
#######################################################
#                                                     #
#                        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  141 ( 1066),  selected  139 , name one
# Molecule2: number of CA atoms  143 ( 1080),  selected  139 , 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:   124      19_A - 142_A       4.97    11.10
  LONGEST_CONTINUOUS_SEGMENT:   124      20_A - 143_A       4.90    11.06
  LONGEST_CONTINUOUS_SEGMENT:   124      21_A - 144_A       4.92    11.03
  LCS_AVERAGE:     80.87

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    80      29_A - 108_A       2.00    11.71
  LCS_AVERAGE:     37.85

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    40      32_A - 71_A        0.99    11.71
  LONGEST_CONTINUOUS_SEGMENT:    40      33_A - 72_A        0.94    11.72
  LCS_AVERAGE:     15.27

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  139
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    17_A     T    17_A      3    4   17      3    3    3    6    6    7    8   10   12   14   15   17   18   21   24   25   26   29   31   48 
LCS_GDT     D    18_A     D    18_A      3    4   92      3    4    4    6    6    6    8    9   10   12   18   19   20   22   29   35   36   50   54   60 
LCS_GDT     L    19_A     L    19_A      3    8  124      3    4    4    6    6    7    9   11   13   14   16   17   19   22   29   35   36   42   45   60 
LCS_GDT     A    20_A     A    20_A      5    9  124      4    4    6    7    9   10   11   12   13   14   18   19   42   53   63   87  100  104  111  115 
LCS_GDT     K    21_A     K    21_A      5    9  124      4    4    5    7    9   10   11   12   13   14   15   16   42   55   83   94  100  106  111  115 
LCS_GDT     L    22_A     L    22_A      5    9  124      4    5    6    7    9   10   11   12   13   14   15   16   17   19   56   70  100  106  111  118 
LCS_GDT     Q    23_A     Q    23_A      5    9  124      4    5    6    7    9   10   11   12   18   20   54   93  103  111  114  115  116  117  119  119 
LCS_GDT     T    24_A     T    24_A      5    9  124      4    5    6    7    9    9   11   18   93  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     Q    25_A     Q    25_A      5    9  124      4    5    6    7    9   10   11   16   19   31   63  106  110  111  114  115  116  117  119  119 
LCS_GDT     I    26_A     I    26_A      5    9  124      4    5    6    7    9   10   11   53   60  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     G    27_A     G    27_A      3   63  124      4    4   16   52   67   88   94   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     Y    28_A     Y    28_A      4   63  124      4    4    6   20   46   58   84   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     K    29_A     K    29_A      4   80  124      4    4    5   11   36   43   59   74   83  102  103  105  107  111  114  115  116  117  119  119 
LCS_GDT     F    30_A     F    30_A      4   80  124      3    4    6   24   50   70   93   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     N    31_A     N    31_A      5   80  124      3    5    5   19   50   58   84   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     N    32_A     N    32_A     40   80  124      3   14   38   68   87   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     I    33_A     I    33_A     40   80  124     25   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     N    34_A     N    34_A     40   80  124     25   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     L    35_A     L    35_A     40   80  124     25   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     L    36_A     L    36_A     40   80  124     25   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     R    37_A     R    37_A     40   80  124     25   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     R    38_A     R    38_A     40   80  124     25   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     A    39_A     A    39_A     40   80  124     25   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     M    40_A     M    40_A     40   80  124     15   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     T    41_A     T    41_A     40   80  124     23   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     H    42_A     H    42_A     40   80  124     23   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     A    43_A     A    43_A     40   80  124     14   40   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     S    44_A     S    44_A     40   80  124      6   39   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     F    45_A     F    45_A     40   80  124      5   37   72   