
#######################################################
#                                                     #
#                        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  198 ( 1543),  selected  198 , name one
# Molecule2: number of CA atoms  198 ( 1543),  selected  198 , 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:    68      56_A - 123_A       4.98    13.68
  LONGEST_CONTINUOUS_SEGMENT:    68      57_A - 124_A       4.84    13.69
  LONGEST_CONTINUOUS_SEGMENT:    68      58_A - 125_A       4.65    13.72
  LONGEST_CONTINUOUS_SEGMENT:    68      59_A - 126_A       4.89    13.77
  LCS_AVERAGE:     19.71

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    45      78_A - 122_A       1.99    14.25
  LCS_AVERAGE:      8.95

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    13      80_A - 92_A        0.97    14.12
  LCS_AVERAGE:      3.06

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  198
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     S     1_A     S     1_A      4    5   25      3    4    4    5    6    7    8    8    8    9   12   13   14   21   22   37   48   62   68   87 
LCS_GDT     E     2_A     E     2_A      4    5   26      3    4    4    4    5    7    9   12   13   17   18   37   52   62   75   85   97  106  121  122 
LCS_GDT     E     3_A     E     3_A      4    7   26      3    4    4    5    7    9   11   12   13   25   37   55   92  100  108  113  117  118  122  123 
LCS_GDT     V     4_A     V     4_A      4    9   26      3    4    6    8   14   23   28   39   46   80   91   98  106  109  113  115  117  120  123  128 
LCS_GDT     K     5_A     K     5_A      5    9   26      4    6   14   27   53   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     N     6_A     N     6_A      6    9   26      4   14   28   42   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     A     7_A     A     7_A      6    9   26      4   23   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     D     8_A     D     8_A      6    9   26      6   23   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     L     9_A     L     9_A      6    9   26      7   23   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     Y    10_A     Y    10_A      6    9   26      3    7   17   36   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     W    11_A     W    11_A      6    9   26      3    7   15   24   48   69   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     G    12_A     G    12_A      4    9   26      2   15   35   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     F    13_A     F    13_A      4    9   26      4   23   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     S    14_A     S    14_A      6    9   26      4    6    7    7   12   27   44   63   81   91   97  104  110  113  114  118  122  125  126  128 
LCS_GDT     G    15_A     G    15_A      6    9   26      4    6    9   22   33   47   57   73   86   96  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     S    16_A     S    16_A      6    9   26      4    6   24   37   51   64   76   85   93  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     S    17_A     S    17_A      6    9   26      4    6    7   15   42   66   78   88   94  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     H    18_A     H    18_A      6    9   26      4    7   25   45   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     H    19_A     H    19_A      6    9   26      4    8   30   45   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     K    20_A     K    20_A      5    9   26      3    8   30   45   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     Y    21_A     Y    21_A      5    9   26      3    7   25   36   51   70   78   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     D    22_A     D    22_A      5    9   26      4   16   30   40   52   69   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     H    23_A     H    23_A      5    7   26      3   11   26   40   51   63   77   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     N    24_A     N    24_A      4    7   26      1    5   23   33   44   58   69   84   94   99  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     G    25_A     G    25_A      3    7   26      3    3    4    5    6   17   22   34   39   63   78   89  101  107  110  112  116  120  123  125 
LCS_GDT     P    26_A     P    26_A      3    6   26      3    3    4    5    5    8    9   12   12   16   22   34   80   94  109  112  115  118  121  125 
LCS_GDT     K    27_A     K    27_A      3    6   26      3    3    4    5    5    6    8   11   16   18   21   29   47   65   88  106  110  114  119  122 
LCS_GDT     F    28_A     F    28_A      3    6   17      0    3    4    5    5    7    8    9   12   16   17   18   19   27   35   39   41   59   72   98 
LCS_GDT     E    29_A     E    29_A      3    6   17      3    6    7    7    9    9   10   12   14   16   17   19   27   31   35   43   50   59   72   79 
LCS_GDT     K    30_A     K    30_A      3    6   17      3    4    4    5    7    8   10   12   13   15   21   23   28   34   39   43   52   59   72   79 
LCS_GDT     A    31_A     A    31_A      4    6   17      4    4    7    7    9    9   10   12   13   15   21   23   28   31   39   43   50   59   72   79 
LCS_GDT     G    32_A     G    32_A      4    6   17      4    6    7    7    7    8   10   12   13   14   15   23   28   34   39   43   50   59   72   79 
LCS_GDT     K    33_A     K    33_A      4    9   17      4    6    7    9    9    9   11   13   15   16   17   23   28   34   39   43   50   59   63   69 
LCS_GDT     G    34_A     G    34_A      6    9   17      4    6    7    9    9    9   11   12   14   16   17   19   28   34   39   43   50   59   63   79 
LCS_GDT     A    35_A     A    35_A      6    9   17      4    6    7    9    9    9   11   14   15   19   24   36   41   53   88   93  105  110  118  122 
