
#######################################################
#                                                     #
#                        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  152 ( 1195),  selected  152 , name one
# Molecule2: number of CA atoms  210 ( 1634),  selected  152 , 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:    74      99_A - 172_A       4.99    12.79
  LONGEST_CONTINUOUS_SEGMENT:    74     100_A - 173_A       4.93    12.86
  LCS_AVERAGE:     28.57

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    30     138_A - 167_A       2.00    12.53
  LCS_AVERAGE:      7.48

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    22     136_A - 157_A       0.99    12.27
  LCS_AVERAGE:      4.09

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  152
LCS_GDT     RESIDUE       RESIDUE       SEGMENT_SIZE    GLOBAL DISTANCE TEST COLUMNS: number of residues under the threshold assigned to each residue pair
LCS_GDT   NAME NUMBER   NAME NUMBER    1.0  2.0  5.0    0.5  1.0  1.5  2.0  2.5  3.0  3.5  4.0  4.5  5.0  5.5  6.0  6.5  7.0  7.5  8.0  8.5  9.0  9.5 10.0
LCS_GDT     T    23_A     T    23_A      9   10   14      4    7    8    9   10   14   17   20   25   26   29   32   36   41   47   51   61   67   69   86 
LCS_GDT     S    24_A     S    24_A      9   10   14      4    6    8    9   10   16   20   24   27   33   39   43   53   60   78   87   96  105  110  114 
LCS_GDT     T    25_A     T    25_A      9   10   14      5    6    8    9   11   18   21   28   36   45   57   66   77   88   95  100  106  109  114  116 
LCS_GDT     L    26_A     L    26_A      9   10   14      5    7    8    9   10   34   42   60   75   86   91   97  101  103  106  109  110  111  114  116 
LCS_GDT     E    27_A     E    27_A      9   10   14      5    7    8    9   10   44   65   78   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     A    28_A     A    28_A      9   10   14      5    7    8   13   25   35   38   58   74   82   89   93   96   99  103  106  110  111  112  114 
LCS_GDT     G    29_A     G    29_A      9   10   14      5    7    8    9   12   19   24   28   41   46   52   61   79   83   89   94   97  103  105  107 
LCS_GDT     H    30_A     H    30_A      9   10   14      3    7    8   10   10   12   15   17   23   29   34   37   42   46   54   57   71   82   86   91 
LCS_GDT     T    31_A     T    31_A      9   10   14      3    7    8    9   10   12   15   17   21   22   27   28   32   38   42   47   52   54   57   63 
LCS_GDT     F    32_A     F    32_A      5   10   15      3    5    6    7   10   11   12   17   19   19   25   28   31   34   39   40   45   46   47   60 
LCS_GDT     D    33_A     D    33_A      4    4   15      3    3    5    5    7   11   11   13   15   18   22   24   29   31   34   37   43   46   47   49 
LCS_GDT     N    34_A     N    34_A      4    4   15      0    3    5    7   10   11   11   12   14   17   22   24   29   31   33   37   38   41   46   49 
LCS_GDT     Q    35_A     Q    35_A      3    6   15      1    3    6    7    9   11   12   14   15   19   21   22   26   28   30   37   38   41   43   47 
LCS_GDT     F    36_A     F    36_A      3    6   15      0    3    4    7   10   11   11   12   15   19   22   24   29   31   33   37   40   44   47   49 
LCS_GDT     G    37_A     G    37_A      3    8   15      3    3    4    4    9   10   12   17   19   21   25   28   31   38   42   47   52   53   55   62 
LCS_GDT     G    38_A     G    38_A      5    8   15      3    4    5    7    9   11   15   17   22   30   30   30   32   38   50   55   57   59   68   77 
LCS_GDT     F    39_A     F    39_A      5    8   15      3    4    5    7    8   10   20   25   27   30   33   36   37   40   50   55   58   65   70   77 
LCS_GDT     T    40_A     T    40_A      5    8   15      3    4    5    7    8   20   23   27   32   41   45   51   58   72   83   85   90   98  100  103 
LCS_GDT     V    41_A     V    41_A      5    8   15      3    4    5    7    8   10   17   24   51   68   74   77   85   91   98  102  106  109  111  113 
LCS_GDT     Y    42_A     Y    42_A      5    8   15      3    4    5    7    8   37   65   75   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     T    43_A     T    43_A      4    8   15      3    4    5   10   23   34   39   60   66   82   91   96  101  103  106  109  110  111  114  116 
LCS_GDT     E    44_A     E    44_A      4    8   15      3    4    5    9   11   18   23   27   31   40   48   60   72   84   95   97  106  109  114  116 
LCS_GDT     F    45_A     F    45_A      4    8   15      3    4    5    6    7   14   18   21   27   29   34   39   44   52   64   81   88   97  101  109 
LCS_GDT     D    46_A     D    46_A      3    5   15      3    3    3    4    5    7    9   10   12   25   29   32   38   48   48   60   68   77   84   99 
