
#######################################################
#                                                     #
#                        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  304 ( 2567),  selected  293 , name one
# Molecule2: number of CA atoms  379 ( 3007),  selected  293 , 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:   128     171_B - 298_B       4.97    10.13
  LCS_AVERAGE:     21.20

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    58     204_B - 261_B       1.85    10.93
  LCS_AVERAGE:      6.14

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    33     207_B - 239_B       1.00    10.97
  LCS_AVERAGE:      3.07

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  293
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     E   108_B     E   108_B      3   13   30      3    3    4    4    4    4    9   22   28   58   83  140  167  187  195  203  207  211  215  220 
LCS_GDT     N   109_B     N   109_B     12   13   30     11   11   12   13   16   54  113  133  149  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     Y   110_B     Y   110_B     12   13   30     11   21   58   83  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     V   111_B     V   111_B     12   13   30     11   11   28   53   90  107  123  138  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     M   112_B     M   112_B     12   13   30     11   11   12   24   38   54   81  120  145  159  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     E   113_B     E   113_B     12   13   30     11   11   12   13   72  104  127  140  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     A   114_B     A   114_B     12   13   30     11   26   61   83  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     V   115_B     V   115_B     12   13   30     11   11   31   61   91  110  128  140  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     S   116_B     S   116_B     12   13   30     11   11   12   13   16   16   26   73  135  157  168  178  185  192  198  203  207  211  215  220 
LCS_GDT     L   117_B     L   117_B     12   13   30     11   11   26   44   92  109  127  138  148  158  168  178  185  192  198  203  207  211  215  220 
LCS_GDT     A   118_B     A   118_B     12   13   30     11   33   71   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     F   119_B     F   119_B     12   13   30     11   11   12   40   60  103  125  140  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     L   120_B     L   120_B     12   13   30      3    8   12   13   16   16   16   18   32   54   71  140  173  189  193  201  207  211  215  220 
LCS_GDT     N   121_B     N   121_B      4   13   30      3    4    4    7    8   12   17   22   23   32   69  111  131  153  165  173  185  193  202  212 
LCS_GDT     E   122_B     E   122_B      4    8   30      3    4    7    8   12   14   22   27   91  114  122  128  152  165  171  178  190  198  205  211 
LCS_GDT     Y   123_B     Y   123_B      4    8   30      3    4    8   11   12   14   17   23   30   42   57   84  102  136  150  154  168  181  192  200 
LCS_GDT     Y   124_B     Y   124_B      5    8   30      3    5    7   10   12   15   17   22   25   32   37   46   57   65  102  127  140  165  172  178 
LCS_GDT     P   125_B     P   125_B      5    8   30      3    5    7   10   12   15   17   22   28   32   55   65   91  110  125  144  155  169  182  198 
LCS_GDT     G   126_B     G   126_B      5    8   30      3    5   11   13   13   15   17   22   25   32   36   50   57   64   72  119  143  155  169  175 
LCS_GDT     I   127_B     I   127_B      5    8   30      3    5    7   12   16   16   17   22   28   32   41   65   91  122  134  146  165  177  194  199 
LCS_GDT     T   128_B     T   128_B      5    8   30      3    5   11   13   16   47   59   66   77  110  125  140  151  159  169  178  190  199  212  220 
LCS_GDT     P   129_B     P   129_B      4    8   30      3    4    6   10   16   47   52   62   74   91  108  134  143  153  167  177  185  198  205  215 
LCS_GDT     K   130_B     K   130_B      4    7   30      3    4    6   10   16   16   16   70  115  122  139  145  155  164  180  188  195  206  213  220 
LCS_GDT     F   131_B     F   131_B      4    6   30      2    3    4    4    5    8   16   45   54   83  100  122  137  151  164  174  185  195  207  218 
LCS_GDT     Y   132_B     Y   132_B      4    6   30      2    3    4    4    9   10   14   18   19   23   26   28   31   35   40   48   66  135  172  191 
LCS_GDT     K   133_B     K   133_B      4    6   30      3    3    4    4    9   10   12   16   19   23   26   31   51   54   67   70  120  147  165  180 
LCS_GDT     I   134_B     I   134_B      4    6   30      3    3    4    4    9   10   13   16   19   23   26   28   31   35   67   70   75  135  156  163 
LCS_GDT     L   135_B     L   135_B      4    6   30      3    3    4    4   12   13   15   18   20   23   26   28   31   35   36   39   75   81  135  143 
LCS_GDT     Y   136_B     Y   136_B      4    6   30      2    3    4    4    5    5    6   10   16   20   26   28   31   35   67   70   75   81  151  158 
LCS_GDT     E   137_B     E   137_B      4    4   30      2    3    4    4    4    4    4    5    8    8    9   12   30   35   36   37   69   92  124  131 
LCS_GDT     S   138_B     S   138_B      4    4   11      0    3    4    4    4    4    4    6    8    8    9   12   14   14   14   20   24  101  124  131 
LCS_GDT     D   139_B     D   139_B      3    3   11      0    3    3    3    3    4    4    5    6    8    9   10   11   13   14   15   19   20   23   28 
LCS_GDT     Y   151_B     Y   151_B      3    5   16      3    3    3    6   14   25   33   50   62   77   96  134  148  158  173  183  190  197  203  208 
LCS_GDT     K   152_B     K   152_B      3    8   16      3    3    6   13   19   27   39   50   63   75   88  106  132  145  164  177  185  193  201  207 
LCS_GDT     F   153_B     F   153_B      3    8   16      3    3    6   11   19   27   39   50   63   75   87  104  126  143  159  173  182  192  201  207 
LCS_GDT     Q   154_B     Q   154_B      3    8   16      3    3    6   10   17   23   34   50   60   75   86  103  126  137  157  171  181  189  198  205 
LCS_GDT     D   155_B     D   155_B      3    8   16      3    3    6   10   19   27   37   50   63   75   90  106  126  145  161  173  184  193  201  207 
LCS_GDT     L   156_B     L   156_B      3    8   16      3    3    6   13   19   27   39   50   63   82   96  111  135  152  168  181  189  196  203  208 
LCS_GDT     N   157_B     N   157_B      3    8   16      3    3    6    7   16   21   33   42   60   74   86  106  126  137  157  172  181  189  198  205 
LCS_GDT     E   158_B     E   158_B      3    8   16      1    3    4    9   12   17   19   27   36   45   51   66   82   98  134  150  168  182  189  198 
LCS_GDT     L   159_B     L   159_B      4    8   18      1    4    6   10   12   17   19   33   48   61   82   97  117  134  146  166  178  185  196  202 
LCS_GDT     N   160_B     N   160_B      4    4   18      3    4    4    4    4    6    7   16   23   29   38   48   58   77   86  100  121  147  167  181 
LCS_GDT     D   161_B     D   161_B      4    4   18      3    4    4    4    4    6    6   16   23   31   47   57   62   72   76   84   97  105  133  141 
LCS_GDT     I   162_B     I   162_B      4    4   18      3    4    4    7   12   17   19   27   36   45   49   60   74   88  106  122  141  167  180  192 
LCS_GDT     L   163_B     L   163_B      3    3   18      0    4    4    4    4    4   19   27   36   45   49   57   71   78   90  113  133  154  177  190 
LCS_GDT     T   164_B     T   164_B      3    3   18      0    3    4    4    4    5   19   27   36   45   49   57   71   78   86   95  114  135  154  174 
LCS_GDT     K   165_B     K   165_B      4    4   18      4    4    4    4    4    7   11   15   21   27   34   39   46   54   61   80  100  115  138  159 
LCS_GDT     K   166_B     K   166_B      4    4   18      4    4    4    4    5    7    7    7    8   11   21   21   27   33   80   83   96  115  134  152 
LCS_GDT     L   167_B     L   167_B      4    4   18      4    4    4    4    6    7   10   14   19   22   26   39   56   68   87  105  123  133  150  171 
LCS_GDT     E   168_B     E   168_B      4    6   18      4    4    4    4    7   10   13   17   20   23   30   41   48   55   68   77   96  119  134  152 
LCS_GDT     N   169_B     N   169_B      3    7   94      3    4    5    7    8    8   13   13   15   19   23   29   39   44   53   66   78   87  100  114 
LCS_GDT     N   170_B     N   170_B      4    7  126      4    5    6   13   15   16   16   18   23   33   41   54   69   83  106  132  147  177  185  198 
LCS_GDT     I   171_B     I   171_B      4    7  128      4    5    6    7    9   12   17   22   34   53   72   98  131  147  162  175  187  196  202  207 
