
#######################################################
#                                                     #
#                        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  236 ( 1963),  selected  230 , name one
# Molecule2: number of CA atoms  431 ( 3484),  selected  230 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:A  -ch2:A  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   134     258_A - 397_A       4.98     8.06
  LONGEST_CONTINUOUS_SEGMENT:   134     259_A - 398_A       4.95     8.04
  LCS_AVERAGE:     21.99

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    33     328_A - 366_A       1.98     7.93
  LONGEST_CONTINUOUS_SEGMENT:    33     356_A - 388_A       1.96     8.20
  LONGEST_CONTINUOUS_SEGMENT:    33     357_A - 389_A       1.98     8.51
  LCS_AVERAGE:      4.28

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    28     358_A - 385_A       0.99     8.20
  LCS_AVERAGE:      2.83

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  230
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     G   203_A     G   203_A      3   26   48      0    3    3    3   23   57   92  114  132  142  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     R   204_A     R   204_A     24   27   48     28   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     D   205_A     D   205_A     24   27   48     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     I   206_A     I   206_A     24   27   48     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     S   207_A     S   207_A     24   27   48     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     Q   208_A     Q   208_A     24   27   48     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     C   209_A     C   209_A     24   27   48     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     W   210_A     W   210_A     24   27   48     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     A   211_A     A   211_A     24   27   48     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     K   212_A     K   212_A     24   27   48     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     T   213_A     T   213_A     24   27   48     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     A   214_A     A   214_A     24   27   48     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     S   215_A     S   215_A     24   27   48     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     N   216_A     N   216_A     24   27   48     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     M   217_A     M   217_A     24   27   48     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     L   218_A     L   218_A     24   27   48     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     H   219_A     H   219_A     24   27   48     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     W   220_A     W   220_A     24   27   48     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     W   221_A     W   221_A     24   27   48     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     F   222_A     F   222_A     24   27   48     33   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     E   223_A     E   223_A     24   27   48     37   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     Q   224_A     Q   224_A     24   27   48     29   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     N   225_A     N   225_A     24   27   48     32   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     K   226_A     K   226_A     24   27   48     29   67   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     D   227_A     D   227_A     24   27   48      3    4   42   86  104  116  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     Y   228_A     Y   228_A      3   27   48      3    8   17   43   77  106  119  130  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     I   229_A     I   229_A      5   27   48      5    8   16   39   70   98  116  130  138  144  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     E   230_A     E   230_A      5   27   48      5    6   16   33   62   93  114  125  135  144  152  161  171  176  181  188  189  192  195  197 
LCS_GDT     Q   231_A     Q   231_A      5    7   48      5    6   16   32   57   82  105  124  131  141  150  161  171  176  181  188  189  192  195  197 
LCS_GDT     Y   232_A     Y   232_A      5    7   48      5    6   14   41   61   86  107  125  134  144  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     K   233_A     K   233_A      5    7   48      5    6   25   53   89  106  119  132  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     Q   234_A     Q   234_A      4    9   48      4    4    4    5    8   15   51   81  109  123  136  147  171  175  179  188  189  192  195  197 
LCS_GDT     K   235_A     K   235_A      4    9   48      4    4    4   10   12   14   15   24   33   54  119  134  155  162  179  188  189  192  195  197 
LCS_GDT     A   236_A     A   236_A      4    9   48      3    4    4    6   13   17   22   43   63   80  137  155  158  176  179  188  189  192  195  197 
LCS_GDT     A   237_A     A   237_A      4    9   48      3    4    5    6    8   16   21   26   29   49   58   91  121  150  164  176  186  189  194  196 
LCS_GDT     I   238_A     I   238_A      4    9   48      3    4    5    9   16   24   35   53   86  114  129  155  163  173  181  188  189  192  195  197 
LCS_GDT     E   239_A     E   239_A      4    9   48      3    4   10   17   30   46   79  102  115  129  149  162  171  176  181  188  189  192  195  197 
LCS_GDT     E   240_A     E   240_A      4    9   48      3    3    5   10   12   26   32   72  100  120  134  147  156  173  179  188  189  192  195  197 
LCS_GDT     W   241_A     W   241_A      4    9   48      3    4    5   10   33   47   69   88  109  123  145  156  171  175  181  188  189  192  195  197 
LCS_GDT     K   242_A     K   242_A      4    9   48      3    4    4    5    8   13   19   28   38   77   84  100  122  153  163  188  189  192  195  197 
LCS_GDT     R   243_A     R   243_A      4    5   48      3    4    6   14   19   30   40   46   59   80   88  132  151  162  179  188  189  192  195  197 
LCS_GDT     P   244_A     P   244_A      4    5   48      3    4   14   23   41   59   81  103  122  133  146  162  171  176  181  188  189  192  195  197 
LCS_GDT     L   245_A     L   245_A      3    5   48      3    3    6   16   25   31   61   85  109  130  145  162  171  176  181  188  189  192  195  197 
LCS_GDT     Y   246_A     Y   246_A      3    5   48      3    3    4   16   25   32   47   73  101  123  145  162  171  176  181  188  189  192  195  197 
LCS_GDT     K   247_A     K   247_A      4    5   48      3    3    4    5   11   24   33   46   59   77   84  135  146  162  179  188  189  192  195  197 
LCS_GDT     H   248_A     H   248_A      4    5   48      3    3    5    5   15   24   33   52   65   81  123  143  153  165  179  188  189  192  195  197 
