
#######################################################
#                                                     #
#                        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  190 ( 1468),  selected  190 , name one
# Molecule2: number of CA atoms  308 ( 2422),  selected  190 , 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:    66     215_A - 280_A       4.88    16.44
  LONGEST_CONTINUOUS_SEGMENT:    66     216_A - 281_A       4.96    16.59
  LCS_AVERAGE:     16.21

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    53     134_A - 186_A       1.97    15.82
  LCS_AVERAGE:      8.60

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    20     259_A - 278_A       0.67    16.92
  LCS_AVERAGE:      3.19

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  190
LCS_GDT     RESIDUE       RESIDUE       SEGMENT_SIZE    GLOBAL DISTANCE TEST COLUMNS: number of residues under the threshold assigned to each residue pair
LCS_GDT   NAME NUMBER   NAME NUMBER    1.0  2.0  5.0    0.5  1.0  1.5  2.0  2.5  3.0  3.5  4.0  4.5  5.0  5.5  6.0  6.5  7.0  7.5  8.0  8.5  9.0  9.5 10.0
LCS_GDT     T    93_A     T    93_A      9   14   24      3    4    9   12   13   14   15   17   18   28   32   36   39   43   47   52   60   65   73   77 
LCS_GDT     H    94_A     H    94_A     10   14   24      3    7    9   12   13   14   15   17   18   23   32   36   39   42   46   51   58   63   71   76 
LCS_GDT     Y    95_A     Y    95_A     10   14   24      4    7    9   12   13   14   15   17   22   28   32   36   39   43   47   52   60   65   73   77 
LCS_GDT     H    96_A     H    96_A     10   14   24      3    8   10   12   13   14   15   17   22   28   32   36   39   43   47   52   60   65   73   81 
LCS_GDT     N    97_A     N    97_A     10   14   24      5    8   10   12   13   14   15   17   22   28   32   36   39   43   47   52   60   65   73   77 
LCS_GDT     S    98_A     S    98_A     10   14   24      5    8   10   12   13   14   15   17   22   28   32   36   39   43   47   52   58   65   73   77 
LCS_GDT     G    99_A     G    99_A     10   14   24      5    8   10   12   13   14   15   17   22   28   32   36   39   43   47   52   60   65   73   84 
LCS_GDT     Y   100_A     Y   100_A     10   14   24      5    8   10   12   13   14   15   17   22   28   32   36   39   43   47   52   60   65   73   84 
LCS_GDT     K   101_A     K   101_A     10   14   24      5    8   10   12   13   14   15   17   22   28   32   36   39   43   47   52   60   67   77   90 
LCS_GDT     I   102_A     I   102_A     10   14   24      5    8   10   12   13   14   15   17   22   28   32   36   39   43   47   52   60   66   78   90 
LCS_GDT     I   103_A     I   103_A     10   14   24      5    8   10   11   13   14   15   17   22   28   32   36   39   43   54   60   69   87   98  107 
LCS_GDT     H   104_A     H   104_A     10   14   24      5    7   10   11   12   13   15   17   22   28   32   36   39   43   47   59   69   80   96  106 
LCS_GDT     H   105_A     H   105_A     10   14   24      5    7   10   11   12   14   15   17   17   23   32   36   39   47   60   68   81   86   97  109 
LCS_GDT     G   106_A     G   106_A      3   14   24      3    3    4    8   11   14   15   17   17   20   24   29   39   43   52   60   73   91  108  124 
LCS_GDT     S   107_A     S   107_A      3    6   24      3    3    4    5    6    7    7   10   16   20   21   22   27   33   37   42   55   88  119  120 
LCS_GDT     P   108_A     P   108_A      4    6   24      3    4    4    5    9    9    9   10   32   35   40   69   87   92  103  110  116  119  122  125 
LCS_GDT     S   109_A     S   109_A      4    6   24      3    4    4    5    6    7    7   10   12   15   17   46   53   57   77  103  113  117  120  123 
LCS_GDT     Y   110_A     Y   110_A      4    8   24      3    4    4    6   10   12   14   15   16   20   21   31   39   58   98  106  113  120  123  127 
LCS_GDT     P   111_A     P   111_A      7    8   24      3    4    7    7   10   10   14   15   15   17   20   21   87  104  108  113  116  119  123  127 
LCS_GDT     D   112_A     D   112_A      7    8   24      3    6    7   10   12   14   15   17   17   23   30   85  106  112  114  115  117  120  123  127 
LCS_GDT     K   113_A     K   113_A      7    8   24      3    6    7    8    9    9    9   17   17   20   21   22   28   33   36   45   69  114  118  124 
LCS_GDT     L   114_A     L   114_A      7    8   24      4    5    7   12   13   13   14   17   17   23   32   55   79   94  101  107  116  120  123  127 
LCS_GDT     N   115_A     N   115_A      7    8   24      4    5    8   18   24   42   58   74   89   97  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     D   116_A     D   116_A      7    8   24      4    5    7    7    9   10   15   19   40   46   60   82   98  110  115  116  118  120  123  127 
LCS_GDT     L   117_A     L   117_A      7    8   17      4    4    7    7    9   10   11   12   18   20   38   44   54   65   81   90  105  110  118  122 
LCS_GDT     S   118_A     S   118_A      4    8   17      3    3    6    7    9   15   19   21   25   33   41   54   61   73   90   96  111  113  118  122 
LCS_GDT     E   119_A     E   119_A      3    6   17      3    3    6    7    7    7    8   10   16   19   21   27   50   60   73   88   98  106  114  121 
LCS_GDT     P   120_A     P   120_A      5    7   17      3    6    6    8    8   15   22   28   38   46   58   64   81   87   94  110  114  120  122  127 
LCS_GDT     P   121_A     P   121_A      5    7   17      4    6    6    8    8    8    9   10   14   32   43   51   61   70   76   85   95  100  108  116 
LCS_GDT     F   122_A     F   122_A      5    7   16      4    6    6    8    8    8    9   11   14   19   20   25   46   56   63   68   74   82   88   93 
LCS_GDT     W   123_A     W   123_A      5    7   17      4    6    6    8    8    8    9   11   14   15   20   22   25   30   35   41   47   57   67   75 