LCS_GDT     G    47_A     G    47_A      4    5   15      3    4    5    7   10   12   15   17   19   26   27   32   34   41   47   56   59   63   77   84 
LCS_GDT     I    48_A     I    48_A      4    5   15      3    4    4    4    5   14   17   20   22   35   42   55   57   58   61   72   84   90   98   99 
LCS_GDT     Q    49_A     Q    49_A      4    5   14      3    4    4    4    5    7    9   16   18   21   23   26   31   50   51   61   65   67   68   77 
LCS_GDT     L    50_A     L    50_A      4    7   14      3    4    4    5    7    8    9   19   22   35   42   45   49   55   61   64   66   68   73   84 
LCS_GDT     G    51_A     G    51_A      5    7   14      3    3    5    6    7    8    9   19   22   35   42   45   49   57   60   64   66   70   74   84 
LCS_GDT     K    52_A     K    52_A      5    7   14      4    4    5    6    6    7    8    9   10   10   12   12   15   50   58   61   66   67   73   76 
LCS_GDT     L    53_A     L    53_A      5    7   14      4    4    5    6    7    8    9   16   22   30   48   55   57   58   69   72   79   90   98   99 
LCS_GDT     E    54_A     E    54_A      5    7   54      4    4    5    6    7    8   13   19   22   40   48   55   57   60   69   73   97  106  110  114 
LCS_GDT     T    55_A     T    55_A      5    7   68      4    4    5    6    6    8    9    9   20   24   37   46   71   77   86   99  106  109  114  116 
LCS_GDT     E    56_A     E    56_A      5    7   68      3    4    5    6    7    8    9    9   20   29   46   59   71   81   95  101  106  109  114  116 
LCS_GDT     N    57_A     N    57_A      3    6   68      3    3    3    5   16   21   22   29   36   46   57   66   75   87   95   99  104  109  113  116 
LCS_GDT     G    58_A     G    58_A      3    6   68      3    3    3   15   23   28   31   40   49   59   72   80   90   97  102  103  106  109  114  116 
LCS_GDT     G    59_A     G    59_A      4    6   68      3    3    5    8   12   20   22   33   49   65   76   86   92   99  102  103  106  109  114  116 
LCS_GDT     A    60_A     A    60_A      4    6   68      3    3    4    4    5    7   20   23   37   49   58   66   84   94  101  103  105  109  113  116 
LCS_GDT     G    61_A     G    61_A      4    6   68      3    3   11   17   24   46   55   67   78   86   91   97  101  103  106  109  110  111  114  116 
LCS_GDT     N    62_A     N    62_A      4    5   68      3    5   11   30   42   46   57   70   79   87   91   97  101  103  106  109  110  111  114  116 
LCS_GDT     T    63_A     T    63_A      3    5   68      3    3   11   22   29   45   51   64   75   86   91   97  101  103  106  109  110  111  114  116 
LCS_GDT     T    64_A     T    64_A      3    8   68      3    8   17   31   42   50   63   77   83   87   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     P    65_A     P    65_A      7   10   68      3    7   11   15   19   28   61   76   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     A    66_A     A    66_A      7   10   68      4    8   15   17   43   60   73   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     I    67_A     I    67_A      7   13   68      3    8   30   52   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     T    68_A     T    68_A      7   13   68      4   12   41   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     V    69_A     V    69_A      7   13   68      4   21   41   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     G    70_A     G    70_A      7   13   68      4    9   25   47   55   69   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     G    71_A     G    71_A      7   13   68      4   11   30   49   59   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     E    72_A     E    72_A      7   15   68      4   11   24   39   55   69   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     Q    73_A     Q    73_A      7   15   68      4   11   24   39   50   68   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     A    74_A     A    74_A      6   15   68      4    9   31   50   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     F    75_A     F    75_A      6   15   68     12   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     N    76_A     N    76_A      6   15   68      4    5   12   46   62   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     I    77_A     I    77_A      6   15   68      9   24   34   48   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     T    78_A     T    78_A      6   15   68      0    3    9   15   26   42   51   65   80   85   91   97  101  103  106  109  110  111  114  116 
LCS_GDT     D    79_A     D    79_A      6   15   68      3    4    6   10   22   37   44   54   62   78   88   96  101  103  106  109  110  111  114  116 