LCS_GDT     E    36_A     E    36_A      6    9   17      4    6    7    9    9   10   13   32   51   60   72   87   96  105  114  117  118  122  123  126 
LCS_GDT     L    37_A     L    37_A      6    9   17      4    6    7   18   25   31   47   59   78   89   96  105  109  111  114  117  119  122  124  128 
LCS_GDT     T    38_A     T    38_A      6    9   17      4    6    7   10   14   17   19   28   38   45   54   64   76   87  102  109  113  115  118  124 
LCS_GDT     N    39_A     N    39_A      6    9   21      4    6    7    9    9    9   11   13   21   23   29   36   48   54   77   82   92  101  111  118 
LCS_GDT     I    40_A     I    40_A      6    9   21      3    5    6    9    9    9   11   13   15   16   21   25   34   38   49   58   66   81   88  100 
LCS_GDT     D    41_A     D    41_A      4    9   21      3    3    4    5    8    9   11   13   15   16   21   25   25   30   36   45   52   60   78   87 
LCS_GDT     A    42_A     A    42_A      4    7   21      1    4    4    5    7    8   11   13   15   17   26   31   34   38   41   58   61   75   83   91 
LCS_GDT     A    43_A     A    43_A      4    5   21      0    4    4    5    6    9   11   13   15   17   20   25   26   37   40   60   68   77   83   94 
LCS_GDT     S    44_A     S    44_A      4    5   21      3    4    4    5    5    8    9   12   13   17   22   26   28   33   42   48   58   75   83   88 
LCS_GDT     A    45_A     A    45_A      4    5   21      3    4    4    5    6    7    9   12   13   15   16   18   24   29   31   44   47   50   55   64 
LCS_GDT     Y    46_A     Y    46_A      3    3   21      3    3    3    5    5    7    9   12   13   15   23   28   30   35   42   44   48   57   64   74 
LCS_GDT     A    47_A     A    47_A      3    4   21      3    3    4    4    4    5    6   11   18   20   25   28   32   37   42   44   48   50   67   74 
LCS_GDT     E    48_A     E    48_A      3    4   21      3    3    4    5    5    7    9   13   17   17   18   21   28   31   33   38   47   50   55   57 
LCS_GDT     T    49_A     T    49_A      4   14   21      3    5    8   11   12   14   14   16   18   19   21   23   28   31   33   38   42   50   55   57 
LCS_GDT     F    50_A     F    50_A      4   14   21      3    5    8   11   12   14   14   16   18   23   25   28   32   37   42   44   48   59   85   91 
LCS_GDT     K    51_A     K    51_A      5   14   21      3    5    8   11   12   14   14   16   18   23   25   28   32   37   42   59   68   81   85   91 
LCS_GDT     K    52_A     K    52_A      5   14   21      3    5    8   11   12   14   14   16   18   19   21   23   30   35   41   44   48   50   55   74 
LCS_GDT     G    53_A     G    53_A      5   14   21      3    4    6   11   12   14   14   16   18   19   21   23   28   31   33   38   42   43   46   51 
LCS_GDT     V    54_A     V    54_A      5   14   21      1    4    8   11   12   14   14   16   18   19   21   23   28   31   33   38   42   44   51   57 
LCS_GDT     F    55_A     F    55_A      5   14   21      3    5    6    8   11   14   14   16   18   19   21   23   28   31   35   38   55   59   68   87 
LCS_GDT     P    56_A     P    56_A      4   14   68      3    4    5   11   11   14   14   16   19   27   39   48   56   62   79   88   98  104  110  115 
LCS_GDT     N    57_A     N    57_A      4   14   68      3    4    8   11   12   14   14   17   20   23   26   31   41   44   49   58   66   75   88   96 
LCS_GDT     N    58_A     N    58_A      4   14   68      3    4    7   11   12   14   14   16   18   19   21   29   35   41   49   58   64   76   87   95 
LCS_GDT     K    59_A     K    59_A      4   14   68      3    4    8   11   12   14   14   16   25   33   43   55   67   79   92  106  116  121  124  128 
LCS_GDT     R    60_A     R    60_A      3   14   68      3    3    5    9   12   14   14   19   33   42   48   66   80   95  108  112  119  121  124  128 
LCS_GDT     E    61_A     E    61_A      3   14   68      3    5    8   11   12   14   14   29   44   66   83   95  106  109  113  116  121  125  126  128 
LCS_GDT     K    62_A     K    62_A      4   14   68      3    3    5   14   45   65   77   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     S    63_A     S    63_A      4    8   68      3    3    5   20   42   61   75   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     D    64_A     D    64_A      4   13   68      3    3    6   13   25   64   77   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     I    65_A     I    65_A      5   13   68      3    5   17   24   47   65   78   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     L    66_A     L    66_A      5   13   68      3    8   19   36   53   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     V    67_A     V    67_A      5   13   68      6   16   35   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     F    68_A     F    68_A      5   13   68      3   16   35   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     H    69_A     H    69_A      5   13   68      3   12   35   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     N    70_A     N    70_A      5   13   68      3    9   17   37   57   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     G    71_A     G    71_A      3   13   68      2    4    8   12   20   45   71   86   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     E    72_A     E    72_A      5   23   68      3    4   11   34   53   66   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     V    73_A     V    73_A      5   24   68      3    9   27   42   56   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     K    74_A     K    74_A      5   24   68      5   18   35   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     T    75_A     T    75_A      5   24   68      3   16   35   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     E    76_A     E    76_A      5   24   68      3   10   24   40   57   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     T    77_A     T    77_A      5   24   68      3    4   18   36   56   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     N    78_A     N    78_A      3   45   68      3    5   24   42   55   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     H    79_A     H    79_A      4   45   68      3    3    8   15   26   50   65   80   94  101  104  107  110  113  114  118  122  125  126  126 