LCS_GDT     L   124_A     L   124_A      5    7   17      4    6    6    8    8    8    9   11   14   16   20   22   24   26   29   34   42   49   56   66 
LCS_GDT     F   125_A     F   125_A      4    7   17      3    3    4    5    6    8    9   11   14   16   20   22   24   26   29   32   35   38   47   51 
LCS_GDT     A   126_A     A   126_A      4    7   17      3    4    6    8    8    8    9   11   14   16   20   22   22   25   28   31   35   41   47   53 
LCS_GDT     Q   127_A     Q   127_A      4    7   17      3    4    5    6    6    8    9   11   14   16   20   22   23   25   28   31   35   38   41   51 
LCS_GDT     G   128_A     G   128_A      4    7   17      3    4    5    6    6    8    9   11   14   16   20   22   26   32   36   42   47   53   64   74 
LCS_GDT     N   129_A     N   129_A      4    7   60      3    4    5    6    6    8    9   11   16   16   20   22   30   35   43   54   65   71   91  100 
LCS_GDT     V   130_A     V   130_A      4    7   60      3    4    5    6    6    8    9   13   19   22   27   37   45   52   65   78   87   93  106  118 
LCS_GDT     S   131_A     S   131_A      3    7   60      3    4    5    6    7   13   21   32   39   48   57   71   84   99  105  113  116  120  123  127 
LCS_GDT     L   132_A     L   132_A      4    7   60      3    4    5    6    7   18   25   36   44   58   67   91  100  104  113  113  117  120  123  127 
LCS_GDT     L   133_A     L   133_A      4    6   60      3    4    6   13   23   35   54   72   86   97  105  108  111  113  115  116  117  120  123  127 
LCS_GDT     D   134_A     D   134_A      4   53   60      3    4   14   21   46   58   72   83   91   97  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     K   135_A     K   135_A      4   53   60      3    4    5    6   23   42   59   78   90   96  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     K   136_A     K   136_A      6   53   60      6   16   35   54   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     C   137_A     C   137_A      7   53   60     11   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     V   138_A     V   138_A      7   53   60     15   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     G   139_A     G   139_A      7   53   60     10   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     V   140_A     V   140_A      7   53   60      9   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     V   141_A     V   141_A      7   53   60      5   25   40   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     G   142_A     G   142_A      7   53   60     15   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     T   143_A     T   143_A      7   53   60     12   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     R   144_A     R   144_A     19   53   60      3    3   17   30   53   71   82   87   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     N   145_A     N   145_A     19   53   60      9   18   27   50   64   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     P   146_A     P   146_A     19   53   60      3    6   19   36   50   70   82   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     T   147_A     T   147_A     19   53   60      3   17   28   44   56   73   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     A   148_A     A   148_A     19   53   60      9   17   28   44   56   73   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     L   149_A     L   149_A     19   53   60      9   18   28   40   56   73   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     G   150_A     G   150_A     19   53   60      9   18   28   44   62   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     I   151_A     I   151_A     19   53   60      9   18   39   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     Y   152_A     Y   152_A     19   53   60      8   18   28   53   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     L   153_A     L   153_A     19   53   60      9   18   28   47   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     T   154_A     T   154_A     19   53   60      9   18   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     Q   155_A     Q   155_A     19   53   60      8   18   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     A   156_A     A   156_A     19   53   60      9   18   28   47   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     V   157_A     V   157_A     19   53   60      9   18   37   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     I   158_A     I   158_A     19   53   60      7   16   37   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     S   159_A     S   159_A     19   53   60      7   16   26   47   63   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     Q   160_A     Q   160_A     19   53   60      5   16   26   47   64   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     F   161_A     F   161_A     19   53   60      8   19   37   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     I   162_A     I   162_A     19   53   60      5   16   19   33   58   73   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     D   163_A     D   163_A      8   53   60      3   19   37   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     S   164_A     S   164_A      8   53   60      4   15   42   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     D   165_A     D   165_A      8   53   60      5   18   42   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     Y   166_A     Y   166_A      8   53   60      5   25   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     S   167_A     S   167_A      8   53   60     15   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     T   168_A     T   168_A      9   53   60     15   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     V   169_A     V   169_A      9   53   60     15   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     