LCS_GDT     D   249_A     D   249_A      4    5   48      3    4    7   16   29   36   56   75   95  119  137  144  151  159  170  179  185  191  195  197 
LCS_GDT     Y   250_A     Y   250_A      4    5   48      3    3    4    9   12   16   27   32   41   53   87  105  132  143  159  166  174  183  188  193 
LCS_GDT     I   251_A     I   251_A      4    5   28      3    4    4    4   12   16   21   32   41   58   65   87  122  137  145  153  166  172  188  190 
LCS_GDT     R   252_A     R   252_A      4    5   28      3    4    4    5    8   12   14   23   37   49   65   77   98  131  139  149  163  172  178  189 
LCS_GDT     G   253_A     G   253_A      4    5   28      3    4    4    4   13   16   18   23   28   36   50   77   83  100  115  123  141  147  178  182 
LCS_GDT     L   254_A     L   254_A      4    5   28      3    4    6   12   16   20   26   30   37   45   49   57   66  100  110  113  118  145  164  175 
LCS_GDT     Q   255_A     Q   255_A      5    6   28      3    4    6    9   16   20   26   30   35   45   49   56   85   94  110  113  118  127  158  175 
LCS_GDT     D   256_A     D   256_A      5    6   36      4    5    6    9   16   20   26   30   55   62   72   81   85  100  115  136  152  159  171  184 
LCS_GDT     E   257_A     E   257_A      5    6   39      4    5    5    6    7    9   10   10   14   18   24   28   31   37   65   72   82   89  137  146 
LCS_GDT     D   258_A     D   258_A      5    6  134      4    5    5    6    9   14   19   24   28   49   58   78   86   98  117  152  169  183  187  190 
LCS_GDT     E   259_A     E   259_A      5    7  134      4    5    6   12   29   52   71   95  123  135  145  156  164  173  175  181  186  191  194  197 
LCS_GDT     G   260_A     G   260_A      5    7  134      4    5    5    8   13   28   47   59   72   99  125  142  157  170  175  181  185  189  193  197 
LCS_GDT     K   261_A     K   261_A      4   12  134      4    5   14   21   30   44   53  107  134  143  152  162  171  176  181  185  189  191  195  197 
LCS_GDT     K   262_A     K   262_A     10   13  134      6   25   74  100  109  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     S   263_A     S   263_A     10   13  134     11   68   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     N   264_A     N   264_A     10   13  134     11   67   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     I   265_A     I   265_A     10   13  134     10   67   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     A   266_A     A   266_A     10   13  134     17   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     N   267_A     N   267_A     10   13  134     11   67   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     I   268_A     I   268_A     10   13  134     10   67   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     F   269_A     F   269_A     10   13  134     22   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     R   270_A     R   270_A     10   13  134     13   67   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     A   271_A     A   271_A     10   13  134      3   14   50   87  105  116  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     Y   272_A     Y   272_A      5   13  134      3    5   16   36   82  112  122  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     S   273_A     S   273_A      5   13  134      3    5   16   28   86  112  122  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     H   274_A     H   274_A      5   13  134      3    7   21   39   72  102  123  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     N   275_A     N   275_A      4   15  134      4    4    4    7   23   87  121  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     N   276_A     N   276_A      4   15  134      4    4   13   27   94  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     A   277_A     A   277_A     11   15  134      4   31   75   99  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     R   278_A     R   278_A     11   15  134      4   18   62   86  109  116  122  129  137  147  153  162  171  176  181  185  189  192  195  197 
LCS_GDT     G   279_A     G   279_A     11   15  134      6   31   70   97  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     G   280_A     G   280_A     11   15  134      6   36   74   99  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     Y   281_A     Y   281_A     11   15  134     21   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     I   282_A     I   282_A     11   15  134     23   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     E   283_A     E   283_A     11   15  134     12   68   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     D   284_A     D   284_A     11   15  134     25   68   87  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     G   285_A     G   285_A     11   15  134     25   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     L   286_A     L   286_A     11   15  134     30   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     T   287_A     T   287_A     11   15  134     30   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     W   288_A     W   288_A     11   15  134     23   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     Y   289_A     Y   289_A     11   15  134     29   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     L   290_A     L   290_A      9   15  134      4   13   46   87  105  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     Y   291_A     Y   291_A      6   12  134      3    5   12   35   49   92  120  131  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     K   292_A     K   292_A      6   12  134      3    5    7   10   27   46   92  115  125  137  146  161  171  176  181  188  189  192  195  197 
LCS_GDT     R   293_A     R   293_A      6   12  134      3    5   10   20   39   85  109  123  134  143  153  161  171  176  181  188  189  192  195  197 
LCS_GDT     D   294_A     D   294_A      6   12  134      3    5    7    9   16   23   44   87  103  121  129  143  153  164  179  188  189  192  195  197 
LCS_GDT     G   295_A     G   295_A      6   12  134      3    4    6    9   25   41   61   76   94  116  129  145  155  164  174  188  189  192  195  197 
LCS_GDT     Q   296_A     Q   296_A      4    8  134      3    3    6    7    9   14   19   24   59   76   98  112  130  148  161  169  177  187  193  197 
LCS_GDT     K   297_A     K   297_A      4    5  134      3    3    4    6    9   14   19   24   24   35   41   91  106  120  138  156  170  176  190  195 
LCS_GDT     N   298_A     N   298_A      3    5  134      0    3    4    5    7   11   15   21   35   40   52   59   71  106  117  137  147  158  174  180 
LCS_GDT     L   299_A     L   299_A      4    7  134      3    4    4    6    9   11   19   34   38   45   62   70   85  105  120  135  144  156  174  184 
LCS_GDT     G   300_A     G   300_A      4    7  134      3    4    4    6    9   23   28   34   38   45   61   70   82  105  120  124  141  152  159  180 