LCS_GDT     N   172_B     N   172_B      4    7  128      4    5    6    7    8   15   26   58   84  104  131  147  162  173  183  191  199  203  208  212 
LCS_GDT     G   173_B     G   173_B      4   18  128      4    5    6    7    8   62   87  112  133  148  159  171  180  187  192  199  204  209  214  218 
LCS_GDT     N   174_B     N   174_B     13   24  128      4   14   30   58   89  108  122  136  152  161  170  178  185  192  198  203  207  211  214  220 
LCS_GDT     I   175_B     I   175_B     13   24  128      5   13   29   55   85  107  122  136  149  161  170  177  185  192  198  203  207  211  214  220 
LCS_GDT     V   176_B     V   176_B     13   24  128      4   13   30   55   87  107  122  136  152  161  170  178  185  192  198  203  207  211  214  220 
LCS_GDT     L   177_B     L   177_B     13   24  128      5   13   31   61   89  109  126  140  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     I   178_B     I   178_B     13   24  128      5   21   36   67  100  116  128  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     S   179_B     S   179_B     13   24  128      5   21   48   82  100  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     E   180_B     E   180_B     14   24  128      4   12   48   82  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     F   181_B     F   181_B     16   24  128      7   21   50   82  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     F   182_B     F   182_B     16   24  128      4   17   35   71  100  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     G   183_B     G   183_B     16   24  128      8   20   50   82  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     E   184_B     E   184_B     16   24  128     10   21   53   82  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     N   185_B     N   185_B     16   24  128     10   39   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     V   186_B     V   186_B     16   24  128     10   38   73   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     F   187_B     F   187_B     16   24  128      9   20   51   86  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     D   188_B     D   188_B     16   24  128     10   24   45   83  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     Y   189_B     Y   189_B     16   24  128     10   21   35   71  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     I   190_B     I   190_B     16   24  128     10   20   34   51   78  109  126  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     K   191_B     K   191_B     16   24  128     10   20   35   53   74  109  126  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     R   192_B     R   192_B     16   24  128     10   20   35   51   81  106  126  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     K   193_B     K   193_B     16   24  128     10   15   31   47   63   96  113  135  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     K   194_B     K   194_B     16   24  128      8   14   30   44   54   75  108  129  144  160  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     N   195_B     N   195_B     16   24  128     10   20   34   50   65   96  117  136  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     T   196_B     T   196_B     16   24  128     10   14   27   44   61   85  109  129  147  158  170  178  185  192  197  202  207  211  214  220 
LCS_GDT     L   197_B     L   197_B      4   24  128      3    4    4    8   37   55   72  112  136  153  170  177  185  192  196  201  207  211  215  220 
LCS_GDT     F   198_B     F   198_B      4    6  128      3    4    4    5    5    6   10   10   34   41  126  159  175  185  196  200  206  211  215  220 
LCS_GDT     V   199_B     V   199_B      4    6  128      3    4    4    5    5    6   10   10   17   24   35   57   68  125  144  188  197  205  212  220 
LCS_GDT     V   200_B     V   200_B      4    5  128      3    5    8   21   33   45   66  100  134  145  154  165  179  187  194  199  206  211  215  220 
LCS_GDT     S   201_B     S   201_B      3    5  128      3    5   10   27   44   67   79  102  133  141  152  164  172  180  190  197  203  209  214  220 
LCS_GDT     D   202_B     D   202_B      3    5  128      3    3   13   16   25   36   52   72   80   98  114  137  155  168  177  185  193  199  207  211 
LCS_GDT     I   203_B     I   203_B      3   48  128      3    3   17   27   36   57   73   93  110  130  145  164  171  179  186  197  203  211  215  220 
LCS_GDT     S   204_B     S   204_B     29   58  128      7   32   65   86  101  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     N   205_B     N   205_B     29   58  128      7   30   55   86  100  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     E   206_B     E   206_B     29   58  128      7   32   67   87  101  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     D   207_B     D   207_B     33   58  128     13   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     K   208_B     K   208_B     33   58  128     21   41   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     K   209_B     K   209_B     33   58  128     21   41   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     K   210_B     K   210_B     33   58  128     18   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     I   211_B     I   211_B     33   58  128     11   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     L   212_B     L   212_B     33   58  128     18   38   69   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     Y   213_B     Y   213_B     33   58  128     21   41   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     N   214_B     N   214_B     33   58  128     17   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     S   215_B     S   215_B     33   58  128     11   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     L   216_B     L   216_B     33   58  128     21   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     N   217_B     N   217_B     33   58  128     17   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     L   218_B     L   218_B     33   58  128     17   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     L   219_B     L   219_B     33   58  128     17   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     M   220_B     M   220_B     33   58  128     18   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     R   221_B     R   221_B     33   58  128     17   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     L   222_B     L   222_B     33   58  128     11   40   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     H   223_B     H   223_B     33   58  128      6   38   70   87  101  116  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     N   224_B     N   224_B     33   58  128     20   42   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     A   225_B     A   225_B     33   58  128     13   40   70   87  101  115  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     G   226_B     G   226_B     33   58  128      8   29   69   85   99  115  129  140  152  161  169  178  185  192  198  203  207  211  215  220 
LCS_GDT     L   227_B     L   227_B     33   58  128     13   45   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     T   228_B     T   228_B     33   58  128     17   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     H   229_B     H   229_B     33   58  128      7   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     L   230_B     L   230_B     33   58  128      5   23   71   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     D   231_B     D   231_B     33   58  128      7   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     L   232_B     L   232_B     33   58  128      6   42   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     S   233_B     S   233_B     33   58  128      9   42   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     P   234_B     P   234_B     33   58  128      9   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     D   235_B     D   235_B     33   58  128     17   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     N   236_B     N   236_B     33   58  128     17   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     M   237_B     M   237_B     33   58  128     17   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     L   238_B     L   238_B     33   58  128     17   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     I   239_B     I   239_B     33   58  128     17   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     S   240_B     S   240_B     28   58  128      5   33   70   87  101  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     P   241_B     P   241_B     11   58  128      3   20   54   82   98  110  127  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     K   242_B     K   242_B      9   58  128      3   20   50   81   95  110  127  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     N   243_B     N   243_B      4   58  128      3    5   20   44   62   99  109  126  141  156  168  176  185  192  198  203  207  211  215  220 