S   170_A     S   170_A      9   53   60     12   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     G   171_A     G   171_A      9   53   60      3   14   26   40   63   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     L   172_A     L   172_A      9   53   60      6   15   25   40   61   75   84   88   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     A   173_A     A   173_A      9   53   60      4   12   22   38   53   72   82   87   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     Y   174_A     Y   174_A     13   53   60      4   18   37   54   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     G   175_A     G   175_A     13   53   60      7   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     I   176_A     I   176_A     13   53   60     10   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     D   177_A     D   177_A     13   53   60     10   20   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     Q   178_A     Q   178_A     13   53   60     10   17   39   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     S   179_A     S   179_A     13   53   60     10   22   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     A   180_A     A   180_A     13   53   60     10   20   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     H   181_A     H   181_A     13   53   60     10   17   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     E   182_A     E   182_A     13   53   60     10   20   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     A   183_A     A   183_A     13   53   60     10   24   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     S   184_A     S   184_A     13   53   60     10   22   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     L   185_A     L   185_A     13   53   60     10   23   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     L   186_A     L   186_A     13   53   60      9   17   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     F   187_A     F   187_A      3   52   60      3    3    3   14   19   29   39   48   74   87   96  102  107  110  114  116  118  120  122  127 
LCS_GDT     K   188_A     K   188_A      4    6   60      3    3    4    7    9   16   20   26   42   49   75   83  100  108  110  114  118  120  122  125 
LCS_GDT     I   189_A     I   189_A      4    6   60      3    3    4    5    6    7    7    9   12   18   22   32   37   47   55   75   85  105  115  119 
LCS_GDT     P   190_A     P   190_A      4    6   60      3    3    4    5    6    7    7    9   10   13   17   20   27   32   41   49   58   76   97  102 
LCS_GDT     T   191_A     T   191_A      5    6   60      4    4    5    5    6    7    7    9   10   12   14   18   18   21   23   24   25   29   31   34 
LCS_GDT     I   192_A     I   192_A      5    6   20      4    4    5    5    6    8    8    9   11   15   17   18   18   21   23   24   27   29   31   34 
LCS_GDT     A   193_A     A   193_A      5    6   20      4    4    7    8    9    9   14   15   16   16   17   18   18   21   23   24   27   29   31   34 
LCS_GDT     V   194_A     V   194_A      5    6   20      4    4    5    8    9    9   14   15   16   16   17   18   18   23   26   26   27   29   31   34 
LCS_GDT     L   195_A     L   195_A      5    6   20      3    4    5    5    6    8   14   15   16   16   17   18   18   23   26   26   27   29   31   34 
LCS_GDT     G   196_A     G   196_A      4    6   20      3    4    4    5    6   10   14   15   16   16   17   18   18   23   26   26   28   31   34   36 
LCS_GDT     T   197_A     T   197_A      4    7   20      3    4    4    5    6   10   14   15   16   16   17   19   24   28   30   32   35   37   39   40 
LCS_GDT     G   198_A     G   198_A      4    7   20      0    4    4    5    6    8   13   15   16   16   17   19   24   26   29   31   35   37   39   40 
LCS_GDT     V   199_A     V   199_A      5    7   20      3    4    7    8    9   10   14   15   16   16   17   19   24   26   29   31   34   37   44   47 
LCS_GDT     N   200_A     N   200_A      5    7   20      3    4    7    8    9   10   14   15   16   16   17   18   22   25   33   38   39   42   44   47 
LCS_GDT     S   201_A     S   201_A      5    7   20      3    4    7    8    9   10   14   15   16   18   20   24   26   32   33   38   40   45   47   55 
LCS_GDT     N   202_A     N   202_A      5    7   20      3    4    7    8    9   10   14   15   17   20   37   44   48   57   66   67   72   88   96   98 
LCS_GDT     Y   203_A     Y   203_A      5    7   20      3    4    7    8    9   10   14   15   16   19   23   24   27   31   66   67   72   78   86   92 
LCS_GDT     P   204_A     P   204_A      4    5   20      3    4    4    4    6    8   14   15   16   19   23   24   27   31   33   36   53   60   66   72 
LCS_GDT     K   205_A     K   205_A      4    5   20      3    4    4    4    6    7    9   12   15   19   23   29   37   43   49   55   60   66   72   81 
LCS_GDT     N   206_A     N   206_A      4    5   20      3    4    4    4    6   10   14   15   19   28   33   39   50   55   65   74   83   92  100  105 
LCS_GDT     S   207_A     S   207_A      4    5   20      3    4    4    4    9   10   14   15   16   19   23   24   34   47   52   59   69   85   94  102 
LCS_GDT     G   208_A     G   208_A      4    5   20      3    4    7    8    9   10   14   15   21   27   33   39   42   53   66   74   82   91  100  105 
LCS_GDT     E   209_A     E   209_A      4    5   20      3    4    5    6   10   13   17   23   30   40   50   55   65   76   87   93  102  109  114  122 
LCS_GDT     M   210_A     M   210_A      3    5   20      3    3    4    6    7   12   17   24   31   40   50   58   67   78   92  101  107  116  120  124 
LCS_GDT     R   211_A     R   211_A      3    5   19      3    4    6    6    8   13   19   27   40   52   65   81   93  101  110  112  117  120  123  127 