LCS_GDT     S   301_A     S   301_A      4    7  134      4    4    4    6    9   23   28   34   46   54   65   82   92  105  120  135  162  167  178  184 
LCS_GDT     I   302_A     I   302_A      4    7  134      4    4    4    6    9   27   33   44   74   90   97  126  143  154  165  173  177  186  193  195 
LCS_GDT     Y   303_A     Y   303_A      4   13  134      4   10   22   56   87  107  121  128  135  144  152  162  169  176  181  188  189  192  195  197 
LCS_GDT     P   304_A     P   304_A      4   13  134      4    4   17   53   96  115  122  132  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     G   305_A     G   305_A     10   13  134      9   67   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     L   306_A     L   306_A     10   13  134      8   67   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     F   307_A     F   307_A     10   13  134     14   67   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     N   308_A     N   308_A     10   13  134     14   67   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     D   309_A     D   309_A     10   13  134     14   63   87  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     V   310_A     V   310_A     10   13  134      9   63   87  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     F   311_A     F   311_A     10   13  134     10   67   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     A   312_A     A   312_A     10   13  134      4    6   81   99  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     H   313_A     H   313_A     10   13  134      4    6   20   62  103  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     D   314_A     D   314_A     10   13  134      4   35   81   99  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     T   315_A     T   315_A      3   13  134      3    4   49   73   97  115  122  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     S   316_A     S   316_A      5    6  134      4    5    5    5   26   66  107  124  133  140  151  162  169  176  181  185  189  192  195  197 
LCS_GDT     P   317_A     P   317_A      5    8  134      4    5    5   11   30   49   84  120  134  143  152  162  171  176  181  188  189  192  195  197 
LCS_GDT     I   318_A     I   318_A      5    9  134      4    5    6   11   32   54  105  124  134  146  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     N   319_A     N   319_A      7    9  134      5    9   13   31   48   68   98  115  134  144  152  162  169  176  181  188  189  192  195  197 
LCS_GDT     I   320_A     I   320_A      7    9  134      5    6   13   24   40   57   89  110  130  142  152  162  169  176  181  188  189  192  195  197 
LCS_GDT     E   321_A     E   321_A      7    9  134      5    6   12   31   42   68  100  124  134  144  152  162  171  176  181  188  189  192  195  197 
LCS_GDT     R   322_A     R   322_A      7    9  134      5    6   12   16   21   51   74  120  134  142  152  162  171  176  181  188  189  192  195  197 
LCS_GDT     C   323_A     C   323_A      7   13  134      4    6   12   16   21   51   99  124  134  144  152  162  171  176  181  188  189  192  195  197 
LCS_GDT     E   324_A     E   324_A      7   20  134      5    6   12   16   21   52   99  124  134  142  152  162  171  176  181  188  189  192  195  197 
LCS_GDT     T   325_A     T   325_A      7   22  134      3    6    7   16   21   33   76  124  134  140  146  161  171  176  181  188  189  192  195  197 
LCS_GDT     K   326_A     K   326_A      5   22  134      3    4   21   29   75  111  122  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     K   327_A     K   327_A     17   22  134      3   13   48   90  103  112  122  133  139  147  153  162  169  176  181  188  189  192  195  197 
LCS_GDT     E   328_A     E   328_A     19   33  134     23   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     F   329_A     F   329_A     19   33  134     15   68   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     E   330_A     E   330_A     19   33  134      8   43   84  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     Q   331_A     Q   331_A     19   33  134     25   47   79  100  109  116  124  133  140  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     L   332_A     L   332_A     19   33  134     23   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     M   333_A     M   333_A     19   33  134     25   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     N   334_A     N   334_A     19   33  134      8   43   85  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     K   335_A     K   335_A     19   33  134     18   62   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     T   336_A     T   336_A     19   33  134     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     L   337_A     L   337_A     19   33  134     10   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     D   338_A     D   338_A     19   33  134      9   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     N   339_A     N   339_A     19   33  134     30   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     K   340_A     K   340_A     19   33  134     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     R   341_A     R   341_A     19   33  134     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     A   342_A     A   342_A     19   33  134     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     I   343_A     I   343_A     19   33  134     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     G   344_A     G   344_A     19   33  134     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     I   345_A     I   345_A     19   33  134     30   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     F   346_A     F   346_A     19   33  134      9   18   67   97  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     W   347_A     W   347_A      3   33  134      3    7   20   45   80   97  111  124  131  143  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     Q   348_A     Q   348_A      3   33  134      3    3    5   12   25   49   72  101  118  130  140  154  167  175  179  185  189  192  195  197 
LCS_GDT     G   349_A     G   349_A      3   33  134      3    4   16   32   67   92  110  122  131  140  151  162  171  176  181  188  189  192  195  197 