LCS_GDT     S    80_A     S    80_A     13   45   68      9   23   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     S    81_A     S    81_A     13   45   68      4   22   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     Y    82_A     Y    82_A     13   45   68      7   22   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     Q    83_A     Q    83_A     13   45   68      3   19   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     I    84_A     I    84_A     13   45   68      9   23   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     N    85_A     N    85_A     13   45   68      8   23   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     W    86_A     W    86_A     13   45   68      8   23   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     P    87_A     P    87_A     13   45   68      9   23   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     G    88_A     G    88_A     13   45   68      3   19   37   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     E    89_A     E    89_A     13   45   68      5   15   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     V    90_A     V    90_A     13   45   68      5   18   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     T    91_A     T    91_A     13   45   68      6   23   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     M    92_A     M    92_A     13   45   68      5   16   35   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     K    93_A     K    93_A     12   45   68      5   15   35   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     L    94_A     L    94_A      9   45   68      3    7   21   41   57   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     G    95_A     G    95_A      9   45   68      3    7   10   29   56   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     Y    96_A     Y    96_A      9   45   68      3    7   12   47   57   69   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     G    97_A     G    97_A      9   45   68      3    6   10   28   37   54   71   81   92  100  104  107  110  113  114  117  121  125  126  128 
LCS_GDT     D    98_A     D    98_A      7   45   68      3    4    9   18   44   55   65   85   92   99  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     G    99_A     G    99_A     11   45   68      4   23   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     L   100_A     L   100_A     11   45   68      4   23   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     V   101_A     V   101_A     11   45   68      4   21   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     I   102_A     I   102_A     11   45   68      4   23   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     K   103_A     K   103_A     11   45   68      4   22   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     D   104_A     D   104_A     11   45   68      9   23   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     L   105_A     L   105_A     11   45   68      3   16   35   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     N   106_A     N   106_A     11   45   68      7   23   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     L   107_A     L   107_A     11   45   68      5   23   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     M   108_A     M   108_A     11   45   68      9   23   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     L   109_A     L   109_A     11   45   68      3   19   37   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     K   110_A     K   110_A      6   45   68      3    6   25   50   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     N   111_A     N   111_A      6   45   68      3    6   23   48   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     G   112_A     G   112_A      6   45   68      4   17   36   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     N   113_A     N   113_A      9   45   68      6   19   37   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     M   114_A     M   114_A      9   45   68      4   14   29   43   56   67   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     G   115_A     G   115_A      9   45   68      4   19   37   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     E   116_A     E   116_A      9   45   68      9   23   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     L   117_A     L   117_A      9   45   68      4   23   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     K   118_A     K   118_A      9   45   68      9   23   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     A   119_A     A   119_A      9   45   68      9   23   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     T   120_A     T   120_A      9   45   68      5   23   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     V   121_A     V   121_A      9   45   68      6   23   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     G   122_A     G   122_A      8   45   68      3   16   35   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     E   123_A     E   123_A      4   25   68      4    4    9   22   36   49   58   66   85   96  104  106  110  113  114  118  122  125  126  128 
LCS_GDT     N   124_A     N   124_A      4    6   68      4    4    4    7    8   10   19   30   36   50   72   88   96  104  109  112  116  119  122  125 
LCS_GDT     S   125_A     S   125_A      4    6   68      4    4    4    6    6    7   10   11   17   19   19   25   32   37   54   64   82   94  108  114 