LCS_GDT     G   212_A     G   212_A      4    5   17      4    4    6    7   12   16   28   39   51   67   86  100  105  109  113  114  117  120  123  127 
LCS_GDT     H   213_A     H   213_A      4    5   17      4    4    6    6    7    8   10   23   34   35   44   49   87   93  102  113  116  119  123  127 
LCS_GDT     I   214_A     I   214_A      4    5   17      4    4    4    4    4    5    7    8   11   13   38   58   62   93  107  113  116  120  123  127 
LCS_GDT     V   215_A     V   215_A      4    5   66      4    4    4    4    4    6    8   13   92  100  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     N   216_A     N   216_A      3    6   66      4   10   28   47   61   73   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     N   217_A     N   217_A      3    6   66      4   10   28   47   63   73   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     G   218_A     G   218_A      3    6   66      3    4   20   33   54   70   82   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     G   219_A     G   219_A      6    8   66      3    5    8   15   31   54   72   83   92  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     L   220_A     L   220_A      6    8   66      4    5   10   16   32   49   67   78   86   98  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     I   221_A     I   221_A      6    8   66      4    5    7    7   16   36   61   78   90   98  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     L   222_A     L   222_A      6    8   66      4    5    7    8   16   50   62   73   81   98  105  108  111  113  115  116  118  120  122  127 
LCS_GDT     T   223_A     T   223_A      6    8   66      4    5    7   27   41   57   67   79   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     E   224_A     E   224_A      6    8   66      4    5   10   13   17   20   23   27   40   50   90   95  104  109  111  114  118  120  122  125 
LCS_GDT     Y   225_A     Y   225_A      4    8   66      4    4    7   13   17   20   23   27   34   39   56   64   94  100  110  114  118  120  122  125 
LCS_GDT     L   226_A     L   226_A      4    8   66      4    4    5    5    6   13   22   27   32   38   44   60   75   96  107  112  117  120  122  125 
LCS_GDT     P   227_A     P   227_A      4    6   66      4    4    5    5   13   19   22   27   34   41   47   63   73   83   99  105  113  120  122  125 
LCS_GDT     N   228_A     N   228_A      4    6   66      3    4    5    5    8   17   22   27   34   63   72   78   91  100  106  112  117  120  122  125 
LCS_GDT     Q   229_A     Q   229_A      3   19   66      3    6    9   15   17   20   23   27   31   35   72   77   86   95  100  109  114  120  122  125 
LCS_GDT     K   230_A     K   230_A      4   19   66      3   16   18   22   31   38   50   61   69   78   88   94  100  106  110  114  117  120  122  125 
LCS_GDT     P   231_A     P   231_A      4   19   66      3    4    6   13   19   44   58   77   85   89   95  101  106  111  115  116  118  120  122  125 
LCS_GDT     S   232_A     S   232_A     13   19   66      8   10   13   25   32   48   63   73   86   90   99  104  111  113  115  116  118  120  123  127 
LCS_GDT     Q   233_A     Q   233_A     13   19   66      8   10   15   23   28   48   55   69   76   89   99  107  111  113  115  116  118  120  123  127 
LCS_GDT     E   234_A     E   234_A     13   19   66      8   10   20   47   63   72   79   88   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     N   235_A     N   235_A     13   19   66      8   17   27   52   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     F   236_A     F   236_A     13   19   66      8   10   21   29   34   48   70   79   91   97  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     V   237_A     V   237_A     13   19   66      8   10   17   31   39   49   69   80   89   98  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     R   238_A     R   238_A     13   19   66      8   10   15   34   55   69   79   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     R   239_A     R   239_A     13   19   66      8   16   27   47   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     N   240_A     N   240_A     13   19   66      7   10   21   31   50   70   77   87   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     R   241_A     R   241_A     13   19   66      5    9   18   32   50   68   74   83   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     I   242_A     I   242_A     13   19   66      5    9   21   50   64   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     Q   243_A     Q   243_A     13   19   66      5   14   29   58   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     A   244_A     A   244_A     13   19   66      4   10   13   15   25   45   71   81   92  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     A   245_A     A   245_A      9   33   66      4    8   10   14   34   51   71   81   90  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     L   246_A     L   246_A      9   34   66      4   15   29   57   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     S   247_A     S   247_A      9   34   66      4   15   36   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     D   248_A     D   248_A      9   34   66      9   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     V   249_A     V   249_A      9   34   66     15   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     L   250_A     L   250_A      9   34   66     15   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     I   251_A     I   251_A      9   34   66     15   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     P   252_A     P   252_A      9   34   66     14   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     V   253_A     V   253_A      9   34   66      8   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     E   254_A     E   254_A      9   34   66      6   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     