LCS_GDT     Y   356_A     Y   356_A     11   33  134      3    8   60   91  105  115  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     Q   357_A     Q   357_A     12   33  134      7   43   76   98  109  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     H   358_A     H   358_A     28   33  134     22   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     A   359_A     A   359_A     28   33  134     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     V   360_A     V   360_A     28   33  134     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     T   361_A     T   361_A     28   33  134     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     C   362_A     C   362_A     28   33  134     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     W   363_A     W   363_A     28   33  134     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     G   364_A     G   364_A     28   33  134     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     A   365_A     A   365_A     28   33  134     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     A   366_A     A   366_A     28   33  134     22   67   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     Y   367_A     Y   367_A     28   33  134     14   50   85   99  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     D   368_A     D   368_A     28   33  134     10   44   80   99  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     E   369_A     E   369_A     28   33  134     10   32   67   97  109  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     D   370_A     D   370_A     28   33  134     10   17   61   91  109  116  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     N   371_A     N   371_A     28   33  134     10   34   72   98  109  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     N   372_A     N   372_A     28   33  134     10   39   76   99  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     I   373_A     I   373_A     28   33  134      7   53   85  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     I   374_A     I   374_A     28   33  134     31   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     C   375_A     C   375_A     28   33  134     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     L   376_A     L   376_A     28   33  134     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     Y   377_A     Y   377_A     28   33  134     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     I   378_A     I   378_A     28   33  134     38   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     A   379_A     A   379_A     28   33  134     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     E   380_A     E   380_A     28   33  134     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     S   381_A     S   381_A     28   33  134     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     N   382_A     N   382_A     28   33  134     37   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     L   383_A     L   383_A     28   33  134     29   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     P   384_A     P   384_A     28   33  134      6   45   84   98  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     E   385_A     E   385_A     28   33  134      4   29   66   97  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     A   386_A     A   386_A      7   33  134      3    3   24   48   82  113  120  130  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     V   387_A     V   387_A      7   33  134      4    6   21   35   70  101  119  129  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     L   388_A     L   388_A      7   33  134      4    6    9   26   41   88  117  128  137  144  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     Y   389_A     Y   389_A      7   33  134      4    6    9   26   46   88  117  128  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     P   390_A     P   390_A      7    9  134      4    6    9   26   41   88  117  128  141  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     F   391_A     F   391_A      7    9  134      4    6   13   26   41   88  117  129  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     G   392_A     G   392_A      7    9  134      4    6    9   26   41   67  117  128  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     V   393_A     V   393_A      5    9  134      3    4    7   13   27   46   79  112  131  142  151  158  168  176  181  188  189  192  195  197 
LCS_GDT     R   394_A     R   394_A      5    9  134      3    8   14   24   42   75   91  125  135  145  151  158  167  176  181  188  189  192  195  197 
LCS_GDT     Y   395_A     Y   395_A      5    8  134      3    4    5    9   25   45   57   76  114  133  142  152  163  170  179  184  186  192  195  197 
LCS_GDT     K   396_A     K   396_A      3    8  134      4   12   28   64   84  108  121  128  142  147  151  162  168  176  181  188  189  192  195  197 
LCS_GDT     G   397_A     G   397_A      4    6  134      3    3   25   73   98  115  122  129  139  147  152  162  171  176  181  188  189  192  195  197 
LCS_GDT     N   398_A     N   398_A      4    6  134      3    3    4    5    8   15   20   33   50   73   99  116  141  146  154  163  172  181  188  193 
LCS_GDT     I   399_A     I   399_A      4    6  133      3    3    4    5    8   12   15   23   43   54   96  106  117  146  149  161  171  180  184  190 
LCS_GDT     Y   400_A     Y   400_A      4    6   95      3    4    5    5    7    7    9   10   13   13   19   37   39   43   48   61   66   74   89  120 
LCS_GDT     E   401_A     E   401_A      4    6   94      3    4    5    5    7    7    9   11   13   14   19   20   25   26   30   34   37   41   45   54 
LCS_GDT     E   402_A     E   402_A      4    6   14      3    4    5    5    7    7    9   11   13   14   19   20   25   26   44   52   56   75   89   98 
LCS_GDT     A   403_A     A   403_A      4    6   14      3    4    5    5    7    7    9   10   11   13   14   32   39   50   61   71   80   90  105  115 
LCS_GDT     E   404_A     E   404_A      4    6   14      3    3    5    5    7   12   18   21   24   31   38   48   56   65   73   88   93  103  117  126 
LCS_GDT     K   405_A     K   405_A      3    7   14      3    3    5    6   12   16   24   31   39   46   60   70   83   96  108  119  128  140  146  157 
LCS_GDT     N   406_A     N   406_A      4    7   14      3    4    5    6    6    7    7   22   27   33   39   68   83  102  113  126  136  146  155  160 
LCS_GDT     R   407_A     R   407_A      4    7   14      3    4    5    6    7    7    9    9   10   11   12   13   39   52   54   59   65   81  109  130 
LCS_GDT     T   408_A     T   408_A      4    7   14      3    4    5    6    7    7    9    9   10   11   12   12   13   15   17   21   23   25   28   31 
LCS_GDT     Y   409_A     Y   409_A      4    7   14      3    4    5    6    7    7    9    9   11   11   12   12   13   15   17   18   21   22   27   31 
LCS_GDT     M   410_A     M   410_A      4    7   14      3    3    4    6    7    7    9    9   11   11   12   12   13   15   17   18   21   22   22   25 
LCS_GDT     F   411_A     F   411_A      4    7   14      3    3    4    5    7    7    9    9   11   11   12   12   13   15   17   21   23   26   32   85 
LCS_GDT     N   412_A     N   412_A      4    7   27      3    3    4    5    7    7    8    9   11   11   14   16   24   28   46  106  159  176  185  195 