LCS_GDT     Y   244_B     Y   244_B      7   58  128      3   15   42   81   97  113  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     E   245_B     E   245_B      7   58  128      9   42   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     M   246_B     M   246_B      8   58  128     17   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     R   247_B     R   247_B      8   58  128     17   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     L   248_B     L   248_B      8   58  128     17   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     C   249_B     C   249_B      8   58  128     10   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     D   250_B     D   250_B      8   58  128      6   37   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     L   251_B     L   251_B      8   58  128      4   18   35   78  101  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     S   252_B     S   252_B      8   58  128      4   13   31   73  101  115  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     Q   253_B     Q   253_B      8   58  128      6   20   46   86  101  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     S   254_B     S   254_B      8   58  128      6   18   48   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     T   255_B     T   255_B      8   58  128      6   30   67   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     P   256_B     P   256_B      8   58  128     21   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     I   257_B     I   257_B      8   58  128      9   44   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     Y   258_B     Y   258_B      8   58  128      6   29   55   83   99  115  129  140  152  161  169  178  185  192  198  203  207  211  215  220 
LCS_GDT     T   259_B     T   259_B      8   58  128     14   44   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     N   260_B     N   260_B      8   58  128     15   46   74   87  103  117  129  141  152  161  169  178  185  192  198  203  207  211  215  220 
LCS_GDT     K   261_B     K   261_B      4   58  128      3    5   41   81  100  111  129  141  152  161  169  178  185  192  198  203  207  211  215  220 
LCS_GDT     L   262_B     L   262_B      4   18  128      3   21   34   63   92  110  128  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     R   263_B     R   263_B      4    6  128      3    3    5    8    9    9   17   23   31  139  152  178  184  191  198  203  207  211  215  220 
LCS_GDT     H   264_B     H   264_B      3    6  128      3    3    4    6    9    9   10   14   34   41   50   74  165  180  190  198  206  209  214  220 
LCS_GDT     K   265_B     K   265_B      3    5  128      3   20   33   47   60   81  112  128  144  160  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     E   266_B     E   266_B      3    5  128      3   19   31   47   54   71   89  120  142  156  169  177  184  191  198  203  207  211  215  220 
LCS_GDT     K   267_B     K   267_B      5    7  128      4    5   27   60   85  109  126  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     L   268_B     L   268_B      5    7  128      4    5   10   32   74  103  122  137  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     N   269_B     N   269_B      5    7  128      4    5    5    8    9    9   11   59   97  131  147  162  171  183  195  202  206  210  214  219 
LCS_GDT     S   270_B     S   270_B      5    7  128      4    5    5    9   16   27   58   93  117  128  146  159  173  181  189  197  204  209  214  218 
LCS_GDT     I   271_B     I   271_B      5    7  128      4    5    5   12   33   43   57   70  100  122  136  155  168  181  188  193  202  209  214  218 
LCS_GDT     K   272_B     K   272_B      4    7  128      3    4    5   10   17   26   37   47   58   88  101  112  137  155  161  175  189  198  204  211 
LCS_GDT     P   273_B     P   273_B      4    7  128      3    4    5    7   12   17   31   44   56   64  101  111  133  148  161  179  189  199  207  211 
LCS_GDT     F   274_B     F   274_B      4   21  128      3    7   17   28   49   68   93  119  139  156  169  177  185  192  198  203  207  211  215  220 
LCS_GDT     E   275_B     E   275_B      3   21  128      3   10   30   48   75  105  123  139  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     S   276_B     S   276_B      3   21  128      7   21   45   84  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     F   277_B     F   277_B      5   21  128      4   11   21   49   84  105  126  139  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     E   278_B     E   278_B      5   21  128      5   18   44   84  101  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     P   279_B     P   279_B      5   21  128      4   15   52   87  101  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     C   280_B     C   280_B      5   21  128      4   18   56   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     I   281_B     I   281_B      5   21  128      3   10   25   57   97  115  128  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     G   282_B     G   282_B     10   21  128      4   16   56   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     K   283_B     K   283_B     11   21  128      9   41   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     I   284_B     I   284_B     11   21  128      8   42   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     E   285_B     E   285_B     11   21  128     14   43   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     Y   286_B     Y   286_B     11   21  128     10   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     I   287_B     I   287_B     11   21  128      9   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     P   288_B     P   288_B     11   21  128     17   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     P   289_B     P   289_B     11   21  128      6   32   71   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     E   290_B     E   290_B     11   21  128      7   32   71   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     C   291_B     C   291_B     11   21  128      7   30   71   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     W   292_B     W   292_B     11   21  128      5   22   56   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     K   293_B     K   293_B     11   21  128      5   18   44   86  101  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     I   294_B     I   294_B     11   21  128      3   18   44   86  101  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     V   295_B     V   295_B      3   21  128      3   13   29   48   75  103  124  139  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     W   296_B     W   296_B      3    4  128      3    3    4    6   11   22   27   32   61   81  102  130  145  163  192  201  206  211  215  220 
LCS_GDT     K   297_B     K   297_B      3    5  128      3    3    4    8   16   23   33   41   56   71   91  114  130  149  166  180  195  205  213  220 
LCS_GDT     Y   298_B     Y   298_B      4    5  128      3    4   19   29   46   53   59   74   97  129  154  169  180  188  195  203  207  211  215  220 
LCS_GDT     K   299_B     K   299_B      4    5  127      3    4    4    5    6    7    8   12   17   20   69   77   89   98  137  155  167  183  190  196 
LCS_GDT     M   300_B     M   300_B      4    7   97      3    4    4    5    6    7    7   10   12   45   53   77   89   98  106  133  145  175  184  188 
LCS_GDT     N   301_B     N   301_B      6    7   30      4    5   15   22   35   45   54   59   68   94  112  130  150  164  176  186  198  205  212  215 
LCS_GDT     N   302_B     N   302_B      6    7   30      4    5    6    6    6    7   41   48   65   82  112  130  136  152  174  186  194  198  203  214 
LCS_GDT     I   303_B     I   303_B      6    7   30      4    5    6    6   10   14   50   69   92  116  143  170  181  189  195  201  206  210  215  220 
LCS_GDT     K   304_B     K   304_B      6    7   19      4    5    6    6    7    9   11   15   23   30   37   49   82  123  146  185  200  205  213  220 
LCS_GDT     N   305_B     N   305_B      6    7   19      3    5    6    6    6    7    8   15   19   22   33   47   83  123  187  197  202  208  214  220 
LCS_GDT     P   306_B     P   306_B      6    7   19      3    4    6    6    6    7    8    9   12   15   21   22   24   27   54   60   64   77  109  154 
LCS_GDT     I   307_B     I   307_B      4    5   44      3    4    4    6    7   10   13   16   18   20   21   22   40   45  161  177  185  198  202  215 
LCS_GDT     E   308_B     E   308_B      4    5   44      3    4    4    5    8   10   13   16   18   70   85  148  151  169  179  192  202  208  214  220 