W   255_A     W   255_A      9   34   66      4   23   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     G   256_A     G   256_A      6   34   66      3    7   15   30   49   70   81   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     L   257_A     L   257_A      6   34   66      1    7   15   30   47   70   79   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     K   258_A     K   258_A      3   34   66      0    3    5   11   23   66   79   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     S   259_A     S   259_A     20   34   66      4   23   42   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     G   260_A     G   260_A     20   34   66      6   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     T   261_A     T   261_A     20   34   66     13   27   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     S   262_A     S   262_A     20   34   66     14   27   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     H   263_A     H   263_A     20   34   66     14   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     T   264_A     T   264_A     20   34   66     14   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     V   265_A     V   265_A     20   34   66     13   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     R   266_A     R   266_A     20   34   66     14   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     Y   267_A     Y   267_A     20   34   66     15   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     A   268_A     A   268_A     20   34   66     15   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     A   269_A     A   269_A     20   34   66     15   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     Q   270_A     Q   270_A     20   34   66     15   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     L   271_A     L   271_A     20   34   66     15   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     K   272_A     K   272_A     20   34   66      5   27   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     R   273_A     R   273_A     20   34   66     15   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     A   274_A     A   274_A     20   34   66     15   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     I   275_A     I   275_A     20   34   66     13   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     L   276_A     L   276_A     20   34   66     11   29   43   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     C   277_A     C   277_A     20   34   66      6   25   40   59   65   75   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     P   278_A     P   278_A     20   34   66      9   20   37   55   64   72   84   89   93  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     L   279_A     L   279_A     18   34   66      3    8   21   29   41   64   72   81   92  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     L   280_A     L   280_A     15   23   66      3    8   21   29   51   68   72   82   92  101  105  108  111  113  115  116  118  120  123  127 
LCS_GDT     R   281_A     R   281_A      3    4   66      3    3    3    4    6    9   14   17   22   32   86   92   99  102  108  114  117  120  123  127 
LCS_GDT     G   282_A     G   282_A      3    4   58      3    3    3    4    4    4   10   16   21   31   39   45   79   97  103  107  115  117  120  122 
LCS_AVERAGE  LCS_A:   9.33  (   3.19    8.60   16.21 )

GLOBAL_DISTANCE_TEST (summary information about detected largest sets of residues (represented by selected AToms) that can fit under specified thresholds)
GDT DIST_CUTOFF  0.50   1.00   1.50   2.00   2.50   3.00   3.50   4.00   4.50   5.00   5.50   6.00   6.50   7.00   7.50   8.00   8.50   9.00   9.50  10.00
GDT NUMBER_AT     15     29     43     59     65     75     84     89     93    101    105    108    111    113    115    116    118    120    123    127 
GDT PERCENT_AT   4.87   9.42  13.96  19.16  21.10  24.35  27.27  28.90  30.19  32.79  34.09  35.06  36.04  36.69  37.34  37.66  38.31  38.96  39.94  41.23
GDT RMS_LOCAL    0.35   0.62   0.96   1.27   1.45   1.73   2.01   2.20   2.34   2.70   2.93   3.03   3.21   3.35   3.52   3.59   3.82   4.08   4.49   4.82
GDT RMS_ALL_AT  16.21  16.17  16.27  16.20  16.09  16.20  16.06  15.89  15.81  15.80  15.41  15.55  15.32  15.30  15.32  15.36  15.60  14.89  14.61  14.48

# Checking swapping
#   possible swapping detected:  Y    95_A      Y    95_A
#   possible swapping detected:  D   116_A      D   116_A
#   possible swapping detected:  E   119_A      E   119_A
#   possible swapping detected:  F   122_A      F   122_A
#   possible swapping detected:  D   134_A      D   134_A
#   possible swapping detected:  Y   152_A      Y   152_A
#   possible swapping detected:  F   161_A      F   161_A
#   possible swapping detected:  D   163_A      D   163_A
#   possible swapping detected:  Y   166_A      Y   166_A
#   possible swapping detected:  E   224_A      E   224_A
#   possible swapping detected:  F   236_A      F   236_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    T    93_A      T    93_A    42.460     0    0.207   1.132    46.450    0.000    0.000
LGA    H    94_A      H    94_A    43.562     0    0.055   0.152    46.930    0.000    0.000
LGA    Y    95_A      Y    95_A    38.731     0    0.038   0.151    40.966    0.000    0.000
LGA    H    96_A      H    96_A    36.968     0    0.087   1.106    37.851    0.000    0.000
LGA    N    97_A      N    97_A    39.188     0    0.058   0.980    45.036    0.000    0.000
LGA    S    98_A      S    98_A    37.010     0    0.020   0.602    38.372    0.000    0.000
LGA    G    99_A      G    99_A    33.294     0    0.030   0.030    34.827    0.000    0.000
LGA    Y   100_A      Y   100_A    32.071     0    0.195   1.286    35.192    0.000    0.000
LGA    K   101_A      K   101_A    30.613     0    0.134   1.146    31.767    0.000    0.000