LCS_GDT     H    80_A     H    80_A      6   15   68      3    6   15   27   35   58   71   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     L    81_A     L    81_A      8   15   68      9   27   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     W    82_A     W    82_A      8   15   68      9   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     V    83_A     V    83_A      8   15   68      6   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     A    84_A     A    84_A      8   15   68      3   14   31   50   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     A    85_A     A    85_A      8   15   68      3   12   31   50   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     G    86_A     G    86_A      8   15   68      5    9   17   26   36   55   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     Y    87_A     Y    87_A      8   13   68      5    9   25   47   58   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     Q    88_A     Q    88_A      8   13   68      5   13   35   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     H    89_A     H    89_A      8   13   68      5   14   41   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     L    90_A     L    90_A      8   13   68      5   25   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     F    91_A     F    91_A      8   13   68      5   22   41   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     S    92_A     S    92_A      8   13   68      5    9   22   51   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     A    93_A     A    93_A      8   13   68      4    8   22   43   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     G    94_A     G    94_A      5   13   68      4   17   33   46   55   65   74   78   81   86   90   94   98  102  105  109  110  111  112  116 
LCS_GDT     E    95_A     E    95_A      5   13   68     12   29   39   54   63   70   74   79   83   88   92   96  101  103  106  109  110  111  114  116 
LCS_GDT     S    96_A     S    96_A      5   13   68      4    5    5   28   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     I    97_A     I    97_A      6   12   68      4    7   11   30   42   54   68   78   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     Q    98_A     Q    98_A      6   12   68      4    9   15   33   48   60   73   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     Y    99_A     Y    99_A      6   12   74      4    9   20   38   55   68   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     R   100_A     R   100_A      8   12   74      4   17   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     P   101_A     P   101_A      8   12   74      5   27   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     L   102_A     L   102_A      8   12   74      5   27   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     V   103_A     V   103_A      8   14   74      5   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     K   104_A     K   104_A      8   14   74      5   19   41   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     I   105_A     I   105_A      8   14   74      6   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     G   106_A     G   106_A      8   14   74      5   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     Y   107_A     Y   107_A      8   14   74     12   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     N   108_A     N   108_A      5   14   74      4    8   17   30   40   63   73   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     F   109_A     F   109_A      5   14   74      3    6   13   18   23   34   47   66   76   86   91   97  101  103  106  109  110  111  114  116 
LCS_GDT     D   110_A     D   110_A      5   14   74      3    5   10   16   21   29   36   46   69   79   88   96   98  101  104  109  110  111  114  116 
LCS_GDT     N   111_A     N   111_A      5   14   74      3    5   10   19   33   46   69   77   82   86   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     G   112_A     G   112_A      5   14   74      3    7   14   30   40   58   73   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     I   113_A     I   113_A      8   14   74      4   19   42   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     S   114_A     S   114_A      8   14   74     12   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     L   115_A     L   115_A      8   14   74     12   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     S   116_A     S   116_A      8   14   74      5   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     N   117_A     N   117_A      8   14   74      6   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     R   118_A     R   118_A      8   14   74      5   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     T   119_A     T   119_A      8   14   74      6   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     R   120_A     R   120_A      8   14   74      8   25   40   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     A   121_A     A   121_A      7   14   74      5   17   31   43   54   68   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     H   122_A     H   122_A      6   14   74      5    5   13   25   39   50   59   72   81   86   90   94   98  103  106  109  110  111  114  116 