LCS_GDT     N   126_A     N   126_A      4    6   68      4    4    4    8   11   11   13   14   17   19   19   23   28   31   35   38   43   53   58   65 
LCS_GDT     I   127_A     I   127_A      4    6   66      3    4    5    8   11   11   13   14   17   19   23   27   32   36   48   51   59   62   73   74 
LCS_GDT     T   128_A     T   128_A      3    7   19      3    6    7    7    7    9   13   14   17   18   23   29   32   35   48   51   59   63   79   85 
LCS_GDT     L   129_A     L   129_A      7   11   19      4    5    7    8   11   11   13   14   17   18   23   28   32   36   48   51   59   62   79   89 
LCS_GDT     F   130_A     F   130_A      7   11   19      4    5    7    8   11   11   13   14   15   18   23   26   27   34   38   43   59   62   79   89 
LCS_GDT     D   131_A     D   131_A      7   11   19      4    5    7    8   11   12   13   14   21   22   37   38   38   42   50   59   70   76   84   89 
LCS_GDT     V   132_A     V   132_A      7   11   19      4    5    7    8   11   11   13   14   21   32   37   38   38   42   50   59   70   76   84   89 
LCS_GDT     Q   133_A     Q   133_A      7   11   19      3    5    7    8   11   12   13   19   23   32   37   38   38   40   44   55   66   73   79   87 
LCS_GDT     E   134_A     E   134_A      7   11   19      3    4    7    8   11   12   13   19   23   32   37   38   38   40   48   55   66   73   79   87 
LCS_GDT     Y   135_A     Y   135_A      7   11   19      3    5    7    8   11   11   13   17   23   32   37   38   38   42   50   59   70   76   84   89 
LCS_GDT     S   136_A     S   136_A      5   11   19      3    6    7    8   11   11   13   14   15   17   19   23   33   40   44   54   68   73   83   89 
LCS_GDT     V   137_A     V   137_A      5   11   19      3    4    6    7    9   11   13   14   15   15   16   18   21   27   35   41   47   51   54   58 
LCS_GDT     S   138_A     S   138_A      5   11   19      4    4    7    9    9   11   13   14   15   15   18   20   23   34   35   41   47   51   54   58 
LCS_GDT     D   139_A     D   139_A      4   11   19      4    4    6    7    8   11   11   13   15   16   18   20   23   25   29   31   34   38   41   47 
LCS_GDT     N   140_A     N   140_A      6    8   19      4    4    7    8   11   11   13   14   15   16   20   22   26   26   31   37   41   46   53   57 
LCS_GDT     T   141_A     T   141_A      6    8   19      4    5    6    7    8   10   14   16   19   23   25   29   38   43   46   58   62   70   84   85 
LCS_GDT     I   142_A     I   142_A      6    8   19      4    5    6    7    8   10   16   25   27   32   47   54   59   68   80   91   98  111  116  119 
LCS_GDT     T   143_A     T   143_A      6    8   18      4    5    6    7   10   16   25   39   47   72   82   90   98  105  111  112  117  119  122  125 
LCS_GDT     V   144_A     V   144_A      6    8   18      4    5    6    7   37   63   76   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     T   145_A     T   145_A      6    8   18      4    5    6    7   28   45   69   86   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     P   146_A     P   146_A      4    8   18      3    4    5    6    8   10   11   15   29   37   54   75   82  101  112  118  122  125  126  128 
LCS_GDT     K   147_A     K   147_A      4    8   18      3    4    5    6    8   10   11   13   14   18   19   23   43   57   72   92  104  111  117  124 
LCS_GDT     I   148_A     I   148_A      3    8   18      3    3    4    6    8   10   11   13   14   16   18   22   26   33   41   44   56   59   81   93 
LCS_GDT     P   149_A     P   149_A      3    8   18      3    3    4    6    8   10   11   13   14   16   18   22   26   28   31   36   45   51   57   60 
LCS_GDT     P   150_A     P   150_A      3    8   18      3    3    4    6    8   10   11   13   14   16   18   20   23   25   29   30   35   40   44   48 
LCS_GDT     C   151_A     C   151_A      3    8   18      3    3    4    6    8    9   11   13   14   16   18   20   23   25   29   30   34   37   39   43 
LCS_GDT     T   152_A     T   152_A      3    8   18      3    3    4    5    8    8   10   13   14   16   18   20   23   29   31   34   38   41   49   53 
LCS_GDT     T   153_A     T   153_A      3    8   18      3    3    4    5    8    9    9   12   13   14   18   20   23   29   31   34   38   43   49   53 
LCS_GDT     G   154_A     G   154_A      4    7   18      3    4    6    6    8    9    9   12   13   14   15   20   22   29   31   34   38   43   49   53 
LCS_GDT     T   155_A     T   155_A      5    7   18      3    4    6    6    8    9    9   12   13   14   15   20   22   29   31   34   38   43   49   53 
LCS_GDT     W   156_A     W   156_A      5    7   18      3    4    6    6    8    9    9   12   13   14   17   22   26   29   31   35   38   43   50   56 
LCS_GDT     K   157_A     K   157_A      5    7   18      3    4    6    6    8    9    9   12   13   14   16   22   26   29   31   36   45   50   57   61 
LCS_GDT     P   158_A     P   158_A      5    7   18      3    4    6    6    8    9   11   14   24   29   32   42   47   59   65   73  100  103  118  124 
LCS_GDT     W   159_A     W   159_A      5    7   20      3    4    6    6    8    9   11   14   24   29   43   60   72   90   95  110  121  125  126  126 
LCS_GDT     H   160_A     H   160_A      4    7   20      3    4    5    5   10   19   27   46   50   59   83   90   95  104  110  117  122  125  126  128 
LCS_GDT     N   161_A     N   161_A      4    5   20      3    4    5    5    5    8   13   28   34   39   48   65   80   98  102  113  122  125  126  128 
LCS_GDT     D   162_A     D   162_A      4    7   20      3    4    5   11   26   33   40   58   65   75   88  101  107  110  114  117  122  125  126  128 