LGA    I   102_A      I   102_A    30.021     0    0.045   0.056    35.231    0.000    0.000
LGA    I   103_A      I   103_A    25.337     0    0.058   0.102    26.869    0.000    0.000
LGA    H   104_A      H   104_A    25.873     0    0.031   1.110    31.400    0.000    0.000
LGA    H   105_A      H   105_A    22.095     0    0.123   1.075    23.884    0.000    0.000
LGA    G   106_A      G   106_A    20.164     0    0.312   0.312    20.502    0.000    0.000
LGA    S   107_A      S   107_A    19.508     0    0.320   0.993    24.021    0.000    0.000
LGA    P   108_A      P   108_A    16.199     0    0.385   0.495    19.175    0.000    0.000
LGA    S   109_A      S   109_A    18.685     0    0.061   0.057    22.910    0.000    0.000
LGA    Y   110_A      Y   110_A    14.348     0    0.609   1.533    21.853    0.000    0.000
LGA    P   111_A      P   111_A    11.396     0    0.619   0.678    15.014    0.357    0.204
LGA    D   112_A      D   112_A     9.534     0    0.079   0.369    11.146    0.952    0.476
LGA    K   113_A      K   113_A    12.183     0    0.035   1.081    17.361    0.000    0.000
LGA    L   114_A      L   114_A    11.736     0    0.117   0.198    15.228    0.000    0.000
LGA    N   115_A      N   115_A     7.730     0    0.282   0.259     8.866    3.929   11.071
LGA    D   116_A      D   116_A    10.726     0    0.090   1.111    13.941    0.119    0.774
LGA    L   117_A      L   117_A    16.181     0    0.608   1.476    19.391    0.000    0.000
LGA    S   118_A      S   118_A    16.565     0    0.076   0.074    18.176    0.000    0.000
LGA    E   119_A      E   119_A    17.255     0    0.594   1.137    18.114    0.000    0.000
LGA    P   120_A      P   120_A    15.563     0    0.691   0.904    19.486    0.000    0.000
LGA    P   121_A      P   121_A    22.262     0    0.248   0.569    23.157    0.000    0.000
LGA    F   122_A      F   122_A    26.168     0    0.082   1.085    29.361    0.000    0.000
LGA    W   123_A      W   123_A    30.674     0    0.093   1.734    37.447    0.000    0.000
LGA    L   124_A      L   124_A    32.141     0    0.418   1.458    32.528    0.000    0.000
LGA    F   125_A      F   125_A    33.630     0    0.573   1.263    40.339    0.000    0.000
LGA    A   126_A      A   126_A    35.453     0    0.655   0.610    37.507    0.000    0.000
LGA    Q   127_A      Q   127_A    36.141     0    0.560   1.011    44.106    0.000    0.000
LGA    G   128_A      G   128_A    31.114     0    0.190   0.190    33.022    0.000    0.000
LGA    N   129_A      N   129_A    24.131     0    0.489   0.941    26.508    0.000    0.000
LGA    V   130_A      V   130_A    22.090     0    0.273   0.344    26.195    0.000    0.000
LGA    S   131_A      S   131_A    16.486     0    0.627   0.808    18.613    0.000    0.000
LGA    L   132_A      L   132_A    13.204     0    0.632   0.902    19.319    0.000    0.000
LGA    L   133_A      L   133_A     8.786     0    0.132   1.418    10.938    6.548    3.988
LGA    D   134_A      D   134_A     6.100     0    0.017   0.656     7.293   13.452   13.036
LGA    K   135_A      K   135_A     7.402     0    0.666   1.178    16.919   13.690    6.243
LGA    K   136_A      K   136_A     2.661     0    0.576   0.974     8.367   59.524   49.259
LGA    C   137_A      C   137_A     0.883     0    0.113   0.128     2.389   88.214   81.746
LGA    V   138_A      V   138_A     0.649     0    0.028   1.187     2.954   88.214   80.748
LGA    G   139_A      G   139_A     1.182     0    0.056   0.056     1.688   81.548   81.548
LGA    V   140_A      V   140_A     1.486     0    0.032   0.050     2.356   75.119   74.150
LGA    V   141_A      V   141_A     2.222     0    0.050   1.103     4.736   75.238   64.898
LGA    G   142_A      G   142_A     1.068     0    0.117   0.117     1.560   83.810   83.810
LGA    T   143_A      T   143_A     0.509     0    0.065   0.120     4.242   70.714   63.129
LGA    R   144_A      R   144_A     4.869     0    0.654   1.235    14.895   45.476   17.489
LGA    N   145_A      N   145_A     2.865     0    0.339   0.760     5.895   53.571   46.548
LGA    P   146_A      P   146_A     3.472     0    0.102   0.145     4.583   50.000   44.558
LGA    T   147_A      T   147_A     3.095     0    0.103   0.147     3.304   53.571   55.102
LGA    A   148_A      A   148_A     3.047     0    0.039   0.038     3.233   51.786   51.429
LGA    L   149_A      L   149_A     3.184     0    0.038   1.451     6.963   53.571   41.905
LGA    G   150_A      G   150_A     2.649     0    0.037   0.037     2.903   65.000   65.000
LGA    I   151_A      I   151_A     1.334     0    0.038   0.656     1.804   79.286   80.417
LGA    Y   152_A      Y   152_A     1.916     0    0.020   0.199     4.419   72.857   56.706
LGA    L   153_A      L   153_A     2.121     0    0.036   1.392     4.748   68.810   66.071
LGA    T   154_A      T   154_A     1.156     0    0.036   0.077     1.475   81.429   81.429
LGA    Q   155_A      Q   155_A     1.357     0    0.031   1.535     5.520   77.143   65.714
LGA    A   156_A      A   156_A     2.162     0    0.037   0.043     2.478   66.786   66.381
LGA    V   157_A      V   157_A     1.631     0    0.016   0.033     2.122   75.000   75.374
LGA    I   158_A      I   158_A     1.695     0    0.049   0.660     2.472   70.952   69.881
LGA    S   159_A      S   159_A     2.994     0    0.134   0.554     5.192   51.905   47.302
LGA    Q   160_A      Q   160_A     2.868     0    0.063   0.964     3.899   59.048   56.508
LGA    F   161_A      F   161_A     1.793     0    0.270   0.387     2.093   75.000   72.900
LGA    I   162_A      I   162_A     3.650     0    0.583   0.946     8.155   43.690   31.071
LGA    D   163_A      D   163_A     2.373     0    0.177   0.762     3.566   64.762   59.286
LGA    S   164_A      S   164_A     2.416     0    0.672   0.614     3.970   59.524   56.349
LGA    D   165_A      D   165_A     2.361     0    0.024   1.120     4.712   62.857   52.560
