.341    0.357    0.119
LGA    D    55_A      D    55_A    15.801     0    0.543   1.313    19.779    0.000    0.000
LGA    F    56_A      F    56_A    15.595     0    0.502   1.383    18.168    0.000    0.043
LGA    N    57_A      N    57_A    20.502     0    0.609   1.102    25.949    0.000    0.000
LGA    E    58_A      E    58_A    22.636     0    0.507   0.505    26.281    0.000    0.000
LGA    L    59_A      L    59_A    23.776     0    0.590   0.496    25.527    0.000    0.000
LGA    E    60_A      E    60_A    26.340     0    0.075   1.066    27.453    0.000    0.000
LGA    T    61_A      T    61_A    25.734     0    0.015   0.092    26.517    0.000    0.000
LGA    Y    62_A      Y    62_A    25.418     0    0.011   1.175    31.014    0.000    0.000
LGA    M    63_A      M    63_A    28.955     0    0.037   1.205    33.056    0.000    0.000
LGA    D    64_A      D    64_A    30.678     0    0.091   1.114    31.909    0.000    0.000
LGA    S    65_A      S    65_A    29.471     0    0.198   0.770    31.264    0.000    0.000
LGA    L    66_A      L    66_A    32.108     0    0.580   0.640    33.866    0.000    0.000
LGA    T    67_A      T    67_A    38.194     0    0.571   1.345    41.809    0.000    0.000
LGA    I    68_A      I    68_A    37.966     0    0.647   0.619    39.884    0.000    0.000
LGA    P    69_A      P    69_A    39.343     0    0.570   0.477    41.114    0.000    0.000
LGA    Q    70_A      Q    70_A    45.512     0    0.257   0.244    48.277    0.000    0.000
LGA    D    71_A      D    71_A    48.812     3    0.355   0.349    48.812    0.000    0.000
LGA    Q    72_A      Q    72_A    46.364     3    0.651   0.867    49.508    0.000    0.000
LGA    N    73_A      N    73_A    39.209     0    0.118   0.160    42.016    0.000    0.000
LGA    V    74_A      V    74_A    35.819     0    0.047   1.144    36.756    0.000    0.000
LGA    Y    75_A      Y    75_A    29.875     0    0.253   0.360    32.441    0.000    0.000
LGA    V    76_A      V    76_A    27.350     0    0.162   1.051    28.343    0.000    0.000
LGA    A    77_A      A    77_A    24.716     0    0.599   0.570    26.405    0.000    0.000
LGA    S    78_A      S    78_A    21.783     0    0.325   0.663    24.752    0.000    0.000
LGA    V    79_A      V    79_A    22.516     0    0.619   1.291    22.516    0.000    0.000
LGA    T    80_A      T    80_A    21.838     0    0.620   0.893    22.506    0.000    0.000
LGA    E    81_A      E    81_A    21.696     0    0.637   1.101    28.535    0.000    0.000
LGA    M    82_A      M    82_A    16.473     0    0.648   1.131    18.015    0.000    0.000
LGA    E    83_A      E    83_A    17.404     0    0.661   1.213    21.296    0.000    0.000
LGA    N    84_A      N    84_A    19.990     0    0.120   1.208    22.899    0.000    0.000
LGA    T    85_A      T    85_A    23.753     0    0.434   0.424    24.338    0.000    0.000
LGA    I    86_A      I    86_A    26.132     0    0.069   1.114    31.403    0.000    0.000
LGA    I    87_A      I    87_A    26.815     0    0.154   1.296    27.920    0.000    0.000
LGA    K    88_A      K    88_A    23.708     0    0.554   0.752    24.624    0.000    0.000
LGA    N    89_A      N    89_A    21.542     0    0.189   1.252    27.461    0.000    0.000
LGA    Q    90_A      Q    90_A    21.933     0    0.338   0.906    26.272    0.000    0.000
LGA    L    91_A      L    91_A    18.792     0    0.633   1.323    21.749    0.000    0.000
LGA    Q    92_A      Q    92_A    16.997     0    0.111   0.852    20.916    0.000    0.000