LCS_GDT     L   163_A     L   163_A      5    7   20      4    5   16   29   47   56   73   87   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     T   164_A     T   164_A      5    7   20      4    5   17   34   47   58   74   88   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     S   165_A     S   165_A      5    7   20      4    5   17   34   47   57   73   86   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     K   166_A     K   166_A      5    7   20      4    5   11   29   44   57   74   88   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     L   167_A     L   167_A      5    7   23      4    5    9   20   42   59   74   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     G   168_A     G   168_A      4    7   23      3    5    8   18   33   46   56   73   85   98  103  107  109  113  114  118  122  125  126  128 
LCS_GDT     S   169_A     S   169_A      4    6   25      3    4    5   10   16   22   59   72   87   96  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     L   170_A     L   170_A      4    6   27      3    4    5    5   10   14   16   27   50   91  101  107  109  113  114  118  122  125  126  128 
LCS_GDT     K   171_A     K   171_A      4    6   27      3    4    5    6   10   31   47   60   88   94  101  106  109  113  114  118  122  125  126  128 
LCS_GDT     S   172_A     S   172_A      4    6   27      3    4   25   39   53   70   79   88   93  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     V   173_A     V   173_A      3    6   27      3    3    4    6   38   50   76   86   91   98  103  106  110  113  114  118  122  125  126  128 
LCS_GDT     F   174_A     F   174_A      3    6   27      9   23   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     F   175_A     F   175_A      4    8   27      4   23   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     E   176_A     E   176_A      5    8   27      3    5   29   46   58   67   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     S   177_A     S   177_A      5    8   27      3    4    6    8    9   17   40   49   64   87  102  107  110  113  114  118  122  125  126  128 
LCS_GDT     Y   178_A     Y   178_A      5    8   27      3    4    6    8    9   10   11   24   35   45   68   90  100  108  113  118  122  125  126  128 
LCS_GDT     T   179_A     T   179_A      5    8   27      3    4    6    8    9   10   11   18   34   45   55   72   91  107  113  118  122  125  126  128 
LCS_GDT     C   180_A     C   180_A      5    8   27      3    4    6    8    9   10   11   24   35   45   67   89   99  108  113  118  122  125  126  128 
LCS_GDT     N   181_A     N   181_A      5    8   27      3    4    6    8    9   10   11   18   31   43   54   67   78   91  102  115  120  125  126  128 
LCS_GDT     N   182_A     N   182_A      3    8   27      3    3    4    6    7   10   19   25   36   74   83   93  100  109  113  118  122  125  126  128 
LCS_GDT     D   183_A     D   183_A      3    8   27      3    3    5    8    9   10   19   25   35   45   55   72   84   96  113  116  122  125  126  128 
LCS_GDT     D   184_A     D   184_A      3    5   27      3    3    4    6   13   20   25   47   58   72   79   85   97  108  113  118  122  125  126  128 
LCS_GDT     I   185_A     I   185_A      5    9   27      3    9   20   36   53   66   79   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     A   186_A     A   186_A      5    9   27      4   17   34   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     K   187_A     K   187_A      5   12   27      3    6   18   49   58   69   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     K   188_A     K   188_A      5   12   27      3    8   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     P   189_A     P   189_A      5   12   27      3   15   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     L   190_A     L   190_A      8   12   27      3    8   18   30   47   62   76   88   93  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     P   191_A     P   191_A      8   12   27      3    8   20   36   51   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     L   192_A     L   192_A      8   12   27      3   14   30   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     T   193_A     T   193_A      8   12   27      3   17   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     V   194_A     V   194_A      8   12   27      4   23   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     V   195_A     V   195_A      8   12   27      3   14   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     L   196_A     L   196_A      8   12   27      4   23   38   52   62   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     N   197_A     N   197_A      8   12   27      3    6   17   30   53   65   78   88   94  101  104  107  110  113  114  118  122  125  126  128 
LCS_GDT     G   198_A     G   198_A      6   12   27      3   11   28   42   58   70   80   89   95  101  104  107  110  113  114  118  122  125  126  128 
LCS_AVERAGE  LCS_A:  10.57  (   3.06    8.95   19.71 )

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      9     23     38     52     62     70     80     89     95    101    104    107    110    113    114    118    122    125    126    128 
GDT PERCENT_AT   4.55  11.62  19.19  26.26  31.31  35.35  40.40  44.95  47.98  51.01  52.53  54.04  55.56  57.07  57.58  59.60  61.62  63.13  63.64  64.65
GDT RMS_LOCAL    0.37   0.71   0.99   1.31   1.61   1.83   2.08   2.38   2.60   2.78   2.91   3.06   3.22   3.37   3.43   3.99   4.33   4.49   4.60   4.83
GDT RMS_ALL_AT  14.27  14.37  14.44  14.28  14.19  14.19  14.13  14.08  14.06  14.12  14.09  14.09  14.11  14.12  14.10  14.15  14.16  14.14  14.15  14.05