LGA    Y   166_A      Y   166_A     1.444     0    0.068   0.221     3.926   79.286   66.825
LGA    S   167_A      S   167_A     0.633     0    0.133   0.601     1.206   95.238   92.143
LGA    T   168_A      T   168_A     0.277     0    0.170   1.117     2.666   97.619   87.483
LGA    V   169_A      V   169_A     0.281     0    0.059   0.080     0.386  100.000  100.000
LGA    S   170_A      S   170_A     0.822     0    0.177   0.294     1.486   85.952   85.952
LGA    G   171_A      G   171_A     3.436     0    0.089   0.089     4.422   48.810   48.810
LGA    L   172_A      L   172_A     3.815     0    0.062   1.458     5.180   39.167   36.131
LGA    A   173_A      A   173_A     4.434     0    0.141   0.189     4.709   38.690   37.238
LGA    Y   174_A      Y   174_A     3.439     0    0.185   0.255     6.981   50.119   33.492
LGA    G   175_A      G   175_A     1.218     0    0.604   0.604     3.224   69.286   69.286
LGA    I   176_A      I   176_A     0.555     0    0.043   0.050     0.801   92.857   95.238
LGA    D   177_A      D   177_A     1.245     0    0.032   1.001     5.078   83.690   65.357
LGA    Q   178_A      Q   178_A     1.817     0    0.085   0.469     4.466   75.000   60.635
LGA    S   179_A      S   179_A     1.199     0    0.092   0.657     3.036   83.690   77.698
LGA    A   180_A      A   180_A     0.880     0    0.028   0.026     0.995   90.476   90.476
LGA    H   181_A      H   181_A     1.573     0    0.025   1.151     7.075   79.286   52.381
LGA    E   182_A      E   182_A     1.385     0    0.065   0.848     2.300   83.690   77.725
LGA    A   183_A      A   183_A     0.659     0    0.044   0.056     0.951   90.476   92.381
LGA    S   184_A      S   184_A     0.886     0    0.018   0.603     2.784   88.214   83.413
LGA    L   185_A      L   185_A     0.982     0    0.053   0.118     1.104   88.214   90.536
LGA    L   186_A      L   186_A     1.407     0    0.355   0.313     3.663   65.714   66.667
LGA    F   187_A      F   187_A     7.961     0    0.319   1.029    15.783    7.500    2.727
LGA    K   188_A      K   188_A    10.606     0    0.300   0.680    14.579    0.714    1.217
LGA    I   189_A      I   189_A    14.889     0    0.165   1.128    17.918    0.000    0.000
LGA    P   190_A      P   190_A    16.532     0    0.355   0.431    18.993    0.000    0.000
LGA    T   191_A      T   191_A    20.051     0    0.619   1.414    22.885    0.000    0.000
LGA    I   192_A      I   192_A    26.074     0    0.082   0.075    30.588    0.000    0.000
LGA    A   193_A      A   193_A    28.275     0    0.243   0.256    32.105    0.000    0.000
LGA    V   194_A      V   194_A    33.711     0    0.085   0.206    36.822    0.000    0.000
LGA    L   195_A      L   195_A    36.134     0    0.536   0.716    39.520    0.000    0.000
LGA    G   196_A      G   196_A    36.186     0    0.073   0.073    36.186    0.000    0.000
LGA    T   197_A      T   197_A    34.886     0    0.694   0.674    35.262    0.000    0.000
LGA    G   198_A      G   198_A    36.596     0    0.572   0.572    36.596    0.000    0.000
LGA    V   199_A      V   199_A    31.399     0    0.691   0.878    33.499    0.000    0.000
LGA    N   200_A      N   200_A    31.430     0    0.208   0.870    37.449    0.000    0.000
LGA    S   201_A      S   201_A    27.299     0    0.099   0.755    28.627    0.000    0.000
LGA    N   202_A      N   202_A    23.632     0    0.112   0.859    25.341    0.000    0.000
LGA    Y   203_A      Y   203_A    24.612     0    0.668   0.809    25.056    0.000    0.000
LGA    P   204_A      P   204_A    26.035     0    0.650   0.827    27.117    0.000    0.000
LGA    K   205_A      K   205_A    28.478     0    0.378   1.044    35.563    0.000    0.000
LGA    N   206_A      N   206_A    23.860     0    0.442   1.077    26.286    0.000    0.000
LGA    S   207_A      S   207_A    25.092     0    0.014   0.080    28.528    0.000    0.000
LGA    G   208_A      G   208_A    25.160     0    0.173   0.173    25.160    0.000    0.000
LGA    E   209_A      E   209_A    19.950     0    0.565   0.805    21.946    0.000    0.000
LGA    M   210_A      M   210_A    17.505     0    0.592   0.871    21.354    0.000    0.000
LGA    R   211_A      R   211_A    14.505     0    0.630   1.468    19.549    0.000    0.000
LGA    G   212_A      G   212_A    13.002     0    0.553   0.553    13.276    0.000    0.000
LGA    H   213_A      H   213_A    14.366     0    0.100   1.009    20.046    0.000    0.000
LGA    I   214_A      I   214_A    10.509     0    0.320   1.381    11.745    3.690    1.845
LGA    V   215_A      V   215_A     6.254     0    0.029   0.089     9.240   29.405   20.816
LGA    N   216_A      N   216_A     3.322     0    0.632   0.561     7.198   42.024   35.060
LGA    N   217_A      N   217_A     3.034     0    0.518   0.746     6.026   50.119   40.952
LGA    G   218_A      G   218_A     3.972     0    0.125   0.125     4.101   40.238   40.238
LGA    G   219_A      G   219_A     5.698     0    0.660   0.660     8.685   17.262   17.262
LGA    L   220_A      L   220_A     6.521     0    0.060   0.144    11.106   26.071   14.464
LGA    I   221_A      I   221_A     6.188     0    0.081   0.675     9.931   13.095    8.155
LGA    L   222_A      L   222_A     6.166     0    0.111   1.377    11.935   26.667   14.583
LGA    T   223_A      T   223_A     4.965     0    0.038   1.211     7.990   19.286   19.864
LGA    E   224_A      E   224_A     8.378     0    0.601   1.018     9.427    5.952    4.074
LGA    Y   225_A      Y   225_A     9.219     0    0.064   1.509    12.131    1.548    0.714
LGA    L   226_A      L   226_A    10.434     0    0.154   1.419    12.222    0.119    0.119
LGA    P   227_A      P   227_A    12.415     0    0.155   0.426    12.986    0.000    0.000
LGA    N   228_A      N   228_A    11.774     0    0.526   0.759    15.706    0.000    0.000
LGA    Q   229_A      Q   229_A    12.368     0    0.604   1.078    15.764    0.000    0.000