LCS_GDT     Y   309_B     Y   309_B      4    5   44      3    4    4   10   11   16   31   48   97  156  168  178  185  192  198  203  207  211  215  220 
LCS_GDT     L   310_B     L   310_B      4    5   44      3    4    4    5    6    7    9   14   18   20   45   53  114  158  165  177  198  207  214  220 
LCS_GDT     K   311_B     K   311_B      4    5   44      3    4    5    8   12   17   41   82  125  130  145  160  169  180  189  193  201  207  213  220 
LCS_GDT     N   312_B     N   312_B      4    5   44      3    4   39   80   98  110  126  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     I   313_B     I   313_B      5    5   44      3    5    5   14   35   85  117  139  151  160  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     S   314_B     S   314_B      5    5   44      5   16   35   51   73  102  123  139  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     N   315_B     N   315_B      5    5   44      4    5   10   15   26   45   88  125  142  159  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     Q   316_B     Q   316_B      5    5   44      4    5   13   36   65   95  115  135  147  159  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     E   317_B     E   317_B      5    6   44      4    6   12   20   38   58   95  129  147  157  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     E   318_B     E   318_B      5    6   44      4    5    5   10   13   32   42   87  102  137  144  166  182  191  198  203  207  211  215  220 
LCS_GDT     R   319_B     R   319_B      5    6   44      4    5   19   52   93  110  128  140  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     K   320_B     K   320_B      5   25   44      4    5   19   30   55   92  114  130  146  156  169  176  185  192  198  203  207  211  215  220 
LCS_GDT     K   321_B     K   321_B      5   26   44      4    5    9   14   27   33   61   80   99  130  140  168  182  191  198  203  207  211  215  220 
LCS_GDT     Y   322_B     Y   322_B      5   27   44      3    5    5    8   29   54   83  125  143  155  168  178  185  192  198  203  207  211  215  220 
LCS_GDT     Y   323_B     Y   323_B      4   27   44      3    3    7   32   66  103  121  136  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     Y   324_B     Y   324_B      6   27   44      3    5    9   23   39   67  100  135  147  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     D   325_B     D   325_B      6   27   44      3    5   16   58   85  106  128  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     V   326_B     V   326_B     18   27   44      3    5   10   22   66  100  121  133  149  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     S   327_B     S   327_B     20   27   44      9   27   52   86  100  114  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     C   328_B     C   328_B     20   27   44     21   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     A   329_B     A   329_B     20   27   44     21   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     D   330_B     D   330_B     20   27   44     21   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     K   331_B     K   331_B     20   27   44     21   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     Y   332_B     Y   332_B     20   27   44     21   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     M   333_B     M   333_B     20   27   44     21   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     L   334_B     L   334_B     20   27   44     21   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     G   335_B     G   335_B     20   27   44     21   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     I   336_B     I   336_B     20   27   44     21   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     F   337_B     F   337_B     20   27   44     21   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     F   338_B     F   338_B     20   27   44     21   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     I   339_B     I   339_B     20   27   44     21   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     W   340_B     W   340_B     20   27   44     21   41   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     M   341_B     M   341_B     20   27   44     21   38   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     W   342_B     W   342_B     20   27   44     21   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     N   343_B     N   343_B     20   27   44     19   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     N   344_B     N   344_B     20   27   44      3   31   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     G   345_B     G   345_B     20   27   44      7   38   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     F   346_B     F   346_B     20   27   44      4   31   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     I   347_B     I   347_B     20   27   44      3   13   42   82  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     W   348_B     W   348_B     16   27   44      3   27   62   86  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     K   349_B     K   349_B      6   26   44      3    5   32   57   88  112  124  140  152  161  169  178  185  192  198  203  207  211  215  220 
LCS_GDT     C   350_B     C   350_B      4   26   44      3   16   45   67   85  106  123  136  149  158  169  176  185  192  198  203  207  211  215  220 
LCS_GDT     S   351_B     S   351_B      5    7   44      3    5    5    8   12   27   38   53   94  115  130  152  172  178  188  193  200  208  215  220 
LCS_GDT     D   352_B     D   352_B      5    7   42      3    5    5    6    9   12   18   43   66   88   99  117  129  141  157  170  180  189  203  207 
LCS_GDT     P   353_B     P   353_B      5    7   42      3    4    5    6    8   11   15   19   26   54   68   83  100  115  123  133  153  165  180  189 
LCS_GDT     I   354_B     I   354_B      5    7   20      3    4    5    6    8   11   13   16   20   25   37   44   55   65   77   96  112  125  139  156 
LCS_GDT     Q   355_B     Q   355_B      5    7   57      3    4    5    6    8   11   17   20   26   34   41   59   72   82   97  116  133  157  168  184 
LCS_GDT     D   356_B     D   356_B      3    6   57      3    3    3    5    6    9   16   22   26   53   61   86  103  124  134  141  156  175  188  194 
LCS_GDT     K   357_B     K   357_B      3    4   57      3    5    5    6    7    9   16   22   43   88   99  107  123  139  146  161  179  189  195  206 
LCS_GDT     I   358_B     I   358_B      3    4   57      3    5   12   25   42   56   76   96  110  121  138  152  167  173  186  195  201  208  215  220 
LCS_GDT     F   359_B     F   359_B      3    4   57      3    3    4    6   11   26   34   53   75  117  130  152  163  178  185  192  200  208  215  220 
LCS_GDT     E   360_B     E   360_B      3    4   57      3    3    5   12   19   26   39   63   89  102  116  134  147  169  176  187  196  204  213  219 
LCS_GDT     I   361_B     I   361_B      3    4   57      3    4    7   15   26   37   51   66   89  106  128  147  162  176  190  197  203  209  215  220 
LCS_GDT     F   362_B     F   362_B      3    4   57      3    3    4    5    8   10   14   20   27   59   76   93  132  146  161  178  191  201  212  219 
LCS_GDT     M   363_B     M   363_B      3    4   57      3    3    3    5    8   25   31   45   60   92  106  121  134  153  171  191  200  208  213  220 
LCS_GDT     K   364_B     K   364_B      3    4   57      3    3    3    4    5    6   14   22   39   67   99  122  135  160  184  197  203  209  215  220 
LCS_GDT     S   365_B     S   365_B      3    6   57      3    3    4    7   10   13   24   41   78   93  107  135  152  169  180  195  201  209  215  220 
LCS_GDT     N   366_B     N   366_B      4    6   57      3    4    4   10   17   23   41   55   65   99  111  134  153  160  172  187  194  207  213  220 
LCS_GDT     M   367_B     M   367_B      4    6   57      3   10   11   11   12   20   53   78  106  118  139  147  163  178  189  197  203  209  215  220 
LCS_GDT     D   368_B     D   368_B      4    6   57      3   11   25   33   44   60   72   92  117  135  154  168  178  189  195  202  207  211  215  220 
LCS_GDT     L   369_B     L   369_B      4    6   57      3    6   16   43   67   89  105  125  142  155  169  178  185  192  198  203  207  211  215  220 
LCS_GDT     N   370_B     N   370_B      3    6   57      3    3    4   15   36   66   97  118  134  152  168  178  185  192  198  203  207  211  215  220 
LCS_GDT     K   371_B     K   371_B      3    5   57      3    3    8   16   34   61   87  110  130  143  158  175  183  191  198  203  207  211  215  220 
LCS_GDT     F   372_B     F   372_B      4   21   57      4    6   20   38   50   68   89  128  134  145  155  175  183  191  198  203  207  211  215  220 