# Checking swapping
#   possible swapping detected:  E     3_A      E     3_A
#   possible swapping detected:  Y    10_A      Y    10_A
#   possible swapping detected:  F    13_A      F    13_A
#   possible swapping detected:  E    29_A      E    29_A
#   possible swapping detected:  E    36_A      E    36_A
#   possible swapping detected:  F    50_A      F    50_A
#   possible swapping detected:  F    68_A      F    68_A
#   possible swapping detected:  E    72_A      E    72_A
#   possible swapping detected:  E    89_A      E    89_A
#   possible swapping detected:  D    98_A      D    98_A
#   possible swapping detected:  D   104_A      D   104_A
#   possible swapping detected:  F   130_A      F   130_A
#   possible swapping detected:  D   131_A      D   131_A
#   possible swapping detected:  D   139_A      D   139_A
#   possible swapping detected:  F   174_A      F   174_A
#   possible swapping detected:  F   175_A      F   175_A
#   possible swapping detected:  E   176_A      E   176_A
#   possible swapping detected:  D   184_A      D   184_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    S     1_A      S     1_A    21.132     0    0.014   0.601    23.458    0.000    0.000
LGA    E     2_A      E     2_A    15.610     0    0.412   1.320    17.278    0.000    0.000
LGA    E     3_A      E     3_A    12.635     0    0.103   0.848    19.980    0.119    0.053
LGA    V     4_A      V     4_A     9.420     0    0.564   0.525    13.991    7.024    4.014
LGA    K     5_A      K     5_A     3.167     0    0.418   1.065     6.477   47.619   35.661
LGA    N     6_A      N     6_A     2.826     0    0.144   0.621     5.201   59.048   46.071
LGA    A     7_A      A     7_A     1.621     0    0.096   0.131     1.882   77.143   78.000
LGA    D     8_A      D     8_A     1.347     0    0.176   0.347     2.062   79.286   76.131
LGA    L     9_A      L     9_A     0.878     0    0.133   0.828     1.736   88.214   81.607
LGA    Y    10_A      Y    10_A     2.617     0    0.098   1.478     9.638   65.119   36.548
LGA    W    11_A      W    11_A     3.440     0    0.214   1.373     5.682   53.571   41.190
LGA    G    12_A      G    12_A     1.229     0    0.434   0.434     3.771   67.619   67.619
LGA    F    13_A      F    13_A     1.894     0    0.589   1.169     4.850   67.262   57.792
LGA    S    14_A      S    14_A     7.281     0    0.468   0.446     8.325   12.143    9.683
LGA    G    15_A      G    15_A     6.251     0    0.109   0.109     7.005   27.143   27.143
LGA    S    16_A      S    16_A     4.754     0    0.065   0.066     7.760   37.738   28.571
LGA    S    17_A      S    17_A     4.130     0    0.098   0.687     4.835   45.357   40.714
LGA    H    18_A      H    18_A     2.429     0    0.428   1.540     5.516   64.881   51.524
LGA    H    19_A      H    19_A     2.281     0    0.043   1.058     8.178   62.857   41.143
LGA    K    20_A      K    20_A     2.327     0    0.130   0.383     6.370   59.167   44.974
LGA    Y    21_A      Y    21_A     3.714     0    0.300   0.379     8.729   42.024   23.968
LGA    D    22_A      D    22_A     3.235     0    0.165   1.159     5.927   41.429   39.107
LGA    H    23_A      H    23_A     4.196     0    0.598   1.390     7.598   28.452   25.857
LGA    N    24_A      N    24_A     5.707     0    0.256   1.087     9.579   16.548   33.452
LGA    G    25_A      G    25_A     9.723     0    0.538   0.538    10.780    2.619    2.619
LGA    P    26_A      P    26_A    10.230     0    0.117   0.343    12.715    0.000    0.000
LGA    K    27_A      K    27_A    12.566     0    0.607   0.821    18.038    0.000    0.000
LGA    F    28_A      F    28_A    16.712     0    0.631   1.516    19.402    0.000    0.000
LGA    E    29_A      E    29_A    19.646     0    0.431   0.521    23.238    0.000    0.000
LGA    K    30_A      K    30_A    20.515     0    0.241   0.948    27.792    0.000    0.000
LGA    A    31_A      A    31_A    20.030     0    0.074   0.076    20.199    0.000    0.000
LGA    G    32_A      G    32_A    21.331     0    0.164   0.164    21.511    0.000    0.000
LGA    K    33_A      K    33_A    22.090     0    0.572   1.053    22.299    0.000    0.000
LGA    G    34_A      G    34_A    20.325     0    0.634   0.634    20.870    0.000    0.000
LGA    A    35_A      A    35_A    13.530     0    0.067   0.066    15.812    0.000    0.000
LGA    E    36_A      E    36_A     9.709     0    0.091   0.808    17.678    1.190    0.529
LGA    L    37_A      L    37_A     7.867     0    0.162   1.389    11.461    3.571   12.560
LGA    T    38_A      T    38_A    14.110     0    0.134   0.176    18.466    0.000    0.000
LGA    N    39_A      N    39_A    18.263     0    0.064   1.180    22.360    0.000    0.000
LGA    I    40_A      I    40_A    19.722     0    0.146   1.327    22.670    0.000    0.000
LGA    D    41_A      D    41_A    24.186     0    0.634   1.268    28.189    0.000    0.000
LGA    A    42_A      A    42_A    24.688     0    0.464   0.477    24.688    0.000    0.000
LGA    A    43_A      A    43_A    24.910     0    0.312   0.340    25.604    0.000    0.000
LGA    S    44_A      S    44_A    26.951     0    0.617   0.748    30.204    0.000    0.000
LGA    A    45_A      A    45_A    29.446     0    0.591   0.578    30.499    0.000    0.000
LGA    Y    46_A      Y    46_A    24.933     0    0.622   1.435    26.789    0.000    0.000
LGA    A    47_A      A    47_A    26.390     0    0.607   0.563    26.835    0.000    0.000
LGA    E    48_A      E    48_A    28.486     0    0.596   0.974    34.809    0.000    0.000
LGA    T    49_A      T    49_A    26.289     0    0.613   1.353    28.128    0.000    0.000
LGA    F    50_A      F    50_A    20.425     0    0.152   1.128    22.296    0.000    0.000
LGA    K    51_A      K    51_A    23.126     0    0.119   1.111    26.142    0.000    0.000
LGA    K    52_A      K    52_A    29.192     0    0.090   0.935    37.312    0.000    0.000
LGA    G    53_A      G    53_A    28.721     0    0.649   0.649    29.607    0.000    0.000
LGA    V    54_A      V    54_A    25.943     0    0.058   0.090    26.717    0.000    0.000
LGA    F    55_A      F    55_A    23.520     0    0.200   1.229    26.612    0.000    0.000
LGA    P    56_A      P    56_A    19.116     0    0.458   0.901    20.872    0.000    0.000