LCS_GDT     Y   413_A     Y   413_A      4    7   27      3    3    4    5    7    7   14   36   49   66   72   84  136  156  170  177  186  190  195  197 
LCS_GDT     A   414_A     A   414_A      4    7   27      3    3    4    5   19   31   63   81  120  142  149  156  164  176  181  188  189  192  195  197 
LCS_GDT     L   415_A     L   415_A      3    7   27      3    3   10   21   28   38   72  113  126  142  151  162  171  176  181  188  189  192  195  197 
LCS_GDT     S   416_A     S   416_A      4    7   27      3    3   14   21   30   38   59   84   98  121  135  153  162  171  177  185  189  191  194  197 
LCS_GDT     K   417_A     K   417_A      4    6   27      3    3   16   22   65   88  109  124  136  146  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     P   418_A     P   418_A      4    8   27      3    3    5    6    7   14   41   61  104  139  149  155  164  176  181  188  189  192  195  197 
LCS_GDT     E   419_A     E   419_A      4   19   27      3    4    6   15   37   63  114  126  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     N   420_A     N   420_A      4   19   27      3    4    7   72  105  115  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     I   421_A     I   421_A      4   19   27      3    4    6   17   59  112  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     Y   422_A     Y   422_A     12   19   27      6   43   79  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     I   423_A     I   423_A     13   19   27      5   43   82  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     D   424_A     D   424_A     13   19   27     14   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     G   425_A     G   425_A     13   19   27      9   61   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     L   426_A     L   426_A     13   19   27     19   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     T   427_A     T   427_A     13   19   27     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     T   428_A     T   428_A     13   19   27     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     L   429_A     L   429_A     13   19   27     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     D   430_A     D   430_A     13   19   27     39   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     K   431_A     K   431_A     13   19   27     33   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     G   432_A     G   432_A     13   19   27     25   69   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     E   433_A     E   433_A     13   19   27      7   54   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     D   434_A     D   434_A     13   19   27      7   50   85  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     Q   435_A     Q   435_A     13   19   27     20   67   88  100  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     W   436_A     W   436_A     13   19   27      9   50   87   99  110  117  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     K   437_A     K   437_A     10   19   27      3   22   58   85  104  116  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_GDT     K   438_A     K   438_A      4   19   27      6   13   47   80  101  116  125  133  142  147  153  162  171  176  181  188  189  192  195  197 
LCS_AVERAGE  LCS_A:   9.70  (   2.83    4.28   21.99 )

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     39     69     88    100    110    117    125    133    142    147    153    162    171    176    181    188    189    192    195    197 
GDT PERCENT_AT   9.05  16.01  20.42  23.20  25.52  27.15  29.00  30.86  32.95  34.11  35.50  37.59  39.68  40.84  42.00  43.62  43.85  44.55  45.24  45.71
GDT RMS_LOCAL    0.33   0.59   0.83   1.03   1.23   1.42   1.69   1.95   2.33   2.42   2.69   2.93   3.42   3.45   3.66   4.12   4.12   4.21   4.33   4.40
GDT RMS_ALL_AT   7.97   7.93   7.92   7.90   7.97   7.99   7.96   7.92   7.98   7.98   7.98   8.04   8.00   8.01   8.04   8.04   8.08   8.02   8.02   8.04

# Checking swapping
#   possible swapping detected:  F   222_A      F   222_A
#   possible swapping detected:  Y   228_A      Y   228_A
#   possible swapping detected:  E   239_A      E   239_A
#   possible swapping detected:  E   240_A      E   240_A
#   possible swapping detected:  Y   246_A      Y   246_A
#   possible swapping detected:  D   249_A      D   249_A
#   possible swapping detected:  E   257_A      E   257_A
#   possible swapping detected:  F   269_A      F   269_A
#   possible swapping detected:  Y   272_A      Y   272_A
#   possible swapping detected:  F   311_A      F   311_A
#   possible swapping detected:  D   314_A      D   314_A
#   possible swapping detected:  E   321_A      E   321_A
#   possible swapping detected:  F   329_A      F   329_A
#   possible swapping detected:  E   330_A      E   330_A
#   possible swapping detected:  F   346_A      F   346_A
#   possible swapping detected:  Y   377_A      Y   377_A
#   possible swapping detected:  E   380_A      E   380_A
#   possible swapping detected:  E   385_A      E   385_A
#   possible swapping detected:  Y   395_A      Y   395_A
#   possible swapping detected:  Y   409_A      Y   409_A
#   possible swapping detected:  F   411_A      F   411_A
#   possible swapping detected:  Y   413_A      Y   413_A
#   possible swapping detected:  D   424_A      D   424_A
#   possible swapping detected:  D   430_A      D   430_A
#   possible swapping detected:  E   433_A      E   433_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    G   203_A      G   203_A     7.258     0    0.070   0.070     8.546   15.357   15.357
LGA    R   204_A      R   204_A     1.005     0    0.591   1.269     4.931   77.619   57.403
LGA    D   205_A      D   205_A     1.037     0    0.098   0.420     1.723   85.952   83.750
LGA    I   206_A      I   206_A     0.985     0    0.075   0.215     1.641   88.214   83.750
LGA    S   207_A      S   207_A     0.924     0    0.153   0.773     3.488   90.476   82.222
LGA    Q   208_A      Q   208_A     0.939     0    0.060   0.178     1.149   90.476   88.466
LGA    C   209_A      C   209_A     0.836     0    0.082   0.602     2.334   90.476   86.190
LGA    W   210_A      W   210_A     0.852     0    0.039   1.336     9.426   90.476   42.687
LGA    A   211_A      A   211_A     0.946     0    0.037   0.041     1.033   90.476   88.667
LGA    K   212_A      K   212_A     0.813     0    0.022   1.386     9.606   90.476   61.270
LGA    T   213_A      T   213_A     0.770     0    0.040   0.930     2.820   90.476   84.422
LGA    A   214_A      A   214_A     0.783     0    0.051   0.062     0.827   90.476   90.476
LGA    S   215_A      S   215_A     0.619     0    0.042   0.681     2.674   90.476   84.921
LGA    N   216_A      N   216_A     0.693     0    0.030   1.077     3.138   90.476   82.083
LGA    M   217_A      M   217_A     0.621     0    0.041   0.697     2.431   90.476   86.131
LGA    L   218_A      L   218_A     0.829     0    0.035   0.223     1.286   90.476   88.214