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     S    46_A     S    46_A     40   80  124      6   44   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     Q    47_A     Q    47_A     40   80  124      5   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     E    48_A     E    48_A     40   80  124     12   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     N    49_A     N    49_A     40   80  124     14   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     N    50_A     N    50_A     40   80  124     25   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     K    51_A     K    51_A     40   80  124     25   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     A    52_A     A    52_A     40   80  124     25   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     L    53_A     L    53_A     40   80  124     25   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     S    54_A     S    54_A     40   80  124     25   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     I    55_A     I    55_A     40   80  124     25   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     F    56_A     F    56_A     40   80  124     25   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     G    57_A     G    57_A     40   80  124     25   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     T    58_A     T    58_A     40   80  124     25   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     H    59_A     H    59_A     40   80  124     25   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     I    60_A     I    60_A     40   80  124     25   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     I    61_A     I    61_A     40   80  124     11   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     E    62_A     E    62_A     40   80  124     13   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     T    63_A     T    63_A     40   80  124     25   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     A    64_A     A    64_A     40   80  124     11   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     V    65_A     V    65_A     40   80  124     11   46   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     S    66_A     S    66_A     40   80  124     13   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     L    67_A     L    67_A     40   80  124     15   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     Q    68_A     Q    68_A     40   80  124     10   49   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     F    69_A     F    69_A     40   80  124     10   45   70   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     L    70_A     L    70_A     40   80  124     13   46   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     A    71_A     A    71_A     40   80  124     12   46   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     K    72_A     K    72_A     40   80  124      4    9   40   78   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     D    73_A     D    73_A     29   80  124      4   17   40   79   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     I    74_A     I    74_A     29   80  124      5   25   53   79   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     D    75_A     D    75_A     27   80  124      5   30   53   81   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     I    76_A     I    76_A     24   80  124     14   39   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     S    77_A     S    77_A     23   80  124     12   40   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     S    78_A     S    78_A     23   80  124     14   40   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     K    79_A     K    79_A     23   80  124     14   40   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     A    80_A     A    80_A     23   80  124     12   40   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     L    81_A     L    81_A     23   80  124     12   40   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     G    82_A     G    82_A     23   80  124     12   40   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     R    83_A     R    83_A     22   80  124     12   40   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     L    84_A     L    84_A     17   80  124     12   39   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     I    85_A     I    85_A     17   80  124     12   37   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     S    86_A     S    86_A     17   80  124     12   40   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     E    87_A     E    87_A     17   80  124     12   40   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     V    88_A     V    88_A     17   80  124     