
#######################################################
#                                                     #
#                        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  310 ( 2535),  selected  154 , name one
# Molecule2: number of CA atoms  211 ( 1753),  selected  154 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:B  -ch2:B  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   147      58_B - 204_B       4.98     7.26
  LCS_AVERAGE:     67.34

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    43     148_B - 190_B       1.97     7.80
  LCS_AVERAGE:     11.24

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    28     163_B - 190_B       0.92     8.00
  LCS_AVERAGE:      6.94

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  154
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     K    58_B     K    58_B     13   16  147      7   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     D    59_B     D    59_B     13   16  147      7   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     L    60_B     L    60_B     13   16  147      7   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     A    61_B     A    61_B     13   16  147      7   31   48   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     Q    62_B     Q    62_B     13   16  147      7   19   46   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     F    63_B     F    63_B     13   16  147      7   31   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     Y    64_B     Y    64_B     13   16  147      7   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     A    65_B     A    65_B     13   16  147      7   15   48   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     L    66_B     L    66_B     13   16  147      7   15   33   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     L    67_B     L    67_B     13   16  147     13   22   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     G    68_B     G    68_B     13   16  147      5   19   46   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     A    69_B     A    69_B     13   16  147      5   19   49   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     L    70_B     L    70_B     13   16  147      5   12   33   52   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     S    71_B     S    71_B     12   16  147      4   21   33   51   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     Y    72_B     Y    72_B     11   16  147      4   10   29   51   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     S    73_B     S    73_B      4   16  147      3    6   16   51   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     P    74_B     P    74_B      4    6  147      3    4    4    4    8   11   14   26   33   89  100  113  119  126  127  131  132  134  138  143 
LCS_GDT     Y    75_B     Y    75_B      4   26  147      3    4    4    6    8   21   32   70   92  105  112  117  122  126  127  131  132  135  140  143 
LCS_GDT     G    76_B     G    76_B     24   30  147     11   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     L    77_B     L    77_B     24   30  147     12   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     E    78_B     E    78_B     24   30  147     14   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     L    79_B     L    79_B     24   30  147     14   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     E    80_B     E    80_B     24   30  147     14   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     L    81_B     L    81_B     24   30  147     14   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     V    82_B     V    82_B     24   30  147     14   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     K    83_B     K    83_B     24   30  147     14   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     K    84_B     K    84_B     24   30  147     14   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     A    85_B     A    85_B     24   30  147     14   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     N    86_B     N    86_B     24   30  147     14   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     I    87_B     I    87_B     24   30  147     14   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     L    88_B     L    88_B     24   30  147     14   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     L    89_B     L    89_B     24   30  147     14   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     Y    90_B     Y    90_B     24   30  147     11   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     S    91_B     S    91_B     24   30  147     13   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     E    92_B     E    92_B     24   30  147     14   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     