LCS_GDT     I   123_A     I   123_A      6   14   74      5    5   13   22   38   47   59   66   81   86   90   94   98  102  106  109  110  111  114  116 
LCS_GDT     D   124_A     D   124_A      5   14   74      5    5    6   16   24   31   38   46   56   63   73   81   86   92   96   99  103  108  110  112 
LCS_GDT     A   125_A     A   125_A      6   14   74      5    5    6   10   18   29   34   46   56   63   68   77   83   89   94   99  103  107  110  112 
LCS_GDT     T   126_A     T   126_A      6   14   74      5    5    6    7   12   16   18   30   37   45   50   59   67   74   79   82   86   91   98  105 
LCS_GDT     D   127_A     D   127_A      6    9   74      4    5    6    7    8    9   13   17   22   29   39   45   53   60   66   72   77   85   89   93 
LCS_GDT     A   128_A     A   128_A      6    9   74      4    5    6    7    8   11   17   22   29   40   50   57   62   70   76   81   85   89   92   97 
LCS_GDT     D   129_A     D   129_A      6    9   74      4    5    6    7    8    9   13   15   22   25   35   44   54   63   67   79   85   89   90  102 
LCS_GDT     A   130_A     A   130_A      6    9   74      4    5    6    7    8   10   17   25   48   51   64   68   71   85   92   97  102  106  108  111 
LCS_GDT     K   131_A     K   131_A      3   28   74      3    5   14   30   43   56   67   78   81   86   90   94   98  102  106  109  110  111  114  116 
LCS_GDT     T   132_A     T   132_A      4   28   74      3    8   14   28   41   53   62   72   81   86   90   94   98  102  106  109  110  111  114  116 
LCS_GDT     D   133_A     D   133_A      4   28   74      3    7   18   26   43   56   71   78   81   86   90   94   98  103  106  109  110  111  114  116 
LCS_GDT     Y   134_A     Y   134_A      7   28   74      3   14   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     R   135_A     R   135_A      8   28   74      4   24   38   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     M   136_A     M   136_A     22   28   74      4   24   38   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     D   137_A     D   137_A     22   28   74      4   14   32   50   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     N   138_A     N   138_A     22   30   74     12   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     R   139_A     R   139_A     22   30   74     12   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     I   140_A     I   140_A     22   30   74     10   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     G   141_A     G   141_A     22   30   74     10   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     Y   142_A     Y   142_A     22   30   74     12   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     A   143_A     A   143_A     22   30   74      3   17   36   52   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     M   144_A     M   144_A     22   30   74      3   24   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     N   145_A     N   145_A     22   30   74     11   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     E   146_A     E   146_A     22   30   74      6   22   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     D   147_A     D   147_A     22   30   74      6   27   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     V   148_A     V   148_A     22   30   74      5   27   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     T   149_A     T   149_A     22   30   74      8   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     F   150_A     F   150_A     22   30   74     11   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     S   151_A     S   151_A     22   30   74     11   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     Y   152_A     Y   152_A     22   30   74     11   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     N   153_A     N   153_A     22   30   74     12   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     N   154_A     N   154_A     22   30   74     11   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     V   155_A     V   155_A     22   30   74     12   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     Y   156_A     Y   156_A     22   30   74     12   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     M   157_A     M   157_A     22   30   74     12   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     I   158_A     I   158_A      5   30   74      3    6   11   17   49   68   72   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     E   159_A     E   159_A      5   30   74      3    7   15   19   35   48   62   75   81   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     A   160_A     A   160_A      5   30   74      3    6   11   18   28   42   54   62   81   86   91   96  101  103  106  109  110  111  114  116 