11   40   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     S    89_A     S    89_A     17   80  124      4   13   44   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     N    90_A     N    90_A      3   80  124      4    4   17   31   61   70   92   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     V    91_A     V    91_A      4   80  124      4    4    4    8   15   43   92   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     E    92_A     E    92_A      5   80  124      4    4   15   31   61   83   93   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     S    93_A     S    93_A     16   80  124      4   37   59   78   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     S    94_A     S    94_A     16   80  124     15   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     C    95_A     C    95_A     16   80  124     14   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     A    96_A     A    96_A     16   80  124     14   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     L    97_A     L    97_A     16   80  124     16   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     D    98_A     D    98_A     16   80  124     20   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     G    99_A     G    99_A     16   80  124     13   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     D   100_A     D   100_A     16   80  124     12   43   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     R   101_A     R   101_A     16   80  124     14   48   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     L   102_A     L   102_A     16   80  124     14   43   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     G   103_A     G   103_A     16   80  124     11   43   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     L   104_A     L   104_A     16   80  124     11   43   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     G   105_A     G   105_A     16   80  124      9   41   71   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     K   106_A     K   106_A     16   80  124      4   28   55   81   87   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     I   107_A     I   107_A     16   80  124      9   41   71   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     I   108_A     I   108_A     16   80  124      4   10   25   68   87   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     R   109_A     R   109_A      4   79  124      3    3    6    9   22   48   73   83   96  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     V   110_A     V   110_A      4   18  124      3    3    5    7    9   15   22   29   41   68   79   96  107  111  114  115  116  117  119  119 
LCS_GDT     S   111_A     S   111_A      4   16  124      3    3    6   11   14   19   28   44   62   71   81   96  103  111  114  115  116  117  119  119 
LCS_GDT     T   112_A     T   112_A      5    6  124      3    5   11   18   34   53   70   81   90   97  103  107  110  111  114  115  116  117  119  119 
LCS_GDT     K   113_A     K   113_A      5    6  124      3    4    5    9   14   19   23   32   45   56   71   79   85   98  107  112  116  117  119  119 
LCS_GDT     T   114_A     T   114_A      5    6  124      3    4    5    6    9   17   23   32   53   61   75   90  103  109  114  115  116  117  119  119 
LCS_GDT     D   115_A     D   115_A      5    6  124      3    4    5    6    7   15   18   25   33   41   45   79   85   90   98  101  112  117  119  119 
LCS_GDT     A   116_A     A   116_A      5    6  124      3    4    5    6   21   25   37   44   72   89  102  106  110  111  114  115  116  117  119  119 
LCS_GDT     S   117_A     S   117_A      3    6  124      3    3    4   11   17   25   39   62   84   93  102  106  110  111  114  115  116  117  119  119 
LCS_GDT     N   118_A     N   118_A      3   23  124      3    4    7   13   24   69   90   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     S   119_A     S   119_A     21   23  124     11   37   70   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     A   120_A     A   120_A     21   23  124     15   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     I   121_A     I   121_A     21   23  124     24   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     L   122_A     L   122_A     21   23  124     25   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     C   123_A     C   123_A     21   23  124     17   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     T   124_A     T   124_A     21   23  124     17   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     G   125_A     G   125_A     21   23  124     23   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     F   126_A     F   126_A     21   23  124     