LGA    K   230_A      K   230_A    10.990     0    0.709   1.161    15.032    0.119    0.053
LGA    P   231_A      P   231_A     8.754     0    0.023   0.174     9.243    2.976    2.721
LGA    S   232_A      S   232_A     8.401     0    0.511   0.709     9.389    6.667    4.921
LGA    Q   233_A      Q   233_A     8.976     0    0.119   1.170    15.893    6.905    3.069
LGA    E   234_A      E   234_A     4.919     0    0.034   1.281     8.066   38.214   27.302
LGA    N   235_A      N   235_A     2.948     0    0.067   0.655     7.350   51.905   34.286
LGA    F   236_A      F   236_A     6.429     0    0.026   1.328    13.323   21.548    8.095
LGA    V   237_A      V   237_A     6.865     0    0.043   1.178    11.362   19.524   12.245
LGA    R   238_A      R   238_A     3.983     0    0.053   1.180    13.469   46.786   22.251
LGA    R   239_A      R   239_A     3.089     0    0.131   1.195     7.145   57.262   30.909
LGA    N   240_A      N   240_A     4.877     0    0.146   0.228     9.916   36.190   20.595
LGA    R   241_A      R   241_A     5.243     0    0.067   0.811     8.312   32.976   20.346
LGA    I   242_A      I   242_A     2.907     0    0.023   0.087     6.528   62.976   45.774
LGA    Q   243_A      Q   243_A     2.602     0    0.041   0.606     8.157   57.976   37.513
LGA    A   244_A      A   244_A     5.569     0    0.172   0.183     6.660   23.333   22.095
LGA    A   245_A      A   245_A     5.574     0    0.030   0.034     5.935   26.429   25.429
LGA    L   246_A      L   246_A     2.803     0    0.261   0.231     4.006   59.167   53.036
LGA    S   247_A      S   247_A     2.219     0    0.175   0.595     2.766   64.881   64.841
LGA    D   248_A      D   248_A     1.486     0    0.086   1.019     4.414   81.429   64.345
LGA    V   249_A      V   249_A     1.093     0    0.013   0.049     1.399   85.952   84.014
LGA    L   250_A      L   250_A     0.730     0    0.041   0.870     3.860   90.476   78.155
LGA    I   251_A      I   251_A     1.071     0    0.114   0.128     1.467   83.690   84.821
LGA    P   252_A      P   252_A     1.140     0    0.018   0.370     1.470   83.690   82.721
LGA    V   253_A      V   253_A     1.148     0    0.566   0.572     3.281   73.571   75.714
LGA    E   254_A      E   254_A     1.106     0    0.092   1.003     3.150   79.286   76.085
LGA    W   255_A      W   255_A     1.228     0    0.153   0.393     4.752   71.190   54.150
LGA    G   256_A      G   256_A     3.766     0    0.398   0.398     5.496   40.952   40.952
LGA    L   257_A      L   257_A     4.129     0    0.459   1.264     5.134   46.905   40.714
LGA    K   258_A      K   258_A     4.081     0    0.253   0.727    11.789   45.595   22.222
LGA    S   259_A      S   259_A     2.784     0    0.626   0.627     5.913   69.286   54.127
LGA    G   260_A      G   260_A     1.806     0    0.109   0.109     2.239   75.119   75.119
LGA    T   261_A      T   261_A     1.862     0    0.098   0.109     2.667   72.857   68.299
LGA    S   262_A      S   262_A     1.949     0    0.021   0.062     2.204   72.857   70.159
LGA    H   263_A      H   263_A     1.317     0    0.071   0.166     2.210   79.286   74.667
LGA    T   264_A      T   264_A     1.043     0    0.025   0.884     2.580   81.429   76.735
LGA    V   265_A      V   265_A     1.622     0    0.028   0.150     2.339   75.000   71.769
LGA    R   266_A      R   266_A     1.791     0    0.038   1.097     7.005   72.857   53.247
LGA    Y   267_A      Y   267_A     1.268     0    0.016   0.357     2.132   79.286   79.444
LGA    A   268_A      A   268_A     1.301     0    0.056   0.072     1.800   77.143   78.000
LGA    A   269_A      A   269_A     1.876     0    0.018   0.021     2.034   70.833   71.238
LGA    Q   270_A      Q   270_A     1.876     0    0.022   0.577     3.104   70.833   71.376
LGA    L   271_A      L   271_A     2.022     0    0.108   0.194     2.688   66.786   64.821
LGA    K   272_A      K   272_A     2.667     0    0.123   0.815     3.737   64.881   54.392
LGA    R   273_A      R   273_A     1.454     0    0.061   0.597     2.461   75.000   74.459
LGA    A   274_A      A   274_A     1.480     0    0.047   0.050     1.480   81.429   81.429
LGA    I   275_A      I   275_A     1.756     0    0.016   0.116     2.060   70.833   71.845
LGA    L   276_A      L   276_A     1.997     0    0.130   1.356     4.356   75.000   68.512
LGA    C   277_A      C   277_A     2.768     0    0.021   0.759     3.691   51.905   52.460
LGA    P   278_A      P   278_A     3.507     0    0.269   0.322     3.895   50.238   53.265
LGA    L   279_A      L   279_A     6.216     0    0.610   1.348     8.755   13.690   11.131
LGA    L   280_A      L   280_A     6.227     0    0.658   1.302     8.879   18.333   13.988
LGA    R   281_A      R   281_A    10.760     0    0.648   1.488    16.647    0.714    0.260
LGA    G   282_A      G   282_A    13.675     0    0.718   0.718    13.984    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      190     760    760  100.00    1468   1468  100.00               308
SUMMARY(RMSD_GDC):    12.797         12.691                 13.446           22.132   19.926

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  190  308    4.0     89    2.20    23.782    21.281     3.876

LGA_LOCAL      RMSD:   2.196  Number of atoms:   89  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  15.885  Number of assigned atoms:  190 
Std_ASGN_ATOMS RMSD:  12.797  Standard rmsd on all 190 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.080851 * X  +  -0.482232 * Y  +   0.872305 * Z  + -11.346639
  Y_new =   0.799443 * X  +  -0.554053 * Y  +  -0.232197 * Z  +  72.398682
  Z_new =   0.595276 * X  +   0.678585 * Y  +   0.430313 * Z  +  57.372849 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  1.671587 -0.637609  1.005656   [DEG:   95.7749  -36.5323   57.6199 ]
ZXZ:  1.310641  1.125957  0.720092   [DEG:   75.0942   64.5126   41.2583 ]
 
# END of job