LGA    H   219_A      H   219_A     0.872     0    0.032   0.287     1.262   90.476   87.762
LGA    W   220_A      W   220_A     0.847     0    0.041   0.110     0.881   90.476   90.476
LGA    W   221_A      W   221_A     0.648     0    0.039   0.153     0.858   90.476   91.156
LGA    F   222_A      F   222_A     1.007     0    0.062   0.577     3.385   83.690   72.641
LGA    E   223_A      E   223_A     1.319     0    0.043   0.895     4.523   81.429   66.243
LGA    Q   224_A      Q   224_A     0.982     0    0.029   0.980     2.680   88.214   83.810
LGA    N   225_A      N   225_A     0.684     0    0.283   0.368     0.937   92.857   91.667
LGA    K   226_A      K   226_A     0.955     0    0.584   1.134     3.097   83.690   77.249
LGA    D   227_A      D   227_A     3.820     0    0.653   1.038     8.462   40.476   27.321
LGA    Y   228_A      Y   228_A     5.757     0    0.601   0.837    16.632   30.595   10.833
LGA    I   229_A      I   229_A     5.930     0    0.577   1.129    10.743   20.357   12.500
LGA    E   230_A      E   230_A     6.912     0    0.069   1.196    11.880   11.667    7.196
LGA    Q   231_A      Q   231_A     8.023     0    0.041   1.072    11.071    6.548    3.386
LGA    Y   232_A      Y   232_A     6.919     0    0.573   1.301     7.380   20.476   16.230
LGA    K   233_A      K   233_A     5.663     0    0.055   1.185     9.136   16.310   10.159
LGA    Q   234_A      Q   234_A    10.776     0    0.072   1.038    16.578    0.714    0.317
LGA    K   235_A      K   235_A    11.054     0    0.039   0.728    18.844    0.000    0.000
LGA    A   236_A      A   236_A     9.702     0    0.597   0.591    11.122    0.476    0.952
LGA    A   237_A      A   237_A    11.934     0    0.281   0.299    13.362    0.357    0.286
LGA    I   238_A      I   238_A     9.835     0    0.049   1.113    11.641    0.238    0.119
LGA    E   239_A      E   239_A     8.843     0    0.073   0.610     9.289    2.143    7.354
LGA    E   240_A      E   240_A    11.476     0    0.568   1.017    15.987    0.000    0.000
LGA    W   241_A      W   241_A    10.116     0    0.627   0.933    15.066    0.000    0.000
LGA    K   242_A      K   242_A    12.095     0    0.196   1.108    18.275    0.000    0.000
LGA    R   243_A      R   243_A    12.991     0    0.630   1.450    22.255    0.000    0.000
LGA    P   244_A      P   244_A     8.635     0    0.641   0.539     9.602    1.667    6.531
LGA    L   245_A      L   245_A     8.825     0    0.260   1.095     9.800    1.905    3.631
LGA    Y   246_A      Y   246_A     9.228     0    0.156   0.188    10.227    1.071    2.103
LGA    K   247_A      K   247_A    11.645     2    0.564   0.872    12.025    0.000    0.000
LGA    H   248_A      H   248_A     9.919     0    0.162   1.225    16.983    0.238    0.095
LGA    D   249_A      D   249_A    10.304     0    0.272   1.017    10.775    1.190    2.083
LGA    Y   250_A      Y   250_A    12.016     0    0.608   0.659    17.120    0.000    0.000
LGA    I   251_A      I   251_A    13.836     0    0.575   0.782    14.601    0.000    0.000
LGA    R   252_A      R   252_A    14.600     0    0.094   1.148    18.180    0.000    0.000
LGA    G   253_A      G   253_A    15.911     0    0.314   0.314    16.177    0.000    0.000
LGA    L   254_A      L   254_A    16.487     0    0.577   0.534    17.672    0.000    0.000
LGA    Q   255_A      Q   255_A    17.599     0    0.591   1.305    22.535    0.000    0.000
LGA    D   256_A      D   256_A    15.370     0    0.141   0.313    17.806    0.000    0.000
LGA    E   257_A      E   257_A    17.413     0    0.127   1.514    22.534    0.000    0.000
LGA    D   258_A      D   258_A    13.200     0    0.238   1.213    14.446    0.000    0.000
LGA    E   259_A      E   259_A     7.735     0    0.628   1.158     9.934    8.690    6.614
LGA    G   260_A      G   260_A     9.147     0    0.160   0.160     9.147    4.048    4.048
LGA    K   261_A      K   261_A     6.563     0    0.298   0.770    11.447   17.857    9.894
LGA    K   262_A      K   262_A     2.401     0    0.541   1.330     8.029   64.881   40.476
LGA    S   263_A      S   263_A     0.597     0    0.229   0.555     1.070   90.476   88.968
LGA    N   264_A      N   264_A     0.931     0    0.033   0.951     5.068   88.214   68.869
LGA    I   265_A      I   265_A     0.913     0    0.022   1.462     3.803   90.476   77.083
LGA    A   266_A      A   266_A     0.427     0    0.031   0.034     0.672   97.619   98.095
LGA    N   267_A      N   267_A     0.621     0    0.053   0.141     0.814   92.857   91.667
LGA    I   268_A      I   268_A     0.897     0    0.032   1.018     2.868   90.476   79.762
LGA    F   269_A      F   269_A     0.486     0    0.050   0.156     2.002   95.238   84.199
LGA    R   270_A      R   270_A     1.010     0    0.072   1.257     4.804   75.476   66.190
LGA    A   271_A      A   271_A     3.586     0    0.132   0.124     5.341   40.952   40.190
LGA    Y   272_A      Y   272_A     5.184     0    0.184   0.402     7.617   25.714   17.341
LGA    S   273_A      S   273_A     4.749     0    0.531   0.628     5.942   28.929   35.000
LGA    H   274_A      H   274_A     4.544     0    0.624   0.447    10.620   31.786   15.905
LGA    N   275_A      N   275_A     4.389     0    0.449   0.401     9.102   42.143   25.595
LGA    N   276_A      N   276_A     3.008     0    0.207   1.470     7.189   51.786   40.238
LGA    A   277_A      A   277_A     2.616     0    0.483   0.450     4.373   50.357   53.238
LGA    R   278_A      R   278_A     3.956     6    0.661   0.597     6.093   36.905   16.797
LGA    G   279_A      G   279_A     3.039     0    0.063   0.063     3.082   51.786   51.786
LGA    G   280_A      G   280_A     2.613     0    0.110   0.110     2.672   60.952   60.952
LGA    Y   281_A      Y   281_A     1.527     0    0.090   0.208     1.838   72.857   75.000
LGA    I   282_A      I   282_A     1.539     0    0.023   1.248     4.136   72.857   65.774
LGA    E   283_A      E   283_A     1.866     0    0.070   1.406     4.727   72.857   63.968
LGA    D   284_A      D   284_A     2.040     0    0.029   0.974     2.632   70.833   68.869
LGA    G   285_A      G   285_A     1.637     0    0.019   0.019     1.813   75.000   75.000
LGA    L   286_A      L   286_A     1.458     0    0.047   1.010     5.039   79.286   62.857
LGA    T   287_A      T   287_A     1.696     0    0.152   1.007     2.441   72.857   69.388
LGA    W   288_A      W   288_A     1.639     0    0.024   1.504     6.597   77.143   57.313
LGA    Y   289_A      Y   289_A     1.047     0    0.175   0.127     2.979   79.286   67.738
LGA    L   290_A      L   290_A     3.074     0    0.126   0.193     6.001   48.095   38.810
LGA    Y   291_A      Y   291_A     5.476     0    0.315   1.443    13.719   29.286   11.548
LGA    K   292_A      K   292_A     7.202     3    0.118   0.683    11.592   13.452    6.296
LGA    R   293_A      R   293_A     6.412     6    0.158   0.205     7.613   11.905    7.186