20   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     R   127_A     R   127_A     21   23  124     25   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     A   128_A     A   128_A     21   23  124     25   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     I   129_A     I   129_A     21   23  124     25   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     F   130_A     F   130_A     21   23  124     25   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     G   131_A     G   131_A     21   23  124     25   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     A   132_A     A   132_A     21   23  124     25   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     I   133_A     I   133_A     21   23  124     13   50   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     A   134_A     A   134_A     21   23  124      7   42   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     I   135_A     I   135_A     21   23  124     13   48   73   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     D   136_A     D   136_A     21   23  124     11   39   62   84   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     A   137_A     A   137_A     21   23  124     11   37   57   72   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     G   138_A     G   138_A     21   23  124     10   37   57   83   91   94   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     T   139_A     T   139_A     21   23  124      3    9   26   69   85   88   95   97   99  102  106  107  110  111  114  115  116  117  119  119 
LCS_GDT     V   140_A     V   140_A     14   23  124      4   10   13   13   16   16   23   24   43   61   97   99  108  111  113  114  116  117  119  119 
LCS_GDT     D   141_A     D   141_A     14   16  124      9   12   13   15   16   16   16   17   20   24   32   78   93   99  104  109  113  116  119  119 
LCS_GDT     E   142_A     E   142_A     14   16  124      9   12   13   15   16   16   16   17   18   19   21   24   28   30   32   35   82   96  101  107 
LCS_GDT     A   143_A     A   143_A     14   16  124      9   12   13   15   16   16   16   17   18   19   20   23   25   27   32   34   36   40   57   91 
LCS_GDT     I   144_A     I   144_A     14   16  124      9   12   13   15   16   16   16   17   18   19   21   24   37   50   64   78   89   97  104  108 
LCS_GDT     K   145_A     K   145_A     14   16  122      9   12   13   15   16   16   16   17   18   19   21   24   28   30   32   48   58   67   74   77 
LCS_GDT     V   146_A     V   146_A     14   16   22      9   12   13   15   16   16   16   17   18   19   21   23   28   30   31   34   36   40   41   43 
LCS_GDT     F   147_A     F   147_A     14   16   22      9   12   13   15   16   16   16   17   18   19   21   24   28   30   32   34   36   40   41   43 
LCS_GDT     W   148_A     W   148_A     14   16   22      9   12   13   15   16   16   16   17   18   19   21   24   28   30   32   34   36   40   41   48 
LCS_GDT     K   149_A     K   149_A     14   16   22      9   12   13   15   16   16   16   17   18   19   21   24   28   30   31   34   36   40   41   43 
LCS_GDT     V   150_A     V   150_A     14   16   22      9   12   13   15   16   16   16   17   18   19   21   23   28   30   31   34   36   40   40   43 
LCS_GDT     H   151_A     H   151_A     14   16   22      9   12   13   15   16   16   16   17   18   19   21   24   28   30   32   34   36   40   41   43 
LCS_GDT     G   152_A     G   152_A     14   16   22      9   12   13   15   16   16   16   17   18   19   21   24   28   30   31   34   36   40   41   43 
LCS_GDT     A   153_A     A   153_A     14   16   22      3    4    8   15   16   16   16   17   18   19   21   24   28   30   31   34   36   39   40   43 
LCS_GDT     R   154_A     R   154_A      6   16   22      3    4    9   15   16   16   16   17   18   19   21   24   28   30   31   34   36   40   41   43 
LCS_GDT     A   155_A     A   155_A      6   16   22      3    3    9   15   16   16   16   17   18   19   20   24   28   30   31   34   36   40   41   43 
LCS_AVERAGE  LCS_A:  44.66  (  15.27   37.85   80.87 )

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     25     50     73     84     91     94     95     97     99    102    106    107    110    111    114    115    116    117    119    119 
GDT PERCENT_AT  17.48  34.97  51.05  58.74  63.64  65.73  66.43  67.83  69.23  71.33  74.13  74.83  76.92  77.62  79.72  80.42  81.12  81.82  83.22  83.22
GDT RMS_LOCAL    0.32   0.64   1.02   1.16   1.33   1.44   1.48   1.59   1.71   1.90   2.25   2.44   2.78   2.85   3.27   3.43   3.49   3.68   3.96   3.96
GDT RMS_ALL_AT  11.60  11.49  11.61  11.57  11.65  11.63  11.60  11.60  11.58  11.65  11.66  11.59  11.51  11.51  11.44  11.41  11.38  11.34  11.26  11.26