LCS_GDT     I   373_B     I   373_B      4   21   57      5   18   28   42   62   92  109  128  136  151  164  175  183  191  198  203  207  211  215  220 
LCS_GDT     M   374_B     M   374_B      4   21   57      4    6   14   43   77  101  118  129  138  151  166  175  183  191  198  203  207  211  215  220 
LCS_GDT     T   375_B     T   375_B      4   21   57      4    8   17   27   39   65   88  128  134  145  159  175  183  191  198  203  207  211  215  220 
LCS_GDT     K   376_B     K   376_B      3   21   57      3    3    5    7   14   25   31   51   85  104  129  138  152  160  181  187  197  206  213  218 
LCS_GDT     S   377_B     S   377_B     16   21   57      4   12   24   38   50   68   89  128  134  145  164  175  183  191  198  203  207  211  215  220 
LCS_GDT     W   378_B     W   378_B     16   21   57      5   18   28   43   82  102  117  130  147  156  168  176  185  192  198  203  207  211  215  220 
LCS_GDT     P   379_B     P   379_B     16   21   57      9   23   53   86  100  113  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     H   380_B     H   380_B     16   21   57      9   29   63   86  100  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     E   381_B     E   381_B     16   21   57      9   26   68   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     L   382_B     L   382_B     16   21   57      9   30   73   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     N   383_B     N   383_B     16   21   57      9   42   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     N   384_B     N   384_B     16   21   57      9   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     L   385_B     L   385_B     16   21   57      9   39   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     I   386_B     I   386_B     16   21   57     10   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     N   387_B     N   387_B     16   21   57     10   41   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     K   388_B     K   388_B     16   21   57     18   40   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     L   389_B     L   389_B     16   21   57     20   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     L   390_B     L   390_B     16   21   57     11   42   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     H   391_B     H   391_B     16   21   57     21   46   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     M   392_B     M   392_B     16   21   57      4   12   29   56   86  100  120  135  147  155  166  176  185  192  198  203  207  211  215  220 
LCS_GDT     E   393_B     E   393_B      5   19   57      4   12   28   61   82  112  125  135  147  157  169  178  185  192  198  203  207  211  215  220 
LCS_GDT     H   394_B     H   394_B      5   17   57      4    5    7   20   36   57   77  110  131  151  169  178  185  192  198  203  207  211  215  220 
LCS_GDT     R   395_B     R   395_B      5    7   57      4    5    9   13   37   61   97  120  140  154  169  178  185  192  198  203  207  211  215  220 
LCS_GDT     K   396_B     K   396_B      5   15   57      4   11   23   59   91  106  122  134  147  157  166  175  185  192  198  203  207  211  215  220 
LCS_GDT     T   397_B     T   397_B     11   15   57      6   12   13   14   45   62   88  110  133  146  160  175  183  191  198  203  207  211  215  220 
LCS_GDT     V   398_B     V   398_B     11   15   57      6   12   29   49   89  112  125  140  152  161  169  178  185  192  198  203  207  211  215  220 
LCS_GDT     K   399_B     K   399_B     11   15   57      6   12   32   64   94  115  129  140  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     L   400_B     L   400_B     11   15   57      6   36   74   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     S   401_B     S   401_B     11   15   57      6   29   61   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     D   402_B     D   402_B     11   15   57      9   18   50   85  101  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     L   403_B     L   403_B     11   15   57      6   30   73   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     S   404_B     S   404_B     11   15   57      6   15   61   87  103  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     R   405_B     R   405_B     11   15   57      6   15   38   65   98  115  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     H   406_B     H   406_B     11   15   57      6   16   38   80   98  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     P   407_B     P   407_B     11   15   57      5   16   39   80  100  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     W   408_B     W   408_B     11   15   57      5   16   42   70   98  117  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     W   409_B     W   409_B      7   15   57      5   12   38   67   98  115  128  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     S   410_B     S   410_B      7   15   57      5   15   31   56   91  111  126  140  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_GDT     S   411_B     S   411_B      7   15   57      2    8   31   63   97  115  129  141  152  161  170  178  185  192  198  203  207  211  215  220 
LCS_AVERAGE  LCS_A:  10.14  (   3.07    6.14   21.20 )

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     21     46     74     87    103    117    129    141    152    161    170    178    185    192    198    203    207    211    215    220 
GDT PERCENT_AT   5.54  12.14  19.53  22.96  27.18  30.87  34.04  37.20  40.11  42.48  44.85  46.97  48.81  50.66  52.24  53.56  54.62  55.67  56.73  58.05
GDT RMS_LOCAL    0.32   0.75   1.00   1.17   1.53   1.77   1.95   2.24   2.45   2.69   3.03   3.18   3.36   3.55   3.81   4.01   4.13   4.30   4.68   4.79
GDT RMS_ALL_AT  10.80  10.77  10.80  10.72  10.47  10.35  10.46  10.41  10.34  10.27  10.24  10.26  10.16  10.23  10.25  10.30  10.30  10.27  10.45  10.38

# Checking swapping
#   possible swapping detected:  F   119_B      F   119_B
#   possible swapping detected:  E   122_B      E   122_B
#   possible swapping detected:  Y   123_B      Y   123_B
#   possible swapping detected:  F   131_B      F   131_B
#   possible swapping detected:  Y   136_B      Y   136_B
#   possible swapping detected:  D   155_B      D   155_B
#   possible swapping detected:  F   181_B      F   181_B
#   possible swapping detected:  F   182_B      F   182_B
#   possible swapping detected:  E   184_B      E   184_B
#   possible swapping detected:  E   206_B      E   206_B
#   possible swapping detected:  D   231_B      D   231_B
#   possible swapping detected:  E   245_B      E   245_B
#   possible swapping detected:  E   266_B      E   266_B
#   possible swapping detected:  F   274_B      F   274_B
#   possible swapping detected:  E   275_B      E   275_B
#   possible swapping detected:  E   290_B      E   290_B
#   possible swapping detected:  Y   298_B      Y   298_B
#   possible swapping detected:  Y   309_B      Y   309_B
#   possible swapping detected:  Y   322_B      Y   322_B
#   possible swapping detected:  Y   324_B      Y   324_B
#   possible swapping detected:  D   352_B      D   352_B
#   possible swapping detected:  D   356_B      D   356_B
#   possible swapping detected:  F   359_B      F   359_B
#   possible swapping detected:  F   362_B      F   362_B
#   possible swapping detected:  F   372_B      F   372_B
#   possible swapping detected:  E   381_B      E   381_B

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    E   108_B      E   108_B    10.310     0    0.489   1.287    15.096    2.976    1.323
LGA    N   109_B      N   109_B     5.875     0    0.581   1.000     8.066   24.286   17.381
LGA    Y   110_B      Y   110_B     2.042     0    0.038   1.360     6.731   59.167   49.603
LGA    V   111_B      V   111_B     5.774     0    0.034   0.056     8.959   25.119   16.463
LGA    M   112_B      M   112_B     6.747     0    0.064   0.945    13.117   20.714   10.952
LGA    E   113_B      E   113_B     4.282     0    0.029   1.077     9.055   43.929   24.444
LGA    A   114_B      A   114_B     2.028     0    0.021   0.028     3.606   68.810   63.714
LGA    V   115_B      V   115_B     4.797     0    0.069   0.166     8.003   34.405   22.789
LGA    S   116_B      S   116_B     6.529     0    0.121   0.172     9.007   18.571   13.810
LGA    L   117_B      L   117_B     4.820     0    0.028   0.092     9.041   37.262   24.226
LGA    A   118_B      A   118_B     1.572     0    0.029   0.038     2.788   72.857   69.714
LGA    F   119_B      F   119_B     4.889     0    0.505   1.366    14.179   30.000   12.294
LGA    L   120_B      L   120_B     8.553     0    0.622   0.673    11.905    4.048    3.333
LGA    N   121_B      N   121_B    12.867     0    0.229   1.005    15.553    0.000    0.000
LGA    E   122_B      E   122_B    12.620     0    0.625   1.377    13.909    0.000    0.000
LGA    Y   123_B      Y   123_B    15.515     0    0.154   1.046    16.977    0.000    0.000