LCS_GDT     E   161_A     E   161_A      9   30   74      3   13   33   48   62   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     T   162_A     T   162_A      9   30   74      3    3   10   26   29   45   62   73   81   85   90   94   98  102  106  109  110  111  114  116 
LCS_GDT     M   163_A     M   163_A      9   30   74      5   22   38   53   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     D   164_A     D   164_A      9   30   74     12   29   42   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     H   165_A     H   165_A      9   30   74     12   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     E   166_A     E   166_A      9   30   74      9   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     L   167_A     L   167_A      9   30   74      6   25   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     R   168_A     R   168_A      9   14   74      6   24   33   50   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     A   169_A     A   169_A      9   14   74      6   24   35   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     T   170_A     T   170_A      9   14   74      7   27   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     W   171_A     W   171_A      9   14   74      6   29   43   54   63   70   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     T   172_A     T   172_A      4   14   74      3    6   14   32   45   68   74   79   83   88   92   97  101  103  106  109  110  111  114  116 
LCS_GDT     R   173_A     R   173_A      4   14   74      3    4    9   18   45   56   70   78   82   86   90   94   98  102  105  109  110  111  112  114 
LCS_GDT     Q   174_A     Q   174_A      3   14   72      3    3   13   17   35   53   63   77   81   85   89   94   97  100  104  107  110  111  112  114 
LCS_AVERAGE  LCS_A:  13.38  (   4.09    7.48   28.57 )

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     29     43     54     63     70     74     79     83     88     92     97    101    103    106    109    110    111    114    116 
GDT PERCENT_AT   5.71  13.81  20.48  25.71  30.00  33.33  35.24  37.62  39.52  41.90  43.81  46.19  48.10  49.05  50.48  51.90  52.38  52.86  54.29  55.24
GDT RMS_LOCAL    0.25   0.70   1.06   1.26   1.46   1.65   1.80   2.11   2.21   2.49   2.77   3.23   3.42   3.53   3.73   3.88   3.96   4.05   4.75   4.89
GDT RMS_ALL_AT  12.35  12.35  12.14  12.18  12.13  12.14  12.14  12.12  12.11  12.10  12.07  12.05  12.06  12.05  12.02  12.02  12.03  12.02  12.09  12.09

# Checking swapping
#   possible swapping detected:  D    33_A      D    33_A
#   possible swapping detected:  D    46_A      D    46_A
#   possible swapping detected:  E    54_A      E    54_A
#   possible swapping detected:  F    91_A      F    91_A
#   possible swapping detected:  E    95_A      E    95_A
#   possible swapping detected:  Y    99_A      Y    99_A
#   possible swapping detected:  D   110_A      D   110_A
#   possible swapping detected:  D   129_A      D   129_A
#   possible swapping detected:  D   137_A      D   137_A
#   possible swapping detected:  E   146_A      E   146_A
#   possible swapping detected:  F   150_A      F   150_A
#   possible swapping detected:  Y   152_A      Y   152_A
#   possible swapping detected:  Y   156_A      Y   156_A
#   possible swapping detected:  E   159_A      E   159_A
#   possible swapping detected:  D   164_A      D   164_A
#   possible swapping detected:  E   166_A      E   166_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    T    23_A      T    23_A    27.333     0    0.486   1.329    29.497    0.000    0.000
LGA    S    24_A      S    24_A    19.880     0    0.118   0.579    22.544    0.000    0.000
LGA    T    25_A      T    25_A    14.939     0    0.118   1.014    16.391    0.000    0.000
LGA    L    26_A      L    26_A     8.362     0    0.010   1.025    10.920    4.405    3.214
LGA    E    27_A      E    27_A     4.944     0    0.047   1.102     5.226   30.119   30.899
LGA    A    28_A      A    28_A     8.399     0    0.057   0.053    11.696    4.524    3.905
LGA    G    29_A      G    29_A    14.097     0    0.212   0.212    16.442    0.000    0.000
LGA    H    30_A      H    30_A    21.270     0    0.089   0.269    22.967    0.000    0.000