# Checking swapping
#   possible swapping detected:  D   100_A      D   100_A
#   possible swapping detected:  D   115_A      D   115_A
#   possible swapping detected:  F   126_A      F   126_A
#   possible swapping detected:  E   142_A      E   142_A
#   possible swapping detected:  F   147_A      F   147_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    T    17_A      T    17_A    27.840     0    0.093   0.103    31.960    0.000    0.000
LGA    D    18_A      D    18_A    24.277     0    0.122   1.046    29.837    0.000    0.000
LGA    L    19_A      L    19_A    21.842     0    0.634   0.665    26.845    0.000    0.000
LGA    A    20_A      A    20_A    18.164     0    0.609   0.600    19.540    0.000    0.000
LGA    K    21_A      K    21_A    16.612     0    0.084   0.831    25.275    0.000    0.000
LGA    L    22_A      L    22_A    14.218     0    0.195   1.373    18.576    0.000    0.000
LGA    Q    23_A      Q    23_A    10.218     0    0.034   0.956    13.543    3.214    1.429
LGA    T    24_A      T    24_A     7.440     0    0.061   0.100     9.487   12.857   10.136
LGA    Q    25_A      Q    25_A     7.149     0    0.165   1.323    14.544   12.619    5.767
LGA    I    26_A      I    26_A     5.384     0    0.677   0.563     7.723   24.048   19.940
LGA    G    27_A      G    27_A     5.396     0    0.222   0.222     7.794   23.452   23.452
LGA    Y    28_A      Y    28_A     6.263     0    0.165   1.177    13.634   24.048    9.762
LGA    K    29_A      K    29_A     7.093     0    0.123   0.684    15.046   12.619    5.820
LGA    F    30_A      F    30_A     5.218     0    0.178   1.184     9.703   19.762   11.948
LGA    N    31_A      N    31_A     5.364     0    0.442   0.828     5.560   27.619   33.333
LGA    N    32_A      N    32_A     3.321     0    0.103   0.940     6.646   57.738   42.738
LGA    I    33_A      I    33_A     1.076     0    0.163   0.897     2.674   83.810   78.631
LGA    N    34_A      N    34_A     0.964     0    0.102   0.197     1.961   88.214   81.607
LGA    L    35_A      L    35_A     0.600     0    0.041   1.305     2.861   90.476   81.964
LGA    L    36_A      L    36_A     0.558     0    0.030   1.410     3.926   90.476   75.357
LGA    R    37_A      R    37_A     0.694     0    0.054   0.966     3.972   90.476   68.442
LGA    R    38_A      R    38_A     0.629     0    0.020   0.976     5.744   92.857   66.277
LGA    A    39_A      A    39_A     0.273     0    0.024   0.023     0.322  100.000  100.000
LGA    M    40_A      M    40_A     0.483     0    0.108   0.173     1.118   92.976   91.726
LGA    T    41_A      T    41_A     0.547     0    0.094   0.108     0.815   92.857   91.837
LGA    H    42_A      H    42_A     0.500     0    0.119   1.076     5.925   90.476   65.905
LGA    A    43_A      A    43_A     0.858     0    0.089   0.109     1.169   85.952   85.048
LGA    S    44_A      S    44_A     1.469     0    0.078   0.573     2.900   75.119   73.175
LGA    F    45_A      F    45_A     1.757     0    0.193   1.295     8.932   79.286   43.939
LGA    S    46_A      S    46_A     0.890     0    0.094   0.126     1.208   88.214   85.952
LGA    Q    47_A      Q    47_A     1.160     0    0.110   0.804     3.621   83.690   70.106
LGA    E    48_A      E    48_A     1.216     0    0.074   0.510     3.328   85.952   76.190
LGA    N    49_A      N    49_A     0.942     0    0.088   0.259     1.404   83.690   85.952
LGA    N    50_A      N    50_A     1.133     0    0.081   0.110     1.622   79.286   84.881
LGA    K    51_A      K    51_A     1.377     0    0.030   0.494     3.518   81.429   69.153
LGA    A    52_A      A    52_A     1.368     0    0.018   0.026     1.406   81.429   81.429
LGA    L    53_A      L    53_A     1.033     0    0.104   0.118     1.155   81.429   84.821
LGA    S    54_A      S    54_A     1.125     0    0.024   0.729     3.437   81.429   76.190
LGA    I    55_A      I    55_A     1.623     0    0.081   0.672     2.222   79.286   77.262
LGA    F    56_A      F    56_A     1.268     0    0.037   0.245     1.392   81.429   84.762
LGA    G    57_A      G    57_A     1.308     0    0.081   0.081     1.366   81.429   81.429
LGA    T    58_A      T    58_A     1.396     0    0.065   0.062     1.451   81.429   81.429
LGA    H    59_A      H    59_A     1.457     0    0.086   1.096     3.188   81.429   75.762
LGA    I    60_A      I    60_A     1.439     0    0.034   1.036     2.624   81.429   74.167
LGA    I    61_A      I    61_A     1.480     0    0.066   0.121     1.921   81.429   77.143
LGA    E    62_A      E    62_A     1.181     0    0.093   0.242     2.046   81.429   77.672
LGA    T    63_A      T    63_A     1.344     0    0.045   0.071     1.553   81.429   80.204