R    93_B     R    93_B     24   30  147     14   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     I    94_B     I    94_B     24   30  147     13   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     R    95_B     R    95_B     24   30  147      7   31   48   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     R    96_B     R    96_B     24   30  147      7   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     E    97_B     E    97_B     24   30  147      5   32   48   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     K    98_B     K    98_B     24   30  147      8   27   45   62   74   85   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     E    99_B     E    99_B     24   30  147      3    9   23   35   52   76   90  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     I   100_B     I   100_B      3   30  147      0    3    5   10   22   38   57   78   97  110  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     R   101_B     R   101_B      5   30  147      5    5    6   17   30   45   75   93  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     P   102_B     P   102_B      5   30  147      5    5    6   20   31   44   64   84   99  110  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     E   103_B     E   103_B      5   30  147      5    5    9   20   31   44   61   75   91  108  112  118  120  126  127  131  132  136  140  143 
LCS_GDT     E   104_B     E   104_B      5   30  147      5   11   21   35   49   78   91  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     I   105_B     I   105_B      5   30  147      5   13   23   30   38   56   88   98  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     S   106_B     S   106_B      5    9  147      3    4    6    8   24   27   31   42   53   59   70   85   97  110  119  127  131  136  140  143 
LCS_GDT     L   107_B     L   107_B      7    9  147      3    4    7    8   10   20   23   34   46   56   67   84   97  107  119  127  131  136  140  143 
LCS_GDT     R   108_B     R   108_B      7    9  147      3    5    7    8   11   16   23   36   46   57   71   85   97  110  120  127  131  136  140  143 
LCS_GDT     I   109_B     I   109_B      7    9  147      3    5    7    8    8   10   21   30   43   53   66   85   97  111  121  127  131  136  140  143 
LCS_GDT     N   110_B     N   110_B      7    8  147      4    5    7    8    8    8   17   30   40   50   65   85  101  117  123  127  131  136  140  143 
LCS_GDT     K   111_B     K   111_B      7    8  147      4    5    7    8    8    8   19   28   36   43   53   68   88  106  116  126  131  136  140  143 
LCS_GDT     A   112_B     A   112_B      7    8  147      4    5    7    8    8    9   11   16   31   45   54   69   95  111  122  127  131  136  140  143 
LCS_GDT     I   113_B     I   113_B      7    8  147      4    5    7    8    8    9   22   30   38   50   65   78   95  107  123  127  131  136  140  143 
LCS_GDT     E   114_B     E   114_B      3    5  147      3    7   10   28   40   59   78   92  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     F   115_B     F   115_B      3    5  147      3   14   19   43   58   74   89  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     P   116_B     P   116_B      3    5  147      7   16   22   30   41   60   71   83   92  108  112  118  122  126  127  131  132  136  140  143 
LCS_GDT     I   117_B     I   117_B      8    9  147      3    8    9   15   22   34   49   55   91  102  113  118  121  125  127  131  132  136  140  143 
LCS_GDT     D   118_B     D   118_B      8    9  147      3    8    9   10   11   34   42   49   64   72  107  117  121  125  127  131  132  136  140  143 
LCS_GDT     D   119_B     D   119_B      8    9  147      4    8    9   10   20   34   42   54   63   88  108  117  121  125  127  131  132  136  140  143 
LCS_GDT     L   120_B     L   120_B      8    9  147      4    8    9   10   11   12   18   21   27   64   70   91  100  107  122  127  132  136  140  143 
LCS_GDT     K   121_B     K   121_B      8    9  147      4    8    9   10   11   14   18   21   38   49   60   64   71  103  110  124  128  136  140  143 
LCS_GDT     K   122_B     K   122_B      8    9  147      4    8    9   10   12   23   34   47   54   63   67   78   88  104  112  124  131  136  140  143 
LCS_GDT     I   123_B     I   123_B      8    9  147      3    8    9   10   11   13   22   34   45   57   62   67   75   90  101  118  127  136  140  143 
LCS_GDT     E   124_B     E   124_B      8    9  147      3    8    9   10   11   12   18   25   36   44   59   63   66   75   82   91  101  120  125  136 
LCS_GDT     R   125_B     R   125_B      4    9  147      3    4    4    5    7   14   21   29   46   54   61   68   74   90  102  118  128  136  140  143 