LGA    D   294_A      D   294_A     9.356     0    0.652   0.854    14.504    2.857    1.429
LGA    G   295_A      G   295_A     9.172     0    0.528   0.528     9.758    1.190    1.190
LGA    Q   296_A      Q   296_A    12.079     0    0.678   0.864    13.265    0.000    0.000
LGA    K   297_A      K   297_A    12.997     0    0.599   1.191    16.720    0.000    0.000
LGA    N   298_A      N   298_A    15.561     3    0.638   0.616    15.796    0.000    0.000
LGA    L   299_A      L   299_A    15.676     0    0.618   1.090    18.971    0.000    0.000
LGA    G   300_A      G   300_A    17.186     0    0.104   0.104    17.186    0.000    0.000
LGA    S   301_A      S   301_A    16.585     0    0.723   0.627    17.469    0.000    0.000
LGA    I   302_A      I   302_A    12.080     0    0.064   1.296    14.412    0.119    0.060
LGA    Y   303_A      Y   303_A     5.587     0    0.397   1.357     9.195   22.857   21.111
LGA    P   304_A      P   304_A     4.555     0    0.593   0.573     7.102   37.500   28.367
LGA    G   305_A      G   305_A     0.763     0    0.329   0.329     2.077   84.048   84.048
LGA    L   306_A      L   306_A     0.905     0    0.112   0.174     1.503   88.214   84.881
LGA    F   307_A      F   307_A     0.677     0    0.039   0.090     0.964   90.476   90.476
LGA    N   308_A      N   308_A     0.829     0    0.094   1.326     4.654   90.476   73.869
LGA    D   309_A      D   309_A     1.254     0    0.139   0.353     2.213   81.429   78.274
LGA    V   310_A      V   310_A     1.202     0    0.080   1.183     3.172   81.429   76.939
LGA    F   311_A      F   311_A     0.990     0    0.200   0.395     1.047   88.214   91.385
LGA    A   312_A      A   312_A     2.392     0    0.015   0.049     2.777   64.881   63.333
LGA    H   313_A      H   313_A     3.396     0    0.517   1.317     7.798   41.190   28.619
LGA    D   314_A      D   314_A     2.313     0    0.691   1.146     3.827   70.952   62.321
LGA    T   315_A      T   315_A     3.923     0    0.375   1.231     7.882   45.238   32.381
LGA    S   316_A      S   316_A     5.885     0    0.624   0.572     9.836   30.357   21.111
LGA    P   317_A      P   317_A     5.916     0    0.080   0.505     8.270   20.357   15.170
LGA    I   318_A      I   318_A     5.310     0    0.033   0.707     7.047   28.810   23.750
LGA    N   319_A      N   319_A     6.442     0    0.604   1.100    10.974   16.310    9.286
LGA    I   320_A      I   320_A     6.682     0    0.121   1.178     7.714   13.333   14.643
LGA    E   321_A      E   321_A     6.074     0    0.039   0.552     6.195   17.143   35.132
LGA    R   322_A      R   322_A     6.502     0    0.080   1.329     7.869   16.190   19.307
LGA    C   323_A      C   323_A     6.196     0    0.115   0.859     7.609   17.143   16.190
LGA    E   324_A      E   324_A     6.315     0    0.708   1.366     8.459   13.095   18.466
LGA    T   325_A      T   325_A     6.296     0    0.062   0.198     8.880   25.357   16.599
LGA    K   326_A      K   326_A     4.380     0    0.589   1.289    13.862   39.167   19.630
LGA    K   327_A      K   327_A     3.746     3    0.114   0.749     4.805   51.905   31.376
LGA    E   328_A      E   328_A     2.004     0    0.090   1.073     7.098   68.810   51.058
LGA    F   329_A      F   329_A     0.766     0    0.128   1.391     8.669   90.476   50.476
LGA    E   330_A      E   330_A     1.854     0    0.065   1.379     4.416   70.952   61.323
LGA    Q   331_A      Q   331_A     2.841     0    0.041   0.822     8.086   60.952   40.053
LGA    L   332_A      L   332_A     1.743     0    0.062   0.325     3.090   77.143   70.119
LGA    M   333_A      M   333_A     0.559     0    0.041   1.328     3.166   88.214   77.857
LGA    N   334_A      N   334_A     2.073     0    0.048   0.853     4.101   66.786   59.464
LGA    K   335_A      K   335_A     2.097     0    0.056   1.131     9.131   70.833   46.825
LGA    T   336_A      T   336_A     0.888     0    0.036   0.093     1.216   88.214   89.184
LGA    L   337_A      L   337_A     0.627     0    0.100   0.207     0.959   90.476   91.667
LGA    D   338_A      D   338_A     1.179     0    0.162   0.319     1.812   81.429   79.286
LGA    N   339_A      N   339_A     1.017     0    0.171   0.818     3.881   81.548   75.655
LGA    K   340_A      K   340_A     1.002     4    0.042   0.068     1.073   85.952   47.249
LGA    R   341_A      R   341_A     0.816     0    0.063   0.973     4.950   90.476   77.316
LGA    A   342_A      A   342_A     0.758     0    0.085   0.129     0.758   92.857   92.381
LGA    I   343_A      I   343_A     0.906     0    0.117   1.245     2.639   83.690   74.405
LGA    G   344_A      G   344_A     1.091     0    0.045   0.045     1.091   83.690   83.690
LGA    I   345_A      I   345_A     1.083     0    0.233   0.236     2.305   83.690   78.333
LGA    F   346_A      F   346_A     2.709     0    0.592   1.303     3.538   60.952   60.866
LGA    W   347_A      W   347_A     5.483     0    0.558   1.356    10.166   25.119   11.497
LGA    Q   348_A      Q   348_A     7.289     2    0.254   0.825     7.543   10.119    9.471
LGA    G   349_A      G   349_A     6.069     0    0.152   0.152     6.467   17.143   17.143
LGA    Y   356_A      Y   356_A     3.469     7    0.459   0.456     5.143   59.286   21.944
LGA    Q   357_A      Q   357_A     2.383     0    0.110   0.725     3.763   64.881   60.741
LGA    H   358_A      H   358_A     1.206     0    0.049   1.013     2.777   75.119   69.762
LGA    A   359_A      A   359_A     0.786     0    0.017   0.035     0.972   90.476   90.476
LGA    V   360_A      V   360_A     0.758     0    0.017   0.073     1.000   90.476   90.476
LGA    T   361_A      T   361_A     0.873     0    0.019   1.039     3.119   90.476   82.109
LGA    C   362_A      C   362_A     0.755     0    0.079   0.116     1.205   88.214   88.968
LGA    W   363_A      W   363_A     0.654     0    0.175   0.199     1.018   90.476   89.184
LGA    G   364_A      G   364_A     0.844     0    0.035   0.035     0.882   90.476   90.476
LGA    A   365_A      A   365_A     0.417     0    0.023   0.041     0.709   92.857   94.286
LGA    A   366_A      A   366_A     0.793     0    0.037   0.051     0.865   90.476   90.476
LGA    Y   367_A      Y   367_A     1.654     0    0.064   0.291     2.071   72.976   80.238
LGA    D   368_A      D   368_A     2.413     0    0.046   0.070     2.758   60.952   60.000
LGA    E   369_A      E   369_A     3.561     0    0.139   0.251     5.047   45.000   37.566
LGA    D   370_A      D   370_A     3.751     0    0.109   0.506     5.214   46.667   42.083
LGA    N   371_A      N   371_A     2.850     0    0.061   0.093     3.680   57.262   52.798
LGA    N   372_A      N   372_A     2.490     0    0.107   0.246     4.428   64.881   55.893
LGA    I   373_A      I   373_A     1.618     0    0.047   1.165     3.532   72.976   64.405
LGA    I   374_A      I   374_A     0.786     0    0.173   1.359     3.881   90.476   76.250