LGA    E    93_A      E    93_A    12.669     0    0.630   1.221    17.642    0.000    0.000
LGA    A    94_A      A    94_A    11.525     0    0.232   0.239    12.546    0.000    0.000
LGA    F    95_A      F    95_A    15.785     0    0.032   0.211    23.393    0.000    0.000
LGA    Y    96_A      Y    96_A    13.056     0    0.213   0.378    22.380    0.000    0.000
LGA    G    97_A      G    97_A     9.782     0    0.067   0.067    10.641    1.190    1.190
LGA    E    98_A      E    98_A    10.244     0    0.183   0.771    17.803    2.500    1.111
LGA    M    99_A      M    99_A     6.489     0    0.037   0.915     7.908   21.786   16.964
LGA    S   100_A      S   100_A     2.912     0    0.075   0.638     4.868   55.952   53.333
LGA    I   101_A      I   101_A     1.508     0    0.140   1.355     5.957   75.000   64.107
LGA    Q   102_A      Q   102_A     0.804     0    0.026   1.310     6.891   92.857   66.138
LGA    I   103_A      I   103_A     0.863     0    0.019   0.096     1.170   90.476   88.214
LGA    G   104_A      G   104_A     1.073     0    0.107   0.107     1.460   83.690   83.690
LGA    Y   105_A      Y   105_A     2.526     0    0.077   1.353    10.537   59.048   33.810
LGA    C   106_A      C   106_A     2.632     0    0.056   0.842     4.246   55.357   52.619
LGA    N   107_A      N   107_A     1.695     0    0.021   1.261     4.396   72.857   67.381
LGA    G   108_A      G   108_A     1.414     0    0.072   0.072     1.584   79.286   79.286
LGA    P   109_A      P   109_A     1.369     0    0.642   0.537     3.157   73.571   68.707
LGA    N   110_A      N   110_A     1.194     0    0.359   0.357     7.040   65.119   47.798
LGA    S   111_A      S   111_A     5.716     0    0.622   0.590     8.648   29.762   21.111
LGA    T   112_A      T   112_A     4.445     0    0.151   0.971     4.952   32.857   39.864
LGA    L   113_A      L   113_A     5.154     0    0.579   0.558     9.255   43.095   25.238
LGA    N   114_A      N   114_A     3.300     0    0.606   1.249     6.139   50.119   38.393
LGA    G   115_A      G   115_A     4.155     0    0.631   0.631     7.285   30.476   30.476
LGA    L   116_A      L   116_A     4.244     0    0.099   0.208     8.560   52.500   33.571
LGA    E   117_A      E   117_A     4.364     0    0.246   1.031    10.896   28.333   14.815
LGA    Y   118_A      Y   118_A     3.092     0    0.220   1.069    11.640   65.357   29.603
LGA    H   119_A      H   119_A     3.306     0    0.154   0.408    10.223   42.381   19.810
LGA    K   120_A      K   120_A     2.407     0    0.253   1.279     7.699   67.024   42.910
LGA    S   121_A      S   121_A     2.106     0    0.067   0.706     2.709   64.762   64.841
LGA    S   122_A      S   122_A     2.067     0    0.126   0.667     3.201   64.762   62.302
LGA    E   123_A      E   123_A     1.671     0    0.065   0.393     2.454   70.833   72.011
LGA    I   124_A      I   124_A     1.498     0    0.047   1.162     3.406   81.548   71.548
LGA    N   125_A      N   125_A     1.117     0    0.041   0.880     2.881   83.690   78.452
LGA    I   126_A      I   126_A     0.391     0    0.017   0.373     2.317   90.595   86.190
LGA    A   127_A      A   127_A     1.992     0    0.088   0.131     2.529   70.952   68.190
LGA    I   128_A      I   128_A     3.625     0    0.349   1.621     7.316   46.667   30.536
LGA    T   129_A      T   129_A     2.292     0    0.062   0.074     3.369   69.048   62.925