LGA    N    57_A      N    57_A    23.841     0    0.073   1.340    29.862    0.000    0.000
LGA    N    58_A      N    58_A    21.103     0    0.505   0.491    27.983    0.000    0.000
LGA    K    59_A      K    59_A    13.946     0    0.158   0.970    16.405    0.000    0.000
LGA    R    60_A      R    60_A    12.260     0    0.683   1.303    20.739    1.310    0.476
LGA    E    61_A      E    61_A     8.863     0    0.389   1.153    15.450    7.381    3.280
LGA    K    62_A      K    62_A     3.786     0    0.525   1.452     5.590   33.214   40.423
LGA    S    63_A      S    63_A     4.726     0    0.301   0.338     7.896   35.833   27.937
LGA    D    64_A      D    64_A     3.802     0    0.035   1.159     8.201   40.357   26.369
LGA    I    65_A      I    65_A     3.782     0    0.107   1.483     8.840   43.452   26.607
LGA    L    66_A      L    66_A     3.057     0    0.275   1.352     3.596   57.381   54.702
LGA    V    67_A      V    67_A     1.479     0    0.238   1.032     3.631   71.071   66.599
LGA    F    68_A      F    68_A     1.386     0    0.136   0.779     2.924   79.286   71.602
LGA    H    69_A      H    69_A     1.491     0    0.280   1.175     6.341   72.976   54.667
LGA    N    70_A      N    70_A     2.650     0    0.445   0.910     5.519   49.524   37.917
LGA    G    71_A      G    71_A     4.740     0    0.708   0.708     4.740   40.476   40.476
LGA    E    72_A      E    72_A     3.345     0    0.549   1.164     6.733   40.714   34.339
LGA    V    73_A      V    73_A     2.707     0    0.232   1.120     4.555   57.262   54.626
LGA    K    74_A      K    74_A     1.417     0    0.512   0.787     6.607   65.595   55.820
LGA    T    75_A      T    75_A     1.594     0    0.325   1.083     4.355   75.000   62.721
LGA    E    76_A      E    76_A     2.911     0    0.299   0.792     3.827   57.143   52.434
LGA    T    77_A      T    77_A     3.003     0    0.549   0.993     6.372   55.476   45.646
LGA    N    78_A      N    78_A     3.460     0    0.363   0.940     4.882   43.929   44.524
LGA    H    79_A      H    79_A     6.127     0    0.547   1.193    11.907   26.548   11.143
LGA    S    80_A      S    80_A     1.328     0    0.480   0.474     4.310   69.762   63.492
LGA    S    81_A      S    81_A     1.965     0    0.117   0.699     2.383   75.119   71.667
LGA    Y    82_A      Y    82_A     1.029     0    0.071   0.337     2.638   88.333   74.762
LGA    Q    83_A      Q    83_A     1.230     0    0.101   0.738     5.772   85.952   64.497
LGA    I    84_A      I    84_A     1.070     0    0.072   0.193     1.448   81.429   81.429
LGA    N    85_A      N    85_A     1.005     0    0.131   1.167     4.137   81.548   67.083
LGA    W    86_A      W    86_A     0.646     0    0.059   0.350     1.410   92.857   89.252
LGA    P    87_A      P    87_A     1.251     0    0.622   0.697     3.077   73.571   75.782
LGA    G    88_A      G    88_A     1.538     0    0.050   0.050     1.694   72.857   72.857
LGA    E    89_A      E    89_A     2.327     0    0.066   0.636     5.110   68.810   49.577
LGA    V    90_A      V    90_A     2.166     0    0.060   1.104     3.352   75.357   66.531
LGA    T    91_A      T    91_A     1.234     0    0.101   0.140     1.396   81.429   81.429
LGA    M    92_A      M    92_A     1.745     0    0.039   0.856     3.299   75.000   73.214
LGA    K    93_A      K    93_A     1.634     0    0.111   0.588     3.908   70.833   59.418
LGA    L    94_A      L    94_A     2.985     0    0.269   1.509     6.997   62.976   51.131
LGA    G    95_A      G    95_A     3.203     0    0.210   0.210     3.396   50.000   50.000
LGA    Y    96_A      Y    96_A     3.276     0    0.175   1.296    12.244   42.619   25.397
LGA    G    97_A      G    97_A     6.047     0    0.549   0.549     6.047   24.286   24.286
LGA    D    98_A      D    98_A     6.096     0    0.243   1.454    11.909   33.690   17.440
LGA    G    99_A      G    99_A     1.339     0    0.496   0.496     3.223   67.262   67.262
LGA    L   100_A      L   100_A     1.525     0    0.064   0.265     2.793   79.286   73.095
LGA    V   101_A      V   101_A     1.677     0    0.089   1.092     3.131   75.000   69.660
LGA    I   102_A      I   102_A     1.086     0    0.153   1.249     3.321   83.690   74.524
LGA    K   103_A      K   103_A     0.733     0    0.590   1.115     3.798   78.810   75.608
LGA    D   104_A      D   104_A     0.710     0    0.279   0.910     3.126   90.476   76.905
LGA    L   105_A      L   105_A     1.131     0    0.132   1.090     3.027   85.952   78.690
LGA    N   106_A      N   106_A     1.063     0    0.067   0.114     2.256   90.595   80.774
LGA    L   107_A      L   107_A     1.279     0    0.099   0.725     2.820   79.286   76.250
LGA    M   108_A      M   108_A     1.016     0    0.106   0.948     1.908   85.952   80.476
LGA    L   109_A      L   109_A     2.238     0    0.230   0.523     4.325   66.786   57.798
LGA    K   110_A      K   110_A     2.469     0    0.605   0.895     9.047   61.429   40.529
LGA    N   111_A      N   111_A     2.713     0    0.049   0.806     7.103   60.952   42.321
LGA    G   112_A      G   112_A     1.853     0    0.113   0.113     2.759   71.071   71.071
LGA    N   113_A      N   113_A     2.082     0    0.112   0.295     4.437   60.595   70.060
LGA    M   114_A      M   114_A     3.308     0    0.252   0.993     4.992   48.333   46.845
LGA    G   115_A      G   115_A     1.822     0    0.118   0.118     2.252   77.381   77.381
LGA    E   116_A      E   116_A     0.544     0    0.079   0.093     3.251   86.071   73.651
LGA    L   117_A      L   117_A     0.959     0    0.096   1.144     5.113   92.857   69.702
LGA    K   118_A      K   118_A     0.687     0    0.064   1.091     8.685   88.214   58.942
LGA    A   119_A      A   119_A     0.513     0    0.073   0.089     1.615   86.190   85.238
LGA    T   120_A      T   120_A     1.201     0    0.075   0.952     2.321   81.429   77.823