LGA    C   375_A      C   375_A     0.441     0    0.065   0.748     2.596   95.238   88.095
LGA    L   376_A      L   376_A     0.794     0    0.030   1.007     2.739   90.476   84.107
LGA    Y   377_A      Y   377_A     0.890     0    0.044   0.202     1.727   90.476   86.032
LGA    I   378_A      I   378_A     0.979     0    0.130   0.163     1.513   88.214   83.750
LGA    A   379_A      A   379_A     0.690     0    0.175   0.178     0.921   90.476   90.476
LGA    E   380_A      E   380_A     0.817     0    0.146   1.004     1.979   85.952   85.556
LGA    S   381_A      S   381_A     0.962     0    0.098   0.099     1.221   85.952   87.460
LGA    N   382_A      N   382_A     1.175     0    0.152   0.367     2.185   77.262   80.536
LGA    L   383_A      L   383_A     1.281     0    0.095   0.997     2.939   81.429   76.310
LGA    P   384_A      P   384_A     2.270     0    0.685   0.602     4.076   57.976   60.952
LGA    E   385_A      E   385_A     2.843     0    0.636   0.715     8.812   57.262   33.122
LGA    A   386_A      A   386_A     4.708     0    0.330   0.355     6.390   31.190   28.381
LGA    V   387_A      V   387_A     5.220     0    0.105   1.135     7.504   27.500   27.619
LGA    L   388_A      L   388_A     5.752     0    0.070   0.920    10.185   22.619   13.512
LGA    Y   389_A      Y   389_A     5.404     0    0.032   0.154     6.385   26.190   21.984
LGA    P   390_A      P   390_A     5.609     0    0.095   0.260     6.155   23.810   22.177
LGA    F   391_A      F   391_A     5.402     0    0.100   0.209     6.577   23.810   20.000
LGA    G   392_A      G   392_A     5.766     0    0.091   0.091     5.769   22.619   22.619
LGA    V   393_A      V   393_A     6.809     0    0.037   0.930    10.709   12.500    8.503
LGA    R   394_A      R   394_A     6.558     0    0.065   1.352    15.407   15.238    6.580
LGA    Y   395_A      Y   395_A     7.554     0    0.617   0.703    17.011   11.905    3.968
LGA    K   396_A      K   396_A     5.372     0    0.057   1.472     6.554   26.310   20.952
LGA    G   397_A      G   397_A     4.360     0    0.650   0.650     6.405   27.143   27.143
LGA    N   398_A      N   398_A    10.825     0    0.054   0.967    16.347    0.714    0.357
LGA    I   399_A      I   399_A    11.122     0    0.623   1.022    14.967    0.000    0.298
LGA    Y   400_A      Y   400_A    18.159     0    0.607   1.250    23.948    0.000    0.000
LGA    E   401_A      E   401_A    22.084     0    0.289   1.234    30.201    0.000    0.000
LGA    E   402_A      E   402_A    22.063     0    0.114   0.969    24.865    0.000    0.000
LGA    A   403_A      A   403_A    26.250     0    0.592   0.580    26.882    0.000    0.000
LGA    E   404_A      E   404_A    27.167     4    0.644   0.618    29.212    0.000    0.000
LGA    K   405_A      K   405_A    21.864     3    0.337   0.695    23.930    0.000    0.000
LGA    N   406_A      N   406_A    19.978     0    0.137   1.290    21.005    0.000    0.000
LGA    R   407_A      R   407_A    21.698     0    0.076   1.494    27.033    0.000    0.000
LGA    T   408_A      T   408_A    22.375     0    0.145   1.121    25.971    0.000    0.000
LGA    Y   409_A      Y   409_A    21.646     0    0.268   1.176    21.646    0.000    0.000
LGA    M   410_A      M   410_A    21.960     0    0.314   0.952    29.606    0.000    0.000
LGA    F   411_A      F   411_A    17.351     0    0.070   0.239    19.379    0.000    0.000
LGA    N   412_A      N   412_A    13.428     0    0.284   1.167    14.500    0.000    0.000
LGA    Y   413_A      Y   413_A    10.849     0    0.647   1.235    20.900    2.500    0.833
LGA    A   414_A      A   414_A     8.423     0    0.660   0.635     9.954    2.857    2.857
LGA    L   415_A      L   415_A     7.741     0    0.115   0.385    12.384   10.238    5.476
LGA    S   416_A      S   416_A    10.760     0    0.634   0.820    14.719    0.357    0.238
LGA    K   417_A      K   417_A     7.037     4    0.362   0.395     8.436    8.690    6.243
LGA    P   418_A      P   418_A     8.591     0    0.605   0.607    10.808    9.167    5.918
LGA    E   419_A      E   419_A     4.893     4    0.576   0.594     6.389   25.357   14.180
LGA    N   420_A      N   420_A     3.301     0    0.047   1.198     7.485   51.905   38.333
LGA    I   421_A      I   421_A     3.682     3    0.110   0.109     6.200   42.381   23.333
LGA    Y   422_A      Y   422_A     2.141     0    0.046   1.202     9.250   63.095   40.317
LGA    I   423_A      I   423_A     1.704     0    0.100   0.148     2.685   75.000   70.952
LGA    D   424_A      D   424_A     0.933     0    0.537   1.210     3.019   78.095   77.679
LGA    G   425_A      G   425_A     1.081     0    0.024   0.024     1.610   86.190   86.190
LGA    L   426_A      L   426_A     0.515     0    0.035   1.465     3.697   92.857   82.381
LGA    T   427_A      T   427_A     1.112     0    0.093   0.144     1.699   81.548   81.497
LGA    T   428_A      T   428_A     0.816     0    0.018   1.071     2.631   90.476   82.041
LGA    L   429_A      L   429_A     0.758     0    0.092   1.014     3.288   88.214   79.821
LGA    D   430_A      D   430_A     0.640     0    0.067   0.736     2.471   90.476   86.131
LGA    K   431_A      K   431_A     0.398     0    0.075   1.140     6.120   97.619   74.921
LGA    G   432_A      G   432_A     0.676     0    0.057   0.057     0.984   90.476   90.476
LGA    E   433_A      E   433_A     1.704     0    0.034   1.307     3.923   75.000   63.704
LGA    D   434_A      D   434_A     2.011     0    0.024   0.948     3.598   70.833   62.321
LGA    Q   435_A      Q   435_A     0.935     0    0.096   1.444     4.184   88.214   74.603
LGA    W   436_A      W   436_A     1.644     0    0.034   0.331     2.784   69.048   77.415
LGA    K   437_A      K   437_A     3.583     3    0.595   0.906     4.582   51.905   30.688
LGA    K   438_A      K   438_A     4.007     1    0.650   1.092     7.819   45.357   25.608

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      230     920    920  100.00    1860   1860  100.00               431
SUMMARY(RMSD_GDC):     7.700          7.610                  8.416           25.680   22.803

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  236  431    4.0    133    1.95    28.422    23.059     6.479

LGA_LOCAL      RMSD:   1.953  Number of atoms:  133  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   7.920  Number of assigned atoms:  230 
Std_ASGN_ATOMS RMSD:   7.700  Standard rmsd on all 230 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.873627 * X  +   0.286496 * Y  +  -0.393313 * Z  +  28.270361
  Y_new =   0.484686 * X  +   0.440816 * Y  +  -0.755487 * Z  +  -5.797470
  Z_new =  -0.043065 * X  +  -0.850648 * Y  +  -0.523969 * Z  +  60.282021 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  2.635074  0.043078 -2.122872   [DEG:  150.9786    2.4682 -121.6316 ]
ZXZ: -0.479998  2.122301 -3.091010   [DEG:  -27.5019  121.5989 -177.1018 ]
 
# END of job