LGA    D   130_A      D   130_A     1.419     0    0.116   1.204     2.960   77.143   77.440
LGA    M   131_A      M   131_A     1.103     0    0.024   0.575     2.281   85.952   83.869
LGA    V   132_A      V   132_A     0.632     0    0.068   0.124     1.219   88.214   87.891
LGA    L   133_A      L   133_A     1.089     0    0.019   0.056     2.502   88.214   78.571
LGA    L   134_A      L   134_A     0.682     0    0.036   0.052     0.911   90.476   90.476
LGA    L   135_A      L   135_A     0.343     0    0.043   0.835     1.855   95.238   89.643
LGA    G   136_A      G   136_A     0.810     0    0.110   0.110     0.810   90.476   90.476
LGA    K   137_A      K   137_A     1.387     0    0.087   1.156     6.555   81.429   62.540
LGA    V   138_A      V   138_A     1.794     0    0.071   0.896     3.987   72.857   67.619
LGA    Q   139_A      Q   139_A     2.871     0    0.141   1.104     4.437   50.595   48.201
LGA    E   140_A      E   140_A     5.990     0    0.301   0.998     9.354   21.429   14.180
LGA    V   141_A      V   141_A     7.353     0    0.470   0.567     9.920   16.429    9.932
LGA    E   142_A      E   142_A     5.463     4    0.657   0.616     6.382   19.405   11.534
LGA    N   143_A      N   143_A     8.425     0    0.176   0.811    10.409    7.976    4.167
LGA    N   144_A      N   144_A     5.249     0    0.251   0.261     7.743   26.548   21.667
LGA    V   145_A      V   145_A     4.163     0    0.055   0.088     4.632   40.476   40.000
LGA    F   146_A      F   146_A     3.141     0    0.029   0.162     3.515   48.333   58.225
LGA    H   147_A      H   147_A     3.884     0    0.032   1.061     6.597   50.119   35.952
LGA    S   148_A      S   148_A     3.107     0    0.068   0.082     3.880   55.476   51.429
LGA    N   149_A      N   149_A     3.123     0    0.022   1.207     3.751   53.571   55.536
LGA    D   150_A      D   150_A     2.483     0    0.024   0.789     5.861   66.905   50.476
LGA    V   151_A      V   151_A     1.282     0    0.033   0.969     3.427   81.548   75.782
LGA    I   152_A      I   152_A     0.461     0    0.047   0.597     1.513   95.238   90.655
LGA    A   153_A      A   153_A     0.572     0    0.031   0.036     0.871   92.857   92.381
LGA    F   154_A      F   154_A     1.006     0    0.109   0.219     1.365   83.690   84.719
LGA    F   155_A      F   155_A     0.699     0    0.021   0.199     1.504   85.952   85.584
LGA    V   156_A      V   156_A     1.444     0    0.183   1.087     3.466   73.214   69.796
LGA    P   157_A      P   157_A     2.424     0    0.635   0.593     4.494   57.976   64.422
LGA    K   158_A      K   158_A     1.996     1    0.640   0.494     2.951   77.381   61.481
LGA    G   159_A      G   159_A     3.118     0    0.142   0.142     3.344   53.571   53.571
LGA    T   160_A      T   160_A     1.634     0    0.049   0.137     2.298   68.810   70.612
LGA    A   161_A      A   161_A     2.157     0    0.160   0.237     2.448   66.786   66.381
LGA    V   162_A      V   162_A     1.982     0    0.026   0.053     2.121   72.857   70.544
LGA    E   163_A      E   163_A     1.835     0    0.077   0.862     3.898   77.143   65.397
LGA    L   164_A      L   164_A     1.255     0    0.030   0.070     1.918   83.690   79.345
LGA    Y   165_A      Y   165_A     0.800     0    0.013   1.159     8.483   90.476   55.873
LGA    S   166_A      S   166_A     0.904     0    0.655   0.790     3.371   88.214   82.222
LGA    T   167_A      T   167_A     3.307     0    0.118   0.230     4.083   51.786   47.279