LGA    T    31_A      T    31_A    25.779     0    0.610   0.937    30.035    0.000    0.000
LGA    F    32_A      F    32_A    32.768     0    0.156   1.037    36.778    0.000    0.000
LGA    D    33_A      D    33_A    37.086     0    0.659   1.166    38.946    0.000    0.000
LGA    N    34_A      N    34_A    39.973     0    0.686   0.656    40.868    0.000    0.000
LGA    Q    35_A      Q    35_A    39.241     0    0.604   1.124    43.879    0.000    0.000
LGA    F    36_A      F    36_A    34.409     0    0.633   1.482    37.835    0.000    0.000
LGA    G    37_A      G    37_A    28.135     0    0.593   0.593    30.176    0.000    0.000
LGA    G    38_A      G    38_A    24.587     0    0.621   0.621    26.092    0.000    0.000
LGA    F    39_A      F    39_A    22.931     0    0.183   1.441    24.557    0.000    0.000
LGA    T    40_A      T    40_A    15.497     0    0.171   0.898    18.327    0.000    0.000
LGA    V    41_A      V    41_A    10.631     0    0.044   0.099    13.872    6.071    3.537
LGA    Y    42_A      Y    42_A     5.643     0    0.150   1.138     9.769   10.833    8.651
LGA    T    43_A      T    43_A     8.580     0    0.115   1.156     9.985    5.476    5.238
LGA    E    44_A      E    44_A    14.332     0    0.661   0.686    20.047    0.000    0.000
LGA    F    45_A      F    45_A    19.491     0    0.538   0.825    21.426    0.000    0.000
LGA    D    46_A      D    46_A    20.445     0    0.105   0.546    22.340    0.000    0.000
LGA    G    47_A      G    47_A    23.504     0    0.270   0.270    23.504    0.000    0.000
LGA    I    48_A      I    48_A    20.361     0    0.150   0.212    21.703    0.000    0.000
LGA    Q    49_A      Q    49_A    24.064     0    0.591   1.377    29.682    0.000    0.000
LGA    L    50_A      L    50_A    21.954     0    0.643   1.402    23.662    0.000    0.000
LGA    G    51_A      G    51_A    23.180     0    0.224   0.224    23.180    0.000    0.000
LGA    K    52_A      K    52_A    22.428     0    0.146   0.917    24.153    0.000    0.000
LGA    L    53_A      L    53_A    19.021     0    0.016   1.324    20.409    0.000    0.000
LGA    E    54_A      E    54_A    16.908     0    0.119   0.889    17.331    0.000    0.000
LGA    T    55_A      T    55_A    16.987     0    0.691   0.559    19.493    0.000    0.000
LGA    E    56_A      E    56_A    17.459     0    0.151   1.139    18.232    0.000    0.000
LGA    N    57_A      N    57_A    20.731     0    0.210   1.330    25.483    0.000    0.000
LGA    G    58_A      G    58_A    17.198     0    0.636   0.636    18.236    0.000    0.000
LGA    G    59_A      G    59_A    15.140     0    0.340   0.340    16.390    0.000    0.000
LGA    A    60_A      A    60_A    15.243     0    0.236   0.228    16.335    0.000    0.000
LGA    G    61_A      G    61_A    10.388     0    0.169   0.169    11.652    0.000    0.000
LGA    N    62_A      N    62_A     9.812     0    0.240   1.068    10.055    1.071    2.321
LGA    T    63_A      T    63_A    10.412     0    0.077   0.119    13.512    1.071    0.612
LGA    T    64_A      T    64_A     7.524     0    0.639   1.104    10.601    7.024    4.626
LGA    P    65_A      P    65_A     5.969     0    0.654   0.568     6.274   30.357   33.265
LGA    A    66_A      A    66_A     4.088     0    0.093   0.100     4.906   40.476   38.667
LGA    I    67_A      I    67_A     2.072     0    0.073   1.307     4.768   66.905   58.869
LGA    T    68_A      T    68_A     1.586     0    0.096   1.048     4.429   77.143   71.565
LGA    V    69_A      V    69_A     1.506     0    0.058   1.090     2.798   70.952   69.592
LGA    G    70_A      G    70_A     3.417     0    0.080   0.080     3.417   53.571   53.571
LGA    G    71_A      G    71_A     2.969     0    0.036   0.036     3.771   50.119   50.119
LGA    E    72_A      E    72_A     3.861     0    0.077   0.768     4.832   43.333   39.259
LGA    Q    73_A      Q    73_A     4.434     0    0.236   0.925     4.750   37.262   41.640
LGA    A    74_A      A    74_A     2.598     0    0.090   0.139     3.229   69.286   65.429
LGA    F    75_A      F    75_A     1.463     0    0.086   1.135     2.746   81.429   76.450
LGA    N    76_A      N    76_A     3.159     0    0.223   0.361     7.138   49.048   35.060
LGA    I    77_A      I    77_A     2.481     0    0.575   1.026     3.254   61.071   64.940
LGA    T    78_A      T    78_A     6.447     0    0.561   0.685     9.330   15.833   10.476
LGA    D    79_A      D    79_A     8.633     0    0.631   1.320    14.197    6.786    3.393
LGA    H    80_A      H    80_A     4.785     0    0.129   0.382     7.358   38.214   27.048
LGA    L    81_A      L    81_A     1.175     0    0.234   0.805     2.539   79.881   75.417
LGA    W    82_A      W    82_A     0.426     0    0.034   1.331    10.586   95.238   46.905