LGA    A    64_A      A    64_A     1.585     0    0.039   0.053     1.822   77.143   76.286
LGA    V    65_A      V    65_A     1.434     0    0.026   0.096     1.791   81.429   77.755
LGA    S    66_A      S    66_A     1.271     0    0.029   0.092     1.317   81.429   81.429
LGA    L    67_A      L    67_A     1.204     0    0.039   0.169     1.292   81.429   82.560
LGA    Q    68_A      Q    68_A     1.510     0    0.110   1.005     4.362   75.000   60.000
LGA    F    69_A      F    69_A     1.682     0    0.016   0.085     1.875   72.857   72.857
LGA    L    70_A      L    70_A     1.243     0    0.120   1.341     3.431   79.286   73.274
LGA    A    71_A      A    71_A     1.204     0    0.054   0.055     2.048   75.119   76.381
LGA    K    72_A      K    72_A     2.747     0    0.011   1.199     3.259   57.262   62.540
LGA    D    73_A      D    73_A     2.792     0    0.181   0.898     7.181   64.881   44.286
LGA    I    74_A      I    74_A     2.810     0    0.067   1.447     7.860   57.143   40.952
LGA    D    75_A      D    75_A     2.589     0    0.125   0.364     4.309   67.143   55.298
LGA    I    76_A      I    76_A     1.538     0    0.045   1.012     4.592   72.976   62.024
LGA    S    77_A      S    77_A     1.248     0    0.056   0.136     1.675   81.429   78.571
LGA    S    78_A      S    78_A     1.051     0    0.054   0.119     1.247   81.429   82.937
LGA    K    79_A      K    79_A     0.978     0    0.040   0.854     4.626   90.476   70.423
LGA    A    80_A      A    80_A     0.974     0    0.032   0.049     1.374   85.952   85.048
LGA    L    81_A      L    81_A     1.261     0    0.069   1.408     4.480   81.429   68.036
LGA    G    82_A      G    82_A     1.155     0    0.037   0.037     1.175   81.429   81.429
LGA    R    83_A      R    83_A     1.152     0    0.063   1.034     6.163   81.429   59.394
LGA    L    84_A      L    84_A     1.328     0    0.066   0.209     1.639   81.429   80.357
LGA    I    85_A      I    85_A     1.481     0    0.030   0.172     1.988   81.429   77.143
LGA    S    86_A      S    86_A     1.218     0    0.099   0.639     2.879   81.429   77.381
LGA    E    87_A      E    87_A     1.035     0    0.115   0.185     1.511   81.429   80.476
LGA    V    88_A      V    88_A     0.873     0    0.340   0.350     1.772   86.071   86.667
LGA    S    89_A      S    89_A     1.988     0    0.146   0.193     4.594   69.048   58.492
LGA    N    90_A      N    90_A     4.807     0    0.635   1.060    10.206   36.190   19.940
LGA    V    91_A      V    91_A     4.190     0    0.590   0.534     6.788   40.238   29.864
LGA    E    92_A      E    92_A     4.213     0    0.131   0.285     8.131   40.238   26.190
LGA    S    93_A      S    93_A     2.681     0    0.175   0.200     3.138   57.262   56.032
LGA    S    94_A      S    94_A     0.882     0    0.110   0.642     3.060   88.214   82.222
LGA    C    95_A      C    95_A     0.297     0    0.519   0.476     2.666   86.905   89.683
LGA    A    96_A      A    96_A     0.927     0    0.056   0.062     1.157   88.214   88.667
LGA    L    97_A      L    97_A     0.942     0    0.038   0.275     1.497   90.476   87.083
LGA    D    98_A      D    98_A     0.788     0    0.046   0.249     2.005   90.476   85.000
LGA    G    99_A      G    99_A     0.544     0    0.067   0.067     0.758   92.857   92.857
LGA    D   100_A      D   100_A     1.170     0    0.168   0.349     2.946   83.690   73.333
LGA    R   101_A      R   101_A     1.270     0    0.042   1.296     7.023   81.429   63.160
LGA    L   102_A      L   102_A     1.683     0    0.014   0.138     1.976   75.000   73.929
LGA    G   103_A      G   103_A     1.680     0    0.020   0.020     1.777   72.857   72.857
LGA    L   104_A      L   104_A     1.299     0    0.089   0.166     1.662   79.286   83.750
LGA    G   105_A      G   105_A     1.806     0    0.026   0.026     2.834   69.048   69.048
LGA    K   106_A      K   106_A     3.304     0    0.030   0.134     5.412   51.786   41.852
LGA    I   107_A      I   107_A     1.969     0    0.014   0.120     2.635   64.881   75.476
LGA    I   108_A      I   108_A     3.283     0    0.601   1.073     4.128   50.357   48.631
LGA    R   109_A      R   109_A     7.708     0    0.203   1.538    13.447    5.238    1.991
LGA    V   110_A      V   110_A    11.930     0    0.578   1.431    13.344    0.119    0.068
LGA    S   111_A      S   111_A    13.190     0    0.575   0.788    13.739    0.000    0.000
LGA    T   112_A      T   112_A    10.569     0    0.618   0.947    12.376    0.000    0.680
LGA    K   113_A      K   113_A    16.407     0    0.600   0.989    20.643    0.000    0.000
LGA    T   114_A      T   114_A    14.251     0    0.095   0.130    14.459    0.000    0.000
LGA    D   115_A      D   115_A    15.798     0    0.627   1.324    20.589    0.000    0.000