LGA    T   168_A      T   168_A     1.347     0    0.072   0.147     1.750   79.286   78.980
LGA    L   169_A      L   169_A     0.915     0    0.008   0.990     4.579   90.476   75.714
LGA    H   170_A      H   170_A     1.403     0    0.071   0.116     1.889   77.143   76.286
LGA    F   171_A      F   171_A     3.105     0    0.187   0.951     9.749   63.095   32.165
LGA    A   172_A      A   172_A     1.411     0    0.037   0.033     1.794   83.810   81.619
LGA    P   173_A      P   173_A     1.644     0    0.151   0.188     2.749   79.286   70.884
LGA    C   174_A      C   174_A     1.556     0    0.178   0.201     1.656   75.000   74.286
LGA    K   175_A      K   175_A     1.524     0    0.070   0.867     9.166   83.810   51.799
LGA    V   176_A      V   176_A     0.954     0    0.291   0.937     3.268   83.810   78.367
LGA    N   177_A      N   177_A     2.928     0    0.036   1.243     4.383   64.881   55.833
LGA    N   178_A      N   178_A     3.080     0    0.507   0.881     7.575   65.833   41.845
LGA    E   179_A      E   179_A     1.399     4    0.685   0.636     2.344   73.095   40.582
LGA    G   180_A      G   180_A     3.325     0    0.155   0.155     3.448   51.786   51.786
LGA    F   181_A      F   181_A     3.200     0    0.024   0.135     3.379   55.476   54.589
LGA    K   182_A      K   182_A     2.592     0    0.038   0.386     3.723   60.952   55.767
LGA    T   183_A      T   183_A     1.813     0    0.010   1.044     3.126   70.833   66.190
LGA    I   184_A      I   184_A     1.733     0    0.052   0.055     1.784   75.000   73.929
LGA    V   185_A      V   185_A     1.350     0    0.063   0.090     1.580   79.286   78.980
LGA    I   186_A      I   186_A     0.516     0    0.077   0.116     1.346   95.238   90.595
LGA    L   187_A      L   187_A     1.013     0    0.100   1.012     4.061   85.952   75.000
LGA    P   188_A      P   188_A     2.236     0    0.040   0.416     3.557   64.762   60.612
LGA    K   189_A      K   189_A     2.640     2    0.046   0.648     3.134   71.310   51.693
LGA    G   190_A      G   190_A     3.526     0    0.667   0.667     4.101   45.119   45.119
LGA    T   191_A      T   191_A     7.272     0    0.125   1.068    11.068    8.690    5.102
LGA    N   192_A      N   192_A     9.169     0    0.704   0.596    13.765    4.524    2.262
LGA    D   193_A      D   193_A     8.939     0    0.166   0.987    13.943    3.810    1.905
LGA    P   194_A      P   194_A     9.425     0    0.506   0.549    10.546    1.190    1.293

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      160     640    640  100.00    1253   1253  100.00               222
SUMMARY(RMSD_GDC):    11.647         11.575                 12.006           33.663   29.690

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  160  222    4.0    100    2.16    35.135    31.081     4.429

LGA_LOCAL      RMSD:   2.158  Number of atoms:  100  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  14.370  Number of assigned atoms:  160 
Std_ASGN_ATOMS RMSD:  11.647  Standard rmsd on all 160 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.726587 * X  +   0.576449 * Y  +  -0.373868 * Z  +  -4.449087
  Y_new =  -0.619431 * X  +   0.785024 * Y  +   0.006567 * Z  +  23.898794
  Z_new =   0.297281 * X  +   0.226814 * Y  +   0.927459 * Z  +  44.561024 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -0.705956 -0.301844  0.239847   [DEG:  -40.4483  -17.2944   13.7422 ]
ZXZ: -1.588360  0.383239  0.919052   [DEG:  -91.0063   21.9580   52.6578 ]
 
# END of job