LGA    V    83_A      V    83_A     0.862     0    0.105   1.047     3.272   85.952   79.524
LGA    A    84_A      A    84_A     2.587     0    0.160   0.201     2.892   61.071   60.286
LGA    A    85_A      A    85_A     2.731     0    0.145   0.203     3.953   51.905   50.190
LGA    G    86_A      G    86_A     4.353     0    0.183   0.183     4.353   48.571   48.571
LGA    Y    87_A      Y    87_A     2.996     0    0.017   1.386    11.572   50.238   27.460
LGA    Q    88_A      Q    88_A     2.166     0    0.121   0.817     2.871   70.833   70.265
LGA    H    89_A      H    89_A     1.664     0    0.025   1.396     8.205   75.119   43.952
LGA    L    90_A      L    90_A     0.618     0    0.088   1.428     3.601   83.810   74.702
LGA    F    91_A      F    91_A     1.236     0    0.046   1.106     3.818   83.690   70.823
LGA    S    92_A      S    92_A     2.351     0    0.134   0.178     4.176   61.190   55.317
LGA    A    93_A      A    93_A     2.780     0    0.316   0.299     2.804   57.143   57.143
LGA    G    94_A      G    94_A     5.494     0    0.371   0.371     5.494   31.548   31.548
LGA    E    95_A      E    95_A     2.948     0    0.180   1.243     6.108   55.595   40.899
LGA    S    96_A      S    96_A     2.493     0    0.151   0.620     3.655   64.762   59.921
LGA    I    97_A      I    97_A     5.962     0    0.584   0.970    10.021   22.500   12.798
LGA    Q    98_A      Q    98_A     4.486     0    0.089   1.291    10.009   47.857   27.831
LGA    Y    99_A      Y    99_A     3.526     0    0.081   1.157    10.380   43.452   20.754
LGA    R   100_A      R   100_A     1.390     0    0.324   1.008    11.001   88.333   46.537
LGA    P   101_A      P   101_A     0.887     0    0.018   0.058     1.487   90.476   86.599
LGA    L   102_A      L   102_A     1.137     0    0.054   0.810     3.729   79.286   70.476
LGA    V   103_A      V   103_A     1.134     0    0.118   1.147     3.285   81.429   75.714
LGA    K   104_A      K   104_A     1.630     0    0.082   0.730     4.004   70.833   61.217
LGA    I   105_A      I   105_A     1.123     0    0.015   1.088     2.740   81.429   73.274
LGA    G   106_A      G   106_A     1.377     0    0.120   0.120     1.377   83.690   83.690
LGA    Y   107_A      Y   107_A     0.259     0    0.172   1.248     9.401   86.429   50.000
LGA    N   108_A      N   108_A     4.341     0    0.046   0.427     6.699   35.476   30.000
LGA    F   109_A      F   109_A     7.743     0    0.609   1.436    11.033    6.429    6.883
LGA    D   110_A      D   110_A     9.818     0    0.253   0.690    12.868    1.905    0.952
LGA    N   111_A      N   111_A     6.636     0    0.664   1.340     7.564   12.976   17.262
LGA    G   112_A      G   112_A     4.742     0    0.340   0.340     4.992   39.048   39.048
LGA    I   113_A      I   113_A     1.215     0    0.080   1.153     4.049   79.524   70.238
LGA    S   114_A      S   114_A     0.603     0    0.236   0.593     2.506   88.214   85.000
LGA    L   115_A      L   115_A     0.316     0    0.095   1.354     4.170  100.000   81.488
LGA    S   116_A      S   116_A     1.151     0    0.155   0.569     1.579   88.214   84.524
LGA    N   117_A      N   117_A     1.102     0    0.039   0.620     3.260   85.952   74.524
LGA    R   118_A      R   118_A     1.358     0    0.094   1.400     6.175   81.429   53.680
LGA    T   119_A      T   119_A     1.430     0    0.057   0.099     1.942   81.429   77.755
LGA    R   120_A      R   120_A     2.196     0    0.024   1.321     3.376   61.190   63.636
LGA    A   121_A      A   121_A     4.127     0    0.038   0.034     5.125   36.190   35.238
LGA    H   122_A      H   122_A     6.581     0    0.377   0.420     8.839   11.190   14.857
LGA    I   123_A      I   123_A     7.863     0    0.072   0.163     9.445    5.000   12.619
LGA    D   124_A      D   124_A    12.828     0    0.082   1.013    18.791    0.000    0.000
LGA    A   125_A      A   125_A    13.596     0    0.106   0.120    16.320    0.000    0.000
LGA    T   126_A      T   126_A    19.065     0    0.074   1.024    20.172    0.000    0.000
LGA    D   127_A      D   127_A    22.276     0    0.031   1.102    26.932    0.000    0.000
LGA    A   128_A      A   128_A    19.995     0    0.608   0.548    20.687    0.000    0.000
LGA    D   129_A      D   129_A    18.190     0    0.429   1.083    21.798    0.000    0.000
LGA    A   130_A      A   130_A    13.244     0    0.657   0.604    15.339    0.119    0.095
LGA    K   131_A      K   131_A     6.918     0    0.574   1.154     9.419    7.976   32.063
LGA    T   132_A      T   132_A     7.449     0    0.627   1.038     9.923   12.619    8.367
LGA    D   133_A      D   133_A     5.683     0    0.124   0.698    10.094   34.643   19.524