LGA    A   116_A      A   116_A    10.338     0    0.575   0.563    12.285    2.143    1.810
LGA    S   117_A      S   117_A     9.354     0    0.598   0.562    10.814    5.476    3.651
LGA    N   118_A      N   118_A     4.823     0    0.208   0.823     8.385   38.333   27.381
LGA    S   119_A      S   119_A     1.853     0    0.575   0.890     5.976   79.286   61.667
LGA    A   120_A      A   120_A     0.483     0    0.028   0.036     0.681   92.857   92.381
LGA    I   121_A      I   121_A     1.114     0    0.021   0.073     1.222   83.690   82.560
LGA    L   122_A      L   122_A     1.105     0    0.035   1.088     2.566   85.952   77.500
LGA    C   123_A      C   123_A     0.358     0    0.021   0.054     0.473  100.000  100.000
LGA    T   124_A      T   124_A     0.315     0    0.022   0.080     0.476  100.000  100.000
LGA    G   125_A      G   125_A     0.248     0    0.028   0.028     0.411  100.000  100.000
LGA    F   126_A      F   126_A     0.531     0    0.028   0.190     1.146   92.857   88.874
LGA    R   127_A      R   127_A     0.903     0    0.050   0.242     1.314   90.476   88.009
LGA    A   128_A      A   128_A     0.759     0    0.126   0.136     0.759   92.857   92.381
LGA    I   129_A      I   129_A     0.651     0    0.036   0.099     1.095   95.238   91.726
LGA    F   130_A      F   130_A     0.820     0    0.083   0.564     1.704   90.476   85.628
LGA    G   131_A      G   131_A     0.583     0    0.058   0.058     0.585   95.238   95.238
LGA    A   132_A      A   132_A     0.400     0    0.118   0.133     0.807   97.619   96.190
LGA    I   133_A      I   133_A     0.850     0    0.021   0.106     1.459   88.333   87.143
LGA    A   134_A      A   134_A     1.348     0    0.025   0.033     1.600   79.286   78.000
LGA    I   135_A      I   135_A     0.760     0    0.056   0.136     1.709   83.810   89.524
LGA    D   136_A      D   136_A     1.748     0    0.036   0.823     2.454   70.952   70.893
LGA    A   137_A      A   137_A     2.417     0    0.134   0.138     3.370   59.167   60.286
LGA    G   138_A      G   138_A     2.071     0    0.645   0.645     3.109   63.095   63.095
LGA    T   139_A      T   139_A     3.762     0    0.166   1.168     7.931   32.381   24.014
LGA    V   140_A      V   140_A     7.463     0    0.590   0.505    10.769    9.405    9.388
LGA    D   141_A      D   141_A    11.915     0    0.109   0.381    15.956    0.119    0.238
LGA    E   142_A      E   142_A    17.488     0    0.054   1.178    21.992    0.000    0.000
LGA    A   143_A      A   143_A    17.819     0    0.085   0.097    19.986    0.000    0.000
LGA    I   144_A      I   144_A    17.255     0    0.054   0.618    21.746    0.000    0.000
LGA    K   145_A      K   145_A    23.287     0    0.031   0.157    27.551    0.000    0.000
LGA    V   146_A      V   146_A    26.956     0    0.060   0.127    29.578    0.000    0.000
LGA    F   147_A      F   147_A    25.370     0    0.037   1.709    28.539    0.000    0.000
LGA    W   148_A      W   148_A    28.369     0    0.085   1.237    33.076    0.000    0.000
LGA    K   149_A      K   149_A    34.448     0    0.031   0.846    37.809    0.000    0.000
LGA    V   150_A      V   150_A    34.983     0    0.020   0.073    37.201    0.000    0.000
LGA    H   151_A      H   151_A    33.519     0    0.190   1.566    36.486    0.000    0.000
LGA    G   152_A      G   152_A    38.482     0    0.057   0.057    42.274    0.000    0.000
LGA    A   153_A      A   153_A    43.581     0    0.203   0.216    44.969    0.000    0.000
LGA    R   154_A      R   154_A    40.980     0    0.012   1.549    41.613    0.000    0.000
LGA    A   155_A      A   155_A    39.122     0    0.522   0.531    40.898    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      139     556    556  100.00    1051   1051  100.00               143
SUMMARY(RMSD_GDC):    10.461         10.600                 10.840           56.151   52.270

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  141  143    4.0     97    1.59    60.490    57.465     5.750

LGA_LOCAL      RMSD:   1.587  Number of atoms:   97  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  11.605  Number of assigned atoms:  139 
Std_ASGN_ATOMS RMSD:  10.461  Standard rmsd on all 139 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.516369 * X  +   0.730649 * Y  +   0.446672 * Z  +  20.869354
  Y_new =   0.154189 * X  +   0.433742 * Y  +  -0.887746 * Z  +  16.050398
  Z_new =  -0.842371 * X  +   0.527276 * Y  +   0.111313 * Z  +  40.700932 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  0.290174  1.001668  1.362742   [DEG:   16.6257   57.3914   78.0793 ]
ZXZ:  0.466167  1.459252 -1.011519   [DEG:   26.7094   83.6090  -57.9558 ]
 
# END of job