LGA    Y   124_B      Y   124_B    17.788     0    0.074   1.470    19.249    0.000    0.000
LGA    P   125_B      P   125_B    17.160     0    0.308   0.539    18.067    0.000    0.000
LGA    G   126_B      G   126_B    19.099     0    0.109   0.109    19.099    0.000    0.000
LGA    I   127_B      I   127_B    14.695     0    0.598   0.658    15.895    0.000    0.000
LGA    T   128_B      T   128_B    11.216     0    0.119   1.031    12.162    0.000    0.680
LGA    P   129_B      P   129_B    12.165     0    0.488   0.555    12.539    0.357    0.204
LGA    K   130_B      K   130_B    10.872     0    0.678   1.017    14.877    0.000    0.000
LGA    F   131_B      F   131_B    13.815     0    0.577   1.123    17.669    0.000    0.000
LGA    Y   132_B      Y   132_B    16.338     0    0.634   1.370    18.309    0.000    0.000
LGA    K   133_B      K   133_B    16.831     0    0.511   0.831    25.303    0.000    0.000
LGA    I   134_B      I   134_B    16.020     0    0.112   1.030    17.748    0.000    0.000
LGA    L   135_B      L   135_B    17.403     0    0.069   1.397    17.813    0.000    0.000
LGA    Y   136_B      Y   136_B    18.644     0    0.093   0.300    26.546    0.000    0.000
LGA    E   137_B      E   137_B    23.332     0    0.662   0.986    26.291    0.000    0.000
LGA    S   138_B      S   138_B    25.193     0    0.660   0.751    25.392    0.000    0.000
LGA    D   139_B      D   139_B    27.201     3    0.337   0.349    30.026    0.000    0.000
LGA    Y   151_B      Y   151_B    20.016     7    0.057   0.055    21.040    0.000    0.000
LGA    K   152_B      K   152_B    22.582     4    0.474   0.439    25.155    0.000    0.000
LGA    F   153_B      F   153_B    22.282     6    0.137   0.146    22.298    0.000    0.000
LGA    Q   154_B      Q   154_B    23.298     3    0.565   0.727    24.506    0.000    0.000
LGA    D   155_B      D   155_B    20.252     0    0.092   1.056    20.905    0.000    0.000
LGA    L   156_B      L   156_B    18.168     0    0.159   0.346    19.327    0.000    0.000
LGA    N   157_B      N   157_B    21.909     0    0.575   0.695    24.621    0.000    0.000
LGA    E   158_B      E   158_B    25.599     4    0.574   0.559    27.705    0.000    0.000
LGA    L   159_B      L   159_B    23.138     0    0.537   0.529    24.386    0.000    0.000
LGA    N   160_B      N   160_B    25.721     0    0.607   0.947    26.741    0.000    0.000
LGA    D   161_B      D   161_B    30.316     0    0.548   0.678    35.063    0.000    0.000
LGA    I   162_B      I   162_B    27.886     0    0.535   0.548    28.608    0.000    0.000
LGA    L   163_B      L   163_B    27.771     0    0.634   0.544    28.671    0.000    0.000
LGA    T   164_B      T   164_B    29.756     0    0.588   1.362    32.977    0.000    0.000
LGA    K   165_B      K   165_B    30.895     4    0.581   0.579    31.037    0.000    0.000
LGA    K   166_B      K   166_B    29.334     2    0.110   0.204    33.215    0.000    0.000
LGA    L   167_B      L   167_B    25.835     0    0.377   0.525    27.456    0.000    0.000
LGA    E   168_B      E   168_B    25.335     4    0.201   0.195    26.056    0.000    0.000
LGA    N   169_B      N   169_B    27.382     0    0.293   0.299    34.036    0.000    0.000
LGA    N   170_B      N   170_B    22.722     3    0.364   0.338    24.397    0.000    0.000
LGA    I   171_B      I   171_B    18.435     0    0.146   0.729    21.274    0.000    0.000
LGA    N   172_B      N   172_B    14.007     3    0.185   0.299    15.264    0.000    0.000
LGA    G   173_B      G   173_B     9.291     0    0.199   0.199    10.929    3.333    3.333
LGA    N   174_B      N   174_B     6.398     0    0.412   1.077     7.101   16.429   22.202
LGA    I   175_B      I   175_B     6.715     0    0.059   0.974     8.904   15.238   12.976
LGA    V   176_B      V   176_B     5.935     0    0.054   0.114     6.808   20.357   19.048
LGA    L   177_B      L   177_B     4.809     0    0.029   1.341     6.330   32.976   31.905
LGA    I   178_B      I   178_B     3.775     0    0.073   0.128     4.171   45.119   45.060
LGA    S   179_B      S   179_B     2.850     0    0.068   0.659     5.098   55.357   50.794
LGA    E   180_B      E   180_B     2.641     0    0.054   1.120     4.351   55.357   52.646
LGA    F   181_B      F   181_B     2.559     0    0.090   1.329     5.260   59.048   54.892
LGA    F   182_B      F   182_B     3.230     0    0.145   1.044    11.275   50.119   23.766
LGA    G   183_B      G   183_B     2.578     0    0.395   0.395     3.786   53.690   53.690
LGA    E   184_B      E   184_B     2.078     0    0.032   0.737     3.354   79.762   64.021
LGA    N   185_B      N   185_B     0.637     0    0.077   0.989     2.050   83.810   82.917
LGA    V   186_B      V   186_B     1.170     0    0.030   0.074     2.012   77.381   80.544
LGA    F   187_B      F   187_B     2.016     6    0.089   0.082     2.704   64.881   29.481
LGA    D   188_B      D   188_B     2.224     0    0.060   0.368     3.237   64.881   62.024
LGA    Y   189_B      Y   189_B     2.801     0    0.034   0.221     5.279   53.810   45.635
LGA    I   190_B      I   190_B     3.778     0    0.041   0.084     4.874   40.476   42.083
LGA    K   191_B      K   191_B     3.984     4    0.117   0.124     4.574   38.810   22.063
LGA    R   192_B      R   192_B     4.386     0    0.066   0.202     5.080   32.976   35.758
LGA    K   193_B      K   193_B     5.718     4    0.030   0.050     6.986   20.833   11.640
LGA    K   194_B      K   194_B     6.463     4    0.051   0.073     7.075   15.476    8.783
LGA    N   195_B      N   195_B     5.867     0    0.227   1.180     7.622   15.833   28.631
LGA    T   196_B      T   196_B     7.223     2    0.622   0.560     8.090   10.476    7.891
LGA    L   197_B      L   197_B     7.459     3    0.352   0.404     7.833    9.286    5.893
LGA    F   198_B      F   198_B     8.446     6    0.320   0.346    10.258    3.333    1.342
LGA    V   199_B      V   199_B    10.790     2    0.282   0.264    12.109    1.071    0.612
LGA    V   200_B      V   200_B     9.163     2    0.016   0.040    10.232    0.833    0.544
LGA    S   201_B      S   201_B    10.202     1    0.110   0.160    10.794    0.119    0.317
LGA    D   202_B      D   202_B    12.611     3    0.606   0.619    14.595    0.000    0.000
LGA    I   203_B      I   203_B     9.554     0    0.581   0.478    12.886    3.095    1.905
LGA    S   204_B      S   204_B     3.445     0    0.664   0.933     5.126   51.548   54.841
LGA    N   205_B      N   205_B     3.266     0    0.015   0.183     5.177   55.476   46.488
LGA    E   206_B      E   206_B     2.428     0    0.041   0.411     4.582   66.905   53.968
LGA    D   207_B      D   207_B     1.449     0    0.019   0.463     2.042   79.524   76.250
LGA    K   208_B      K   208_B     1.461     0    0.068   0.915     5.632   77.143   64.180
LGA    K   209_B      K   209_B     1.599     4    0.030   0.034     1.866   77.143   42.381
LGA    K   210_B      K   210_B     0.763     4    0.046   0.047     1.027   88.214   49.259
LGA    I   211_B      I   211_B     0.762     0    0.029   0.651     2.466   85.952   85.060
LGA    L   212_B      L   212_B     1.776     0    0.084   1.202     5.834   75.000   62.619
LGA    Y   213_B      Y   213_B     1.270     0    0.079   1.377     8.770   79.286   51.865
LGA    N   214_B      N   214_B     0.649     0    0.131   0.652     2.321   88.214   85.000
LGA    S   215_B      S   215_B     1.150     0    0.032   0.575     1.475   83.690   82.937
LGA    L   216_B      L   216_B     1.308     0    0.056   1.155     3.734   81.429   75.595
LGA    N   217_B      N   217_B     0.977     0    0.021   0.984     4.769   88.214   69.881
LGA    L   218_B      L   218_B     1.227     3    0.021   0.029     1.572   81.429   49.821
LGA    L   219_B      L   219_B     1.192     0    0.160   0.983     4.134   77.262   70.655
LGA    M   220_B      M   220_B     1.393     0    0.069   0.168     1.745   79.286   80.357
LGA    R   221_B      R   221_B     1.314     0    0.042   1.139     4.972   77.143   69.567
LGA    L   222_B      L   222_B     2.370     0    0.040   1.391     4.623   61.190   59.940
LGA    H   223_B      H   223_B     2.884     0    0.012   1.503     7.395   55.357   41.524
LGA    N   224_B      N   224_B     2.503     0    0.069   0.121     2.768   59.048   62.917
LGA    A   225_B      A   225_B     3.142     0    0.100   0.101     3.638   50.119   51.524
LGA    G   226_B      G   226_B     3.750     0    0.051   0.051     3.750   46.667   46.667
LGA    L   227_B      L   227_B     2.265     0    0.050   0.109     3.370   66.905   61.190
LGA    T   228_B      T   228_B     1.427     0    0.086   1.226     3.352   77.143   73.265
LGA    H   229_B      H   229_B     1.088     0    0.511   0.447     3.062   78.095   71.286
LGA    L   230_B      L   230_B     1.381     0    0.123   1.054     5.185   83.810   70.536