LCS_GDT     V   126_B     V   126_B      3    5  147      3    3    6    8    9   10   11   26   59   99  110  116  121  125  127  131  132  136  140  143 
LCS_GDT     F   127_B     F   127_B      3    5  147     13   32   48   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     G   128_B     G   128_B      3    6  147      0   25   50   62   74   86   93  100  106  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     K   129_B     K   129_B      5    6  147      4    5    5   25   73   83   93  100  106  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     L   130_B     L   130_B      5    7  147      7   15   45   56   69   81   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     P   131_B     P   131_B      5   11  147      4    5    5   36   74   84   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     E   132_B     E   132_B      5   11  147      4    6   22   30   43   71   91   98  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     Y   133_B     Y   133_B      9   13  147      4   15   23   30   54   83   92  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     T   134_B     T   134_B      9   13  147     10   16   23   30   51   82   92  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     I   135_B     I   135_B      9   13  147     10   16   23   29   34   78   91  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     H   136_B     H   136_B      9   13  147      7   16   23   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     L   137_B     L   137_B      9   13  147      7   26   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     A   138_B     A   138_B      9   13  147      7   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     E   139_B     E   139_B      9   13  147     13   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     F   140_B     F   140_B      9   13  147     13   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     L   141_B     L   141_B      9   13  147      7   19   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     D   142_B     D   142_B      5   13  147      5   12   22   27   42   61   77   90  102  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     L   143_B     L   143_B      5   13  147      5    5   10   13   16   29   48   69   85  100  108  116  120  126  127  131  132  136  140  143 
LCS_GDT     I   144_B     I   144_B      5   13  147      5    5    5    9   13   17   23   32   80  102  111  116  122  126  127  131  132  136  140  143 
LCS_GDT     P   145_B     P   145_B      5   13  147      3    4    9   36   69   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     G   146_B     G   146_B      4   13  147      3    3    9   36   69   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     E   147_B     E   147_B      4    6  147      3    3    4    7    8   10   20   83   94  110  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     R   148_B     R   148_B      3   43  147      2    3    4    5    5   15   20   71   93  110  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     L   149_B     L   149_B      3   43  147      0    3    4    5    7   46   62   96  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     S   150_B     S   150_B     20   43  147     10   16   23   30   35   54   90   99  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     E   151_B     E   151_B     20   43  147     10   16   23   29   34   70   90   99  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     Y   152_B     Y   152_B     20   43  147     10   16   23   48   73   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     Y   153_B     Y   153_B     20   43  147     10   16   23   46   68   85   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     I   154_B     I   154_B     20   43  147      8   18   26   47   71   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     Y   155_B     Y   155_B     20   43  147     11   20   32   47   73   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     N   156_B     N   156_B     20   43  147     10   20   32   46   71   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     G   157_B     G   157_B     20   43  147     10   21   33   59   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     N   158_B     N   158_B     20   43  147     10   16   32   52   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     V   159_B     V   159_B     20   43  147      7   16   32   59   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     Y   160_B     Y   160_B     21   43  147     10   16   30   46   73   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     L   161_B     L   161_B     25   43  147      4   13   26   46   73   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     R   162_B     R   162_B     27   43  147      8   17   26   56   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     K   163_B     