LGA    Y   134_A      Y   134_A     1.298     0    0.580   1.380    10.791   73.214   37.698
LGA    R   135_A      R   135_A     2.244     0    0.128   0.594     2.862   66.786   64.113
LGA    M   136_A      M   136_A     2.110     0    0.013   0.614     2.640   64.881   66.845
LGA    D   137_A      D   137_A     2.646     0    0.155   0.871     3.200   64.881   63.036
LGA    N   138_A      N   138_A     0.901     0    0.168   0.254     2.683   90.595   81.905
LGA    R   139_A      R   139_A     0.514     0    0.045   0.966     5.090   95.238   75.974
LGA    I   140_A      I   140_A     0.529     0    0.013   1.216     2.921   92.857   81.071
LGA    G   141_A      G   141_A     1.143     0    0.077   0.077     1.143   88.214   88.214
LGA    Y   142_A      Y   142_A     0.463     0    0.179   0.421     2.674   95.238   80.556
LGA    A   143_A      A   143_A     2.047     0    0.330   0.397     2.767   72.976   69.810
LGA    M   144_A      M   144_A     1.259     0    0.083   1.121     4.960   83.690   73.333
LGA    N   145_A      N   145_A     0.697     0    0.052   0.173     2.173   95.238   84.107
LGA    E   146_A      E   146_A     1.061     0    0.154   0.730     4.763   81.548   60.265
LGA    D   147_A      D   147_A     1.992     0    0.065   0.090     2.475   68.810   67.798
LGA    V   148_A      V   148_A     2.009     0    0.034   1.114     4.953   72.976   63.605
LGA    T   149_A      T   149_A     1.113     0    0.121   1.141     3.249   81.429   75.850
LGA    F   150_A      F   150_A     1.433     0    0.034   1.327     5.181   83.690   67.532
LGA    S   151_A      S   151_A     1.038     0    0.060   0.215     1.715   79.286   78.571
LGA    Y   152_A      Y   152_A     0.691     0    0.019   0.191     2.670   95.238   79.802
LGA    N   153_A      N   153_A     0.477     0    0.096   0.835     2.467   95.238   85.298
LGA    N   154_A      N   154_A     0.766     0    0.021   1.086     3.790   88.214   76.845
LGA    V   155_A      V   155_A     1.150     0    0.083   0.184     1.755   81.548   80.272
LGA    Y   156_A      Y   156_A     1.577     0    0.029   0.123     2.230   75.000   73.690
LGA    M   157_A      M   157_A     1.646     0    0.207   1.242     4.454   70.833   70.595
LGA    I   158_A      I   158_A     4.393     0    0.020   0.496     7.464   36.786   25.714
LGA    E   159_A      E   159_A     6.579     0    0.111   1.293    11.787   16.667    8.730
LGA    A   160_A      A   160_A     6.072     0    0.502   0.454     6.631   21.548   19.905
LGA    E   161_A      E   161_A     3.513     0    0.389   0.937     4.502   37.262   47.037
LGA    T   162_A      T   162_A     5.888     0    0.691   0.607     7.744   19.762   14.762
LGA    M   163_A      M   163_A     2.848     0    0.064   1.112     3.675   53.690   54.524
LGA    D   164_A      D   164_A     1.803     0    0.048   0.723     3.826   75.119   68.274
LGA    H   165_A      H   165_A     1.001     0    0.119   0.210     1.931   83.690   81.524
LGA    E   166_A      E   166_A     0.530     0    0.077   0.624     1.814   92.857   86.561
LGA    L   167_A      L   167_A     1.483     0    0.016   0.835     4.415   79.405   65.119
LGA    R   168_A      R   168_A     2.444     0    0.026   0.789     3.644   64.762   55.498
LGA    A   169_A      A   169_A     2.318     0    0.090   0.111     2.953   62.857   61.714
LGA    T   170_A      T   170_A     1.775     0    0.051   0.121     2.092   75.000   74.150
LGA    W   171_A      W   171_A     1.904     0    0.168   0.238     4.586   65.000   55.408
LGA    T   172_A      T   172_A     4.497     0    0.456   1.338     7.599   30.476   23.401
LGA    R   173_A      R   173_A     6.483     0    0.041   0.927     7.901   19.286   14.675
LGA    Q   174_A      Q   174_A     8.402     0    0.146   1.244    16.158   10.833    4.815

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      152     608    608  100.00    1195   1195  100.00               210
SUMMARY(RMSD_GDC):    11.934         11.842                 12.301           30.318   26.764

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  152  210    4.0     79    2.11    32.262    27.571     3.574

LGA_LOCAL      RMSD:   2.111  Number of atoms:   79  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  12.120  Number of assigned atoms:  152 
Std_ASGN_ATOMS RMSD:  11.934  Standard rmsd on all 152 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.238417 * X  +  -0.928845 * Y  +   0.283555 * Z  +  -6.544890
  Y_new =  -0.163369 * X  +   0.326173 * Y  +   0.931086 * Z  +  -6.112139
  Z_new =  -0.957323 * X  +   0.175663 * Y  +  -0.229510 * Z  +  72.930611 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -2.540853  1.277594  2.488318   [DEG: -145.5802   73.2007  142.5701 ]
ZXZ:  2.845974  1.802370 -1.389321   [DEG:  163.0623  103.2682  -79.6022 ]
 
# END of job