LGA    D   231_B      D   231_B     0.276     0    0.070   0.269     2.170   92.857   86.190
LGA    L   232_B      L   232_B     1.153     3    0.300   0.360     2.190   79.524   49.940
LGA    S   233_B      S   233_B     1.113     0    0.022   0.054     1.166   85.952   84.444
LGA    P   234_B      P   234_B     0.861     0    0.047   0.219     1.848   88.214   82.857
LGA    D   235_B      D   235_B     0.671     0    0.043   0.480     1.914   92.857   89.464
LGA    N   236_B      N   236_B     0.538     0    0.026   0.749     2.963   92.857   82.083
LGA    M   237_B      M   237_B     0.645     3    0.020   0.026     0.848   90.476   56.548
LGA    L   238_B      L   238_B     0.620     0    0.084   0.210     1.227   92.857   88.274
LGA    I   239_B      I   239_B     0.548     0    0.092   1.139     2.739   88.333   81.905
LGA    S   240_B      S   240_B     2.726     1    0.121   0.165     3.086   55.476   46.508
LGA    P   241_B      P   241_B     3.993     0    0.126   0.309     4.760   38.810   37.347
LGA    K   242_B      K   242_B     4.068     4    0.555   0.504     4.453   38.690   21.323
LGA    N   243_B      N   243_B     6.273     3    0.257   0.244     7.476   26.786   14.643
LGA    Y   244_B      Y   244_B     3.523     0    0.197   0.270     8.399   52.500   29.881
LGA    E   245_B      E   245_B     1.516     0    0.038   0.904     4.196   75.119   65.608
LGA    M   246_B      M   246_B     0.967     0    0.132   1.058     2.480   83.810   78.512
LGA    R   247_B      R   247_B     0.826     0    0.030   0.886     3.213   90.476   83.506
LGA    L   248_B      L   248_B     0.770     0    0.074   1.389     3.707   88.214   73.393
LGA    C   249_B      C   249_B     0.692     0    0.100   0.659     2.111   81.786   83.175
LGA    D   250_B      D   250_B     1.461     0    0.533   0.753     2.991   77.262   69.167
LGA    L   251_B      L   251_B     2.949     0    0.256   1.233     6.189   59.048   52.440
LGA    S   252_B      S   252_B     3.186     0    0.119   0.133     3.520   48.333   48.889
LGA    Q   253_B      Q   253_B     2.692     0    0.058   0.758     5.919   57.143   48.624
LGA    S   254_B      S   254_B     2.423     0    0.069   0.612     3.326   57.262   56.032
LGA    T   255_B      T   255_B     1.634     0    0.056   1.183     3.246   75.119   69.728
LGA    P   256_B      P   256_B     1.422     0    0.104   0.154     1.509   83.690   81.497
LGA    I   257_B      I   257_B     2.092     0    0.327   0.429     4.154   61.190   55.774
LGA    Y   258_B      Y   258_B     4.116     0    0.065   0.214    10.783   46.786   19.603
LGA    T   259_B      T   259_B     1.631     0    0.042   1.051     2.992   65.000   67.483
LGA    N   260_B      N   260_B     2.156     0    0.613   1.184     5.458   63.095   51.488
LGA    K   261_B      K   261_B     3.395     0    0.655   1.045    12.559   51.905   26.561
LGA    L   262_B      L   262_B     4.449     0    0.582   0.773     7.983   34.405   24.167
LGA    R   263_B      R   263_B     8.233     0    0.354   1.264    14.770    5.000    2.078
LGA    H   264_B      H   264_B    10.245     0    0.069   0.200    17.416    0.833    0.333
LGA    K   265_B      K   265_B     7.689     2    0.034   0.432     9.366    5.476    3.069
LGA    E   266_B      E   266_B     9.443     0    0.626   1.150    15.897    2.619    1.164
LGA    K   267_B      K   267_B     4.652     4    0.372   0.400     6.003   27.857   17.937
LGA    L   268_B      L   268_B     6.043     0    0.071   1.181     9.130   16.667   13.333
LGA    N   269_B      N   269_B    10.465     0    0.145   0.934    12.770    0.714    0.357
LGA    S   270_B      S   270_B    11.916     0    0.368   0.509    13.122    0.000    0.000
LGA    I   271_B      I   271_B    12.576     0    0.613   1.163    16.612    0.000    0.000
LGA    K   272_B      K   272_B    15.372     0    0.047   1.105    20.585    0.000    0.000
LGA    P   273_B      P   273_B    14.050     0    0.527   0.579    18.665    0.000    0.000
LGA    F   274_B      F   274_B     8.055     0    0.637   1.370    10.186    7.857    7.273
LGA    E   275_B      E   275_B     5.479     0    0.131   0.738     6.507   30.952   25.820
LGA    S   276_B      S   276_B     2.341     0    0.082   0.790     6.428   40.595   41.587
LGA    F   277_B      F   277_B     5.003     0    0.685   0.773     8.969   40.714   20.043
LGA    E   278_B      E   278_B     3.059     0    0.054   1.433     7.099   50.119   42.116
LGA    P   279_B      P   279_B     2.556     0    0.080   0.289     2.763   57.143   60.408
LGA    C   280_B      C   280_B     2.401     0    0.544   0.861     4.086   59.167   56.429
LGA    I   281_B      I   281_B     3.845     0    0.645   1.338     9.896   43.690   32.679
LGA    G   282_B      G   282_B     2.009     0    0.277   0.277     2.009   70.833   70.833
LGA    K   283_B      K   283_B     1.235     0    0.112   0.659     1.831   86.190   87.725
LGA    I   284_B      I   284_B     0.743     0    0.101   0.470     2.323   90.476   83.929
LGA    E   285_B      E   285_B     0.695     0    0.076   0.158     1.587   90.476   84.497
LGA    Y   286_B      Y   286_B     0.546     0    0.023   0.152     2.178   95.238   83.254
LGA    I   287_B      I   287_B     0.666     0    0.048   0.654     3.830   97.619   87.024
LGA    P   288_B      P   288_B     0.909     0    0.058   0.213     1.516   95.238   88.095
LGA    P   289_B      P   289_B     1.309     0    0.081   0.330     2.027   81.429   76.599
LGA    E   290_B      E   290_B     1.176     0    0.031   0.219     1.545   81.429   82.487
LGA    C   291_B      C   291_B     1.089     0    0.139   0.257     2.307   75.119   78.730
LGA    W   292_B      W   292_B     2.282     0    0.222   1.376     5.818   62.976   55.578
LGA    K   293_B      K   293_B     3.327     4    0.261   0.255     3.327   51.786   28.571
LGA    I   294_B      I   294_B     3.283     0    0.574   0.975     6.103   43.452   47.917
LGA    V   295_B      V   295_B     5.643     0    0.407   0.588     8.111   18.214   13.946
LGA    W   296_B      W   296_B    11.992     0    0.073   1.446    17.211    0.119    0.034
LGA    K   297_B      K   297_B    14.043     4    0.228   0.251    14.450    0.000    0.000
LGA    Y   298_B      Y   298_B    11.239     0    0.381   1.138    14.330    0.000    7.460
LGA    K   299_B      K   299_B    18.096     4    0.285   0.289    20.982    0.000    0.000
LGA    M   300_B      M   300_B    21.026     0    0.372   0.644    28.784    0.000    0.000
LGA    N   301_B      N   301_B    15.286     0    0.113   0.141    17.096    0.000    0.000
LGA    N   302_B      N   302_B    16.717     0    0.073   0.807    22.052    0.000    0.000
LGA    I   303_B      I   303_B    12.040     0    0.158   0.248    13.705    0.000    0.060
LGA    K   304_B      K   304_B    13.565     0    0.184   0.745    21.524    0.000    0.000
LGA    N   305_B      N   305_B    10.575     0    0.169   1.087    11.869    1.190    1.369
LGA    P   306_B      P   306_B    12.905     0    0.054   0.261    14.545    0.000    0.000
LGA    I   307_B      I   307_B    11.528     0    0.584   0.757    12.934    0.357    0.179
LGA    E   308_B      E   308_B     8.991     0    0.584   1.085    14.430    6.548    2.910
LGA    Y   309_B      Y   309_B     6.551     0    0.543   1.442     9.839   11.667    7.302
LGA    L   310_B      L   310_B     9.291     0    0.217   0.209    14.672    2.976    1.488
LGA    K   311_B      K   311_B     8.437     4    0.372   0.362     9.681   12.024    5.397
LGA    N   312_B      N   312_B     3.573     3    0.230   0.226     5.277   31.786   22.143
LGA    I   313_B      I   313_B     6.663     0    0.175   0.604     9.815   23.095   12.440
LGA    S   314_B      S   314_B     6.694     0    0.560   0.773     9.171   11.667    9.683
LGA    N   315_B      N   315_B     8.548     0    0.571   0.473    10.210    3.452    2.202
LGA    Q   316_B      Q   316_B     8.002     0    0.434   0.677     9.944    5.357    3.069
LGA    E   317_B      E   317_B     8.214     0    0.076   1.109    10.067    4.762    3.280
LGA    E   318_B      E   318_B     9.378     0    0.422   1.227    15.991    4.048    1.799
LGA    R   319_B      R   319_B     3.764     0    0.108   1.030     8.874   37.500   30.260
LGA    K   320_B      K   320_B     8.102     0    0.000   0.688    17.264    7.857    3.492
LGA    K   321_B      K   321_B     9.634     0    0.644   0.920    17.734    4.405    1.958
LGA    Y   322_B      Y   322_B     6.142     0    0.508   1.349    16.458   17.500    6.468
LGA    Y   323_B      Y   323_B     4.686     0    0.265   0.374     5.842   26.310   40.556
LGA    Y   324_B      Y   324_B     5.738     0    0.170   1.102     6.525   25.000   28.810
LGA    D   325_B      D   325_B     3.801     0    0.083   0.939     4.721   42.024   50.774
LGA    V   326_B      V   326_B     4.709     0    0.038   1.268     7.896   37.262   27.279