K   163_B     28   43  147      4   18   32   48   73   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     E   164_B     E   164_B     28   43  147     11   20   36   59   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     D   165_B     D   165_B     28   43  147     13   24   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     L   166_B     L   166_B     28   43  147     12   21   36   61   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     I   167_B     I   167_B     28   43  147     15   23   36   55   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     K   168_B     K   168_B     28   43  147      5   23   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     V   169_B     V   169_B     28   43  147      5   24   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     W   170_B     W   170_B     28   43  147     14   23   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     M   171_B     M   171_B     28   43  147     15   23   35   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     K   172_B     K   172_B     28   43  147     15   31   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     A   173_B     A   173_B     28   43  147     15   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     F   174_B     F   174_B     28   43  147     15   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     E   175_B     E   175_B     28   43  147     15   27   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     R   176_B     R   176_B     28   43  147     15   26   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     N   177_B     N   177_B     28   43  147     15   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     I   178_B     I   178_B     28   43  147     15   32   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     E   179_B     E   179_B     28   43  147     15   23   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     K   180_B     K   180_B     28   43  147     15   23   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     S   181_B     S   181_B     28   43  147     15   26   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     V   182_B     V   182_B     28   43  147     15   23   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     N   183_B     N   183_B     28   43  147     15   23   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     M   184_B     M   184_B     28   43  147     15   23   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     L   185_B     L   185_B     28   43  147     15   23   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     Y   186_B     Y   186_B     28   43  147     12   23   36   59   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     E   187_B     E   187_B     28   43  147      4   18   33   53   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     I   188_B     I   188_B     28   43  147      4   21   40   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     R   189_B     R   189_B     28   43  147      7   25   50   62   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     D   190_B     D   190_B     28   43  147      8   20   32   59   74   86   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     E   191_B     E   191_B      4   42  147      3    4    4    4    5   11   42   76   89  101  110  116  122  126  127  131  132  134  137  142 
LCS_GDT     L   192_B     L   192_B      6   29  147      3    5    7    9   10   14   20   27   66   86  100  111  115  120  125  129  132  134  137  138 
LCS_GDT     P   193_B     P   193_B      6   11  147      3    5    7   10   21   48   68   83   97  105  112  116  122  126  127  131  132  134  138  143 
LCS_GDT     G   194_B     G   194_B      8   11  147      4    6    9    9   14   28   63   83   97  105  112  117  122  126  127  131  132  135  139  143 
LCS_GDT     F   195_B     F   195_B      8   11  147      4    6    9   11   21   29   55   83   97  104  112  117  121  126  127  131  132  135  140  143 
LCS_GDT     F   196_B     F   196_B      8   11  147      5    6    9   11   26   35   64   87   99  108  112  117  122  126  127  131  132  136  140  143 
LCS_GDT     R   197_B     R   197_B      8   11  147      5    6    9   12   27   58   85   99  106  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     E   198_B     E   198_B      8   11  147      5    6   18   56   69   85   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     V   199_B     V   199_B      8   11  147      5    7   19   29   64   81   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     L   200_B     L   200_B      8   11  147      5    6    9   23   56   62   92  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     G   201_B     G   201_B      8   11  147      3    6    9   52   67   82   93  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     G   202_B     G   202_B      7   11  147      3    6    9   15   52   74   92  100  107  111  115  118  122  126  127  131  132  136  140  143 