LGA    S   327_B      S   327_B     3.159     0    0.046   0.199     3.455   53.571   54.841
LGA    C   328_B      C   328_B     1.125     0    0.085   0.181     1.365   85.952   84.444
LGA    A   329_B      A   329_B     0.922     0    0.043   0.051     1.115   88.214   86.857
LGA    D   330_B      D   330_B     1.305     0    0.108   0.690     1.651   81.429   81.488
LGA    K   331_B      K   331_B     1.259     0    0.030   1.003     3.567   81.429   75.291
LGA    Y   332_B      Y   332_B     1.092     0    0.062   0.227     2.576   83.690   75.952
LGA    M   333_B      M   333_B     0.938     0    0.077   0.177     1.221   88.214   89.345
LGA    L   334_B      L   334_B     0.950     0    0.056   0.080     1.546   90.476   84.881
LGA    G   335_B      G   335_B     1.134     0    0.054   0.054     1.134   81.429   81.429
LGA    I   336_B      I   336_B     1.174     0    0.056   0.665     3.014   81.429   76.429
LGA    F   337_B      F   337_B     1.271     0    0.019   0.327     1.810   81.429   79.870
LGA    F   338_B      F   338_B     1.239     0    0.038   0.583     2.018   81.429   81.602
LGA    I   339_B      I   339_B     1.510     0    0.060   0.136     1.973   75.000   73.929
LGA    W   340_B      W   340_B     1.967     0    0.015   1.112     5.153   68.810   58.129
LGA    M   341_B      M   341_B     1.873     0    0.039   0.782     4.165   72.857   68.393
LGA    W   342_B      W   342_B     1.720     0    0.108   1.409     5.811   77.143   58.333
LGA    N   343_B      N   343_B     1.399     0    0.043   0.225     1.638   79.286   79.286
LGA    N   344_B      N   344_B     1.395     0    0.531   1.043     3.841   69.762   71.488
LGA    G   345_B      G   345_B     0.412     0    0.046   0.046     1.205   92.976   92.976
LGA    F   346_B      F   346_B     0.827     0    0.091   1.048     5.311   85.952   62.641
LGA    I   347_B      I   347_B     2.048     0    0.536   1.001     4.817   66.905   61.845
LGA    W   348_B      W   348_B     2.101     0    0.699   1.279     4.819   54.762   54.864
LGA    K   349_B      K   349_B     4.720     0    0.210   0.515     8.521   31.905   22.063
LGA    C   350_B      C   350_B     5.249     0    0.062   0.873     8.418   19.524   22.619
LGA    S   351_B      S   351_B    11.367     0    0.377   0.668    13.382    0.714    0.476
LGA    D   352_B      D   352_B    15.782     0    0.057   1.115    19.688    0.000    0.000
LGA    P   353_B      P   353_B    20.956     0    0.658   0.595    22.997    0.000    0.000
LGA    I   354_B      I   354_B    25.191     0    0.150   0.181    29.930    0.000    0.000
LGA    Q   355_B      Q   355_B    20.996     0    0.548   0.956    23.297    0.000    0.000
LGA    D   356_B      D   356_B    19.285     0    0.583   1.186    20.514    0.000    0.000
LGA    K   357_B      K   357_B    17.316     4    0.268   0.282    17.856    0.000    0.000
LGA    I   358_B      I   358_B    12.392     0    0.527   1.644    13.998    0.000    0.000
LGA    F   359_B      F   359_B    12.278     0    0.610   1.360    17.082    0.000    0.000
LGA    E   360_B      E   360_B    15.296     0    0.266   0.887    19.769    0.000    0.000
LGA    I   361_B      I   361_B    13.748     0    0.581   0.711    16.254    0.000    0.000
LGA    F   362_B      F   362_B    16.137     0    0.050   1.324    21.702    0.000    0.000
LGA    M   363_B      M   363_B    14.544     0    0.655   1.092    15.499    0.000    0.000
LGA    K   364_B      K   364_B    13.456     4    0.556   0.499    15.589    0.000    0.000
LGA    S   365_B      S   365_B    14.171     0    0.289   0.714    16.301    0.000    0.000
LGA    N   366_B      N   366_B    14.622     0    0.568   0.881    21.527    0.000    0.000
LGA    M   367_B      M   367_B    10.948     0    0.231   0.830    15.053    0.000    0.000
LGA    D   368_B      D   368_B    10.007     3    0.482   0.447    11.263    3.810    1.905
LGA    L   369_B      L   369_B     7.190     0    0.626   0.602    11.830    7.500    4.762
LGA    N   370_B      N   370_B     7.970     0    0.597   0.751     9.745    9.405    6.310
LGA    K   371_B      K   371_B     9.227     4    0.545   0.498    11.220    1.429    0.635
LGA    F   372_B      F   372_B     8.320     0    0.564   1.202     8.375    5.357    7.662
LGA    I   373_B      I   373_B     7.769     0    0.671   0.871     9.507    4.286    9.167
LGA    M   374_B      M   374_B     7.295     0    0.081   0.995    11.285    8.571    7.560
LGA    T   375_B      T   375_B     8.386     0    0.661   0.639    10.443    2.381    5.850
LGA    K   376_B      K   376_B    12.875     4    0.623   0.608    15.215    0.000    0.000
LGA    S   377_B      S   377_B     7.941     1    0.431   0.422     9.683    6.905    5.794
LGA    W   378_B      W   378_B     5.573     0    0.000   1.353     6.660   24.048   32.823
LGA    P   379_B      P   379_B     3.601     0    0.128   0.383     4.602   45.119   41.769
LGA    H   380_B      H   380_B     2.956     0    0.049   1.165     4.345   59.167   53.143
LGA    E   381_B      E   381_B     1.919     0    0.086   1.246     6.477   72.976   55.714
LGA    L   382_B      L   382_B     1.743     0    0.048   0.909     4.105   72.857   59.226
LGA    N   383_B      N   383_B     2.060     0    0.022   0.863     2.447   70.833   71.964
LGA    N   384_B      N   384_B     1.537     0    0.028   1.399     4.950   77.143   61.786
LGA    L   385_B      L   385_B     1.205     0    0.027   1.039     2.857   79.286   78.452
LGA    I   386_B      I   386_B     1.724     0    0.050   0.096     2.175   68.810   69.821
LGA    N   387_B      N   387_B     2.614     0    0.069   1.093     4.301   59.048   52.976
LGA    K   388_B      K   388_B     2.602     0    0.215   0.804     5.713   57.262   51.852
LGA    L   389_B      L   389_B     1.657     0    0.150   0.154     1.772   72.857   78.274
LGA    L   390_B      L   390_B     2.152     0    0.423   0.394     4.173   55.952   62.500
LGA    H   391_B      H   391_B     2.037     0    0.057   1.087     3.812   57.738   66.429
LGA    M   392_B      M   392_B     5.960     0    0.090   1.130    13.526   20.714   11.667
LGA    E   393_B      E   393_B     6.115     4    0.577   0.580     6.274   19.405   11.005
LGA    H   394_B      H   394_B     7.961     0    0.295   1.208    14.683   10.119    4.048
LGA    R   395_B      R   395_B     5.774     0    0.265   0.737    10.393   22.857    9.524
LGA    K   396_B      K   396_B     5.241     0    0.257   0.217     8.128   22.857   16.984
LGA    T   397_B      T   397_B     7.250     0    0.582   0.552    10.030   16.429   10.816
LGA    V   398_B      V   398_B     4.269     0    0.038   1.010     5.288   35.952   41.088
LGA    K   399_B      K   399_B     3.765     0    0.050   0.947     4.635   54.167   46.878
LGA    L   400_B      L   400_B     1.470     0    0.051   0.136     2.544   79.524   72.202
LGA    S   401_B      S   401_B     2.230     0    0.070   0.663     2.917   62.976   65.079
LGA    D   402_B      D   402_B     2.830     0    0.066   0.241     4.552   60.952   49.940
LGA    L   403_B      L   403_B     1.161     0    0.063   1.342     3.451   72.976   72.440
LGA    S   404_B      S   404_B     2.146     0    0.024   0.163     3.568   59.524   63.968
LGA    R   405_B      R   405_B     3.857     0    0.105   1.233     6.999   43.452   31.515
LGA    H   406_B      H   406_B     3.133     0    0.028   0.865     6.409   50.000   39.524
LGA    P   407_B      P   407_B     2.818     0    0.063   0.206     2.869   57.143   57.143
LGA    W   408_B      W   408_B     3.165     0    0.071   1.212    12.513   48.333   20.612
LGA    W   409_B      W   409_B     3.774     0    0.122   1.389     8.926   43.333   35.408
LGA    S   410_B      S   410_B     4.695     0    0.300   0.556     5.276   32.976   31.587
LGA    S   411_B      S   411_B     3.601     0    0.045   0.675     4.406   40.238   48.492

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      293    1172   1172  100.00    2322   2322  100.00               379
SUMMARY(RMSD_GDC):     9.828          9.797                 10.236           28.896   25.646

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  304  379    4.0    141    2.24    31.464    26.733     6.020

LGA_LOCAL      RMSD:   2.242  Number of atoms:  141  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  10.407  Number of assigned atoms:  293 
Std_ASGN_ATOMS RMSD:   9.828  Standard rmsd on all 293 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.906210 * X  +  -0.053252 * Y  +  -0.419461 * Z  + -129.297180
  Y_new =  -0.377427 * X  +   0.345332 * Y  +  -0.859241 * Z  + -70.014084
  Z_new =   0.190610 * X  +   0.936969 * Y  +   0.292844 * Z  +  67.834717 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -0.394640 -0.191783  1.267871   [DEG:  -22.6112  -10.9884   72.6437 ]
ZXZ: -0.454144  1.273596  0.200694   [DEG:  -26.0205   72.9717   11.4989 ]
 
# END of job