LCS_GDT     I   203_B     I   203_B      3    5  147      3    3    4    9   13   21   31   43   62   86  105  115  121  125  127  131  132  136  140  143 
LCS_GDT     K   204_B     K   204_B      3    4  147      3    3    3    5    8   10   14   26   34   43   53   69   98  113  116  127  131  134  137  140 
LCS_GDT     E   205_B     E   205_B      3    3   87      3    3    3    7    8    9   14   26   34   43   57   70  104  113  120  127  131  134  137  140 
LCS_GDT     V   206_B     V   206_B      3    3   84      3    3    3    4    5    7    9   14   15   20   28   34   42   43   47   58   70   81   95  116 
LCS_GDT     A   207_B     A   207_B      3    3   59      0    3    3    3    3    4    5    6    7   10   13   17   21   26   28   34   38   40   44   49 
LCS_GDT     E   208_B     E   208_B      3    3   13      3    3    3    3    3    4    5    6    9   10   14   15   18   25   26   29   35   40   42   45 
LCS_GDT     Q   209_B     Q   209_B      3    3   13      3    3    3    3    3    4    4    5    6    7   12   17   21   26   31   34   38   42   47   59 
LCS_GDT     E   210_B     E   210_B      3    3    9      3    3    3    3    3    4    4    4    6    7    8   10   12   14   16   17   18   21   28   38 
LCS_GDT     F   211_B     F   211_B      3    3    8      3    3    3    3    3    4    4    4    5    7    7    8    8   11   12   17   18   21   21   25 
LCS_AVERAGE  LCS_A:  28.50  (   6.94   11.24   67.34 )

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     15     32     50     62     74     86     93    100    107    111    115    118    122    126    127    131    132    136    140    143 
GDT PERCENT_AT   7.11  15.17  23.70  29.38  35.07  40.76  44.08  47.39  50.71  52.61  54.50  55.92  57.82  59.72  60.19  62.09  62.56  64.45  66.35  67.77
GDT RMS_LOCAL    0.32   0.67   1.09   1.23   1.52   1.89   2.04   2.22   2.58   2.67   2.86   3.07   3.21   3.41   3.47   3.70   3.77   4.40   4.61   4.71
GDT RMS_ALL_AT   8.23   7.72   7.83   7.73   7.80   7.62   7.56   7.55   7.42   7.42   7.42   7.37   7.43   7.43   7.35   7.31   7.32   7.33   7.30   7.29

# Checking swapping
#   possible swapping detected:  D    59_B      D    59_B
#   possible swapping detected:  F    63_B      F    63_B
#   possible swapping detected:  Y    64_B      Y    64_B
#   possible swapping detected:  Y    72_B      Y    72_B
#   possible swapping detected:  E    78_B      E    78_B
#   possible swapping detected:  E    80_B      E    80_B
#   possible swapping detected:  Y    90_B      Y    90_B
#   possible swapping detected:  E    99_B      E    99_B
#   possible swapping detected:  E   103_B      E   103_B
#   possible swapping detected:  E   114_B      E   114_B
#   possible swapping detected:  D   118_B      D   118_B
#   possible swapping detected:  D   119_B      D   119_B
#   possible swapping detected:  E   124_B      E   124_B
#   possible swapping detected:  E   132_B      E   132_B
#   possible swapping detected:  Y   133_B      Y   133_B
#   possible swapping detected:  E   147_B      E   147_B
#   possible swapping detected:  Y   153_B      Y   153_B
#   possible swapping detected:  Y   155_B      Y   155_B
#   possible swapping detected:  Y   160_B      Y   160_B
#   possible swapping detected:  E   164_B      E   164_B
#   possible swapping detected:  D   165_B      D   165_B
#   possible swapping detected:  E   175_B      E   175_B
#   possible swapping detected:  E   179_B      E   179_B
#   possible swapping detected:  Y   186_B      Y   186_B
#   possible swapping detected:  E   187_B      E   187_B
#   possible swapping detected:  E   191_B      E   191_B
#   possible swapping detected:  F   195_B      F   195_B
#   possible swapping detected:  E   205_B      E   205_B
#   possible swapping detected:  E   208_B      E   208_B
#   possible swapping detected:  E   210_B      E   210_B

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    K    58_B      K    58_B     1.269     0    0.157   0.769     4.452   77.143   70.688
LGA    D    59_B      D    59_B     1.370     0    0.072   0.213     1.634   81.429   79.286
LGA    L    60_B      L    60_B     1.058     0    0.066   1.392     4.482   83.690   74.940
LGA    A    61_B      A    61_B     1.367     0    0.026   0.022     1.654   77.143   76.286
LGA    Q    62_B      Q    62_B     1.921     0    0.013   1.383     5.828   72.857   56.561
LGA    F    63_B      F    63_B     1.556     0    0.033   0.200     1.644   72.857   76.753
LGA    Y    64_B      Y    64_B     1.456     0    0.114   1.409     8.924   81.429   48.452
LGA    A    65_B      A    65_B     1.827     0    0.040   0.041     2.228   72.857   71.238
LGA    L    66_B      L    66_B     2.160     0    0.115   0.249     3.703   70.833   61.369
LGA    L    67_B      L    67_B     1.599     0    0.015   0.182     2.681   72.857   69.881
LGA    G    68_B      G    68_B     1.931     0    0.031   0.031     2.096   70.833   70.833
LGA    A    69_B      A    69_B     1.662     0    0.031   0.028     2.136   70.833   71.238
LGA    L    70_B      L    70_B     2.557     0    0.212   1.016     5.539   57.262   47.619
LGA    S    71_B      S    71_B     2.794     0    0.084   0.115     3.114   57.262   58.492
LGA    Y    72_B      Y    72_B     2.883     0    0.659   1.224    11.922   48.929   26.905
LGA    S    73_B      S    73_B     2.506     0    0.079   0.639     5.820   45.952   40.397
LGA    P    74_B      P    74_B     7.869     0    0.239   0.276     9.659   10.476    8.912
LGA    Y    75_B      Y    75_B     6.622     0    0.564   0.385    18.985   25.238    8.810
LGA    G    76_B      G    76_B     0.844     0    0.662   0.662     2.669   79.881   79.881
LGA    L    77_B      L    77_B     0.921     0    0.042   1.279     2.937   85.952   78.631
LGA    E    78_B      E    78_B     1.327     0    0.032   0.797     3.476   81.429   74.233
LGA    L    79_B      L    79_B     1.281     0    0.020   1.008     2.470   81.429   76.190
LGA    E    80_B      E    80_B     1.442     0    0.086   1.226     3.747   81.429   70.053
LGA    L    81_B      L    81_B     1.176     0    0.041   0.144     1.361   81.429   81.429
LGA    V    82_B      V    82_B     0.955     0    0.034   0.789     1.963   83.690   80.272
LGA    K    83_B      K    83_B     1.380     0    0.024   0.824     1.775   81.429   79.524
LGA    K    84_B      K    84_B     1.424     0    0.010   0.587     4.209   81.429   70.053
LGA    A    85_B      A    85_B     1.012     0    0.025   0.037     1.123   85.952   86.857
LGA    N    86_B      N    86_B     0.980     0    0.039   0.410     1.707   90.476   86.012
LGA    I    87_B      I    87_B     1.088     0    0.043   0.601     3.468   83.690   78.631
LGA    L    88_B      L    88_B     1.074     0    0.007   0.088     1.863   85.952   81.548
LGA    L    89_B      L    89_B     0.824     0    0.036   0.114     1.010   90.476   89.345
LGA    Y    90_B      Y    90_B     0.759     0    0.062   0.607     3.062   90.476   77.143
LGA    S    91_B      S    91_B     0.975     0    0.031   0.057     1.332   85.952   85.952
LGA    E    92_B      E    92_B     1.444     0    0.020   0.941     5.403   79.286   61.376
LGA    R    93_B      R    93_B     1.300     0    0.061   1.108     2.719   79.286   79.307
LGA    I    94_B      I    94_B     1.544     0    0.029   0.604     2.485   72.976   72.976
LGA    R    95_B      R    95_B     2.333     0    0.103   1.262     4.356   61.190   67.100
LGA    R    96_B      R    96_B     2.183     0    0.094   0.425     5.438   64.762   54.329
LGA    E    97_B      E    97_B     1.957     0    0.069   0.874     2.861   66.905   70.476
LGA    K    98_B      K    98_B     2.484     0    0.602   1.534     7.027   60.952   53.069
LGA    E    99_B      E    99_B     5.044     0    0.525   1.237    10.950   26.667   14.444
LGA    I   100_B      I   100_B     5.995     0    0.568   1.018    10.669   25.000   14.286
LGA    R   101_B      R   101_B     6.336     0    0.708   0.987    15.130   19.405    7.619
LGA    P   102_B      P   102_B     7.236     0    0.080   0.322     9.662    8.571    5.782
LGA    E   103_B      E   103_B     8.166     0    0.147   0.874    10.016    9.643    5.556
LGA    E   104_B      E   104_B     4.221     0    0.271   0.894     6.967   31.786   31.270
LGA    I   105_B      I   105_B     5.098     0    0.116   1.067     7.690   18.690   38.988
LGA    S   106_B      S   106_B    10.888     0    0.623   0.535    13.076    0.833    0.556
LGA    L   107_B      L   107_B    10.620     0    0.019   0.122    11.183    0.000    0.655
LGA    R   108_B      R   108_B    11.505     0    0.181   1.259    20.441    0.000    0.000
LGA    I   109_B      I   109_B    11.077     0    0.007   0.119    13.376    0.000    0.000
LGA    N   110_B      N   110_B    11.223     0    0.016   1.153    15.006    0.000    0.000
LGA    K   111_B      K   111_B    11.706     0    0.060   0.991    15.903    0.000    0.000
LGA    A   112_B      A   112_B    11.318     0    0.453   0.416    11.664    0.000    0.000
LGA    I   113_B      I   113_B    11.850     0    0.103   0.662    14.416    0.000    0.000
LGA    E   114_B      E   114_B     7.053     0    0.635   1.319     8.388   10.476   26.931
LGA    F   115_B      F   115_B     5.485     0    0.676   1.332     8.502   17.143   19.567
LGA    P   116_B      P   116_B     8.529     0    0.356   0.492     8.820    8.333    7.755
LGA    I   117_B      I   117_B     9.627     0    0.646   1.378    12.078    0.833    0.417
LGA    D   118_B      D   118_B    10.798     0    0.317   0.507    14.514    0.000    0.000
LGA    D   119_B      D   119_B     9.638     0    0.077   0.306    10.956    0.238    4.345
LGA    L   120_B      L   120_B    11.379     0    0.044   0.977    12.985    0.000    0.000
LGA    K   121_B      K   121_B    13.339     0    0.050   0.849    14.326    0.000    0.000
LGA    K   122_B      K   122_B    12.544     0    0.124   0.276    12.896    0.000    0.053
LGA    I   123_B      I   123_B    12.708     0    0.117   0.472    13.555    0.000    0.000
LGA    E   124_B      E   124_B    13.669     0    0.164   0.722    15.152    0.000    0.000
LGA    R   125_B      R   125_B    11.127     0    0.361   1.528    19.274    1.071    0.390
LGA    V   126_B      V   126_B     6.635     0    0.581   0.866     9.416   32.143   23.061
LGA    F   127_B      F   127_B     2.290     0    0.685   1.495    11.377   59.405   27.143
LGA    G   128_B      G   128_B     2.055     0    0.466   0.466     2.055   70.833   70.833
LGA    K   129_B      K   129_B     3.196     0    0.675   0.805     7.678   44.048   28.942
LGA    L   130_B      L   130_B     3.538     0    0.072   1.366     9.205   57.500   33.810
LGA    P   131_B      P   131_B     2.964     0    0.059   0.423     6.566   59.286   42.585
LGA    E   132_B      E   132_B     5.032     0    0.670   0.778    11.868   30.595   15.132
LGA    Y   133_B      Y   133_B     3.983     0    0.071   0.229     5.339   43.452   36.944
LGA    T   134_B      T   134_B     3.883     0    0.189   1.053     5.476   38.810   37.415
LGA    I   135_B      I   135_B     3.694     0    0.141   0.951     5.508   51.905   44.107
LGA    H   136_B      H   136_B     1.689     0    0.067   1.105     2.706   70.833   69.762
LGA    L   137_B      L   137_B     1.073     0    0.045   0.668     3.431   83.690   73.631
LGA    A   138_B      A   138_B     1.147     0    0.059   0.061     1.976   79.405   81.619
LGA    E   139_B      E   139_B     2.194     0    0.064   0.770     5.603   63.095   51.376
LGA    F   140_B      F   140_B     1.606     0    0.385   1.051     7.071   70.833   49.048
LGA    L   141_B      L   141_B     1.949     0    0.076   1.430     6.759   68.810   50.179
LGA    D   142_B      D   142_B     5.638     0    0.090   0.637     9.473   21.429   13.631
LGA    L   143_B      L   143_B     7.116     0    0.041   0.069    10.575   11.071    7.619
LGA    I   144_B      I   144_B     6.633     0    0.551   0.511    11.939   21.786   13.512
LGA    P   145_B      P   145_B     2.899     0    0.159   0.213     4.098   57.976   55.850
LGA    G   146_B      G   146_B     2.891     0    0.633   0.633     3.827   51.905   51.905
LGA    E   147_B      E   147_B     6.383     0    0.089   1.225    13.745   20.714    9.524
LGA    R   148_B      R   148_B     6.752     0    0.656   0.613     8.250   11.190    9.524
LGA    L   149_B      L   149_B     5.812     0    0.695   0.618    10.470   20.595   12.381
LGA    S   150_B      S   150_B     4.789     0    0.644   0.565     5.389   34.762   32.778
LGA    E   151_B      E   151_B     4.319     0    0.123   0.659     5.146   38.690   38.042
LGA    Y   152_B      Y   152_B     2.853     0    0.022   1.257     9.651   50.119   33.810
LGA    Y   153_B      Y   153_B     3.842     0    0.132   0.265     6.014   46.667   33.294
LGA    I   154_B      I   154_B     3.611     0    0.054   1.116     5.370   43.333   38.929
LGA    Y   155_B      Y   155_B     3.611     0    0.076   0.197     5.638   46.667   36.706
LGA    N   156_B      N   156_B     3.784     0    0.058   0.076     4.889   46.667   39.762
LGA    G   157_B      G   157_B     2.328     0    0.020   0.020     2.863   64.881   64.881
LGA    N   158_B      N   158_B     2.532     0    0.115   0.363     4.109   59.048   52.917
LGA    V   159_B      V   159_B     2.077     0    0.064   0.088     3.081   61.071   66.122
LGA    Y   160_B      Y   160_B     2.789     0    0.067   0.222     3.757   59.048   50.794
LGA    L   161_B      L   161_B     2.996     0    0.061   0.428     4.496   57.143   50.298
LGA    R   162_B      R   162_B     2.343     0    0.157   1.120     3.547   62.857   59.437
LGA    K   163_B      K   163_B     3.119     0    0.174   1.126     4.785   55.357   45.291
LGA    E   164_B      E   164_B     2.257     0    0.087   0.681     2.514   64.881   66.667
LGA    D   165_B      D   165_B     1.286     0    0.108   0.188     2.447   75.000   71.964
LGA    L   166_B      L   166_B     1.921     0    0.026   0.927     5.726   68.810   55.238
LGA    I   167_B      I   167_B     2.509     0    0.013   0.656     5.189   62.857   54.345
LGA    K   168_B      K   168_B     1.954     0    0.024   0.692     2.055   70.833   71.058
LGA    V   169_B      V   169_B     1.599     0    0.019   0.108     1.731   72.857   74.082
LGA    W   170_B      W   170_B     1.848     0    0.042   1.572     7.495   72.857   53.469
LGA    M   171_B      M   171_B     2.181     0    0.037   0.663     2.614   68.810   68.929
LGA    K   172_B      K   172_B     1.614     0    0.033   0.726     2.756   77.143   72.116
LGA    A   173_B      A   173_B     0.789     0    0.029   0.038     1.039   88.214   88.667
LGA    F   174_B      F   174_B     1.050     0    0.017   0.129     1.944   85.952   77.619
LGA    E   175_B      E   175_B     1.236     0    0.087   0.141     1.521   81.429   80.476
LGA    R   176_B      R   176_B     0.833     0    0.053   1.087     6.051   90.476   63.117
LGA    N   177_B      N   177_B     0.549     0    0.063   0.157     1.369   92.857   89.405
LGA    I   178_B      I   178_B     1.073     0    0.063   0.702     4.488   88.214   74.048
LGA    E   179_B      E   179_B     1.495     0    0.054   0.870     3.453   79.286   76.085
LGA    K   180_B      K   180_B     1.170     0    0.018   0.899     4.400   81.429   69.577
LGA    S   181_B      S   181_B     0.647     0    0.043   0.600     1.922   90.476   89.127
LGA    V   182_B      V   182_B     1.070     0    0.020   0.100     1.405   83.690   82.721
LGA    N   183_B      N   183_B     1.413     0    0.079   0.102     1.730   79.286   79.286
LGA    M   184_B      M   184_B     1.280     0    0.026   1.013     4.616   81.429   71.250
LGA    L   185_B      L   185_B     1.203     0    0.069   1.374     3.435   79.286   71.548
LGA    Y   186_B      Y   186_B     2.273     0    0.029   0.309     3.311   64.762   59.762
LGA    E   187_B      E   187_B     2.802     0    0.119   0.887     3.239   55.357   65.291
LGA    I   188_B      I   188_B     2.132     0    0.435   1.367     4.387   64.881   59.524
LGA    R   189_B      R   189_B     0.886     0    0.644   0.834     2.231   81.786   76.147
LGA    D   190_B      D   190_B     2.297     0    0.546   1.177     5.599   55.714   42.321
LGA    E   191_B      E   191_B     7.260     0    0.112   1.080    13.393   12.262    5.556
LGA    L   192_B      L   192_B     8.679     0    0.646   0.610    13.563    6.786    3.452
LGA    P   193_B      P   193_B     6.368     0    0.061   0.294     7.486   14.405   14.150
LGA    G   194_B      G   194_B     5.911     0    0.086   0.086     5.911   21.429   21.429
LGA    F   195_B      F   195_B     6.100     0    0.009   0.174     7.854   20.357   14.502
LGA    F   196_B      F   196_B     5.476     0    0.151   0.198     5.910   26.310   24.069
LGA    R   197_B      R   197_B     4.729     0    0.038   0.703     8.766   36.071   20.866
LGA    E   198_B      E   198_B     3.160     0    0.029   0.893     6.829   53.810   40.370
LGA    V   199_B      V   199_B     3.494     0    0.042   0.129     4.501   48.333   42.721
LGA    L   200_B      L   200_B     4.001     0    0.138   1.412     8.500   40.238   31.964
LGA    G   201_B      G   201_B     3.115     0    0.144   0.144     3.775   48.333   48.333
LGA    G   202_B      G   202_B     4.081     0    0.619   0.619     7.441   27.976   27.976
LGA    I   203_B      I   203_B     8.312     0    0.599   0.549    11.404    5.595    4.643
LGA    K   204_B      K   204_B    12.331     0    0.645   0.967    14.467    0.000    0.000
LGA    E   205_B      E   205_B    12.749     0    0.598   1.137    14.730    0.000    0.000
LGA    V   206_B      V   206_B    18.033     0    0.611   0.601    21.646    0.000    0.000
LGA    A   207_B      A   207_B    24.010     0    0.591   0.594    25.605    0.000    0.000
LGA    E   208_B      E   208_B    26.191     0    0.657   0.842    27.501    0.000    0.000
LGA    Q   209_B      Q   209_B    24.916     0    0.478   1.120    27.315    0.000    0.000
LGA    E   210_B      E   210_B    32.065     0    0.590   1.261    37.979    0.000    0.000
LGA    F   211_B      F   211_B    35.510     0    0.450   0.600    38.091    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      154     616    616  100.00    1292   1292  100.00               211
SUMMARY(RMSD_GDC):     7.027          7.050                  7.796           35.323   31.697

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  310  211    4.0    100    2.22    38.507    33.956     4.311

LGA_LOCAL      RMSD:   2.220  Number of atoms:  100  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   7.553  Number of assigned atoms:  154 
Std_ASGN_ATOMS RMSD:   7.027  Standard rmsd on all 154 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.535261 * X  +   0.819131 * Y  +   0.206203 * Z  + -21.189838
  Y_new =  -0.752790 * X  +  -0.351864 * Y  +  -0.556327 * Z  +  63.063858
  Z_new =  -0.383150 * X  +  -0.453008 * Y  +   0.804972 * Z  +  -1.057412 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -2.188891  0.393204 -0.512588   [DEG: -125.4142   22.5289  -29.3691 ]
ZXZ:  0.354952  0.635168 -2.439547   [DEG:   20.3372   36.3924 -139.7758 ]
 
# END of job