LGA    V   121_A      V   121_A     0.928     0    0.062   0.086     2.235   79.524   79.116
LGA    G   122_A      G   122_A     1.983     0    0.344   0.344     5.774   52.619   52.619
LGA    E   123_A      E   123_A     6.613     0    0.582   1.086    11.332   15.595    8.571
LGA    N   124_A      N   124_A    10.729     0    0.068   0.789    14.697    0.714    0.357
LGA    S   125_A      S   125_A    16.998     0    0.334   0.399    20.197    0.000    0.000
LGA    N   126_A      N   126_A    23.279     0    0.449   0.397    26.782    0.000    0.000
LGA    I   127_A      I   127_A    20.378     0    0.289   0.563    20.894    0.000    0.000
LGA    T   128_A      T   128_A    19.797     0    0.233   0.281    21.088    0.000    0.000
LGA    L   129_A      L   129_A    17.337     0    0.576   0.849    21.760    0.000    0.000
LGA    F   130_A      F   130_A    18.940     0    0.086   1.176    21.471    0.000    0.000
LGA    D   131_A      D   131_A    20.892     0    0.165   1.043    23.544    0.000    0.000
LGA    V   132_A      V   132_A    20.606     0    0.077   0.159    20.772    0.000    0.000
LGA    Q   133_A      Q   133_A    22.812     0    0.494   1.484    30.895    0.000    0.000
LGA    E   134_A      E   134_A    21.992     0    0.345   1.193    28.100    0.000    0.000
LGA    Y   135_A      Y   135_A    21.024     0    0.066   1.421    25.015    0.000    0.000
LGA    S   136_A      S   136_A    21.574     0    0.126   0.166    22.541    0.000    0.000
LGA    V   137_A      V   137_A    22.417     0    0.189   1.141    24.786    0.000    0.000
LGA    S   138_A      S   138_A    24.738     0    0.269   0.886    27.599    0.000    0.000
LGA    D   139_A      D   139_A    29.753     0    0.543   0.934    34.081    0.000    0.000
LGA    N   140_A      N   140_A    27.327     0    0.577   1.162    33.264    0.000    0.000
LGA    T   141_A      T   141_A    20.957     0    0.135   1.342    23.142    0.000    0.000
LGA    I   142_A      I   142_A    14.429     0    0.080   1.203    17.069    0.000    0.000
LGA    T   143_A      T   143_A    10.179     0    0.077   1.087    13.400    5.000    2.857
LGA    V   144_A      V   144_A     4.168     0    0.194   0.259     6.464   27.143   29.796
LGA    T   145_A      T   145_A     5.160     0    0.069   0.095     7.602   23.333   29.252
LGA    P   146_A      P   146_A    10.985     0    0.181   0.423    12.980    0.357    0.408
LGA    K   147_A      K   147_A    16.554     0    0.281   1.177    20.761    0.000    0.000
LGA    I   148_A      I   148_A    20.232     0    0.431   0.400    22.414    0.000    0.000
LGA    P   149_A      P   149_A    24.590     0    0.415   0.825    27.493    0.000    0.000
LGA    P   150_A      P   150_A    28.956     0    0.602   0.606    31.380    0.000    0.000
LGA    C   151_A      C   151_A    35.549     0    0.575   1.127    38.788    0.000    0.000
LGA    T   152_A      T   152_A    38.138     0    0.485   1.023    38.307    0.000    0.000
LGA    T   153_A      T   153_A    40.123     0    0.232   0.312    41.748    0.000    0.000
LGA    G   154_A      G   154_A    37.856     0    0.576   0.576    38.405    0.000    0.000
LGA    T   155_A      T   155_A    32.638     0    0.168   1.104    34.729    0.000    0.000
LGA    W   156_A      W   156_A    26.603     0    0.259   1.623    28.909    0.000    0.000
LGA    K   157_A      K   157_A    22.422     0    0.206   1.037    26.565    0.000    0.000
LGA    P   158_A      P   158_A    15.713     0    0.615   0.600    20.576    0.000    0.000
LGA    W   159_A      W   159_A    12.558     0    0.416   1.125    18.334    0.000    0.000
LGA    H   160_A      H   160_A    10.293     0    0.033   0.964    15.462    0.000    0.000
LGA    N   161_A      N   161_A    11.221     0    0.079   1.372    16.274    0.000    0.000
LGA    D   162_A      D   162_A     9.026     0    0.463   0.934     9.417    4.286    3.631
LGA    L   163_A      L   163_A     4.989     0    0.108   0.903     6.493   27.857   33.274
LGA    T   164_A      T   164_A     4.921     0    0.021   1.073     7.349   30.119   27.687
LGA    S   165_A      S   165_A     5.511     0    0.039   0.667     8.355   25.000   21.032
LGA    K   166_A      K   166_A     5.104     0    0.246   0.924     6.491   30.238   25.556
LGA    L   167_A      L   167_A     4.382     0    0.050   0.164     6.885   34.286   28.631
LGA    G   168_A      G   168_A     6.979     0    0.089   0.089     7.694   12.738   12.738
LGA    S   169_A      S   169_A     7.063     0    0.622   0.810    10.013   21.429   14.762
LGA    L   170_A      L   170_A     7.514     0    0.090   0.087    13.298    7.976    4.167
LGA    K   171_A      K   171_A     6.633     0    0.379   0.711     7.992   23.810   16.190
LGA    S   172_A      S   172_A     4.049     0    0.032   0.033     5.089   37.262   34.444
LGA    V   173_A      V   173_A     5.415     0    0.597   0.546     8.780   31.786   21.429
LGA    F   174_A      F   174_A     1.422     0    0.601   1.430     9.095   83.690   44.069
LGA    F   175_A      F   175_A     1.760     0    0.636   1.345     8.729   68.929   41.732
LGA    E   176_A      E   176_A     3.008     0    0.025   1.102    10.616   38.929   24.656
LGA    S   177_A      S   177_A     7.284     0    0.259   0.335     8.491   11.429    9.206
LGA    Y   178_A      Y   178_A    11.273     0    0.459   0.615    16.445    0.119    0.040
LGA    T   179_A      T   179_A    12.263     0    0.090   0.109    15.399    1.786    1.020
LGA    C   180_A      C   180_A    10.113     0    0.407   0.512    12.733    0.357    0.238
LGA    N   181_A      N   181_A    13.653     0    0.206   1.010    19.938    0.000    0.000
LGA    N   182_A      N   182_A    11.259     0    0.236   0.309    12.010    0.000    0.000
LGA    D   183_A      D   183_A    12.799     0    0.481   1.291    17.409    0.357    0.179
LGA    D   184_A      D   184_A    10.149     0    0.571   1.455    14.720    1.548    0.774
LGA    I   185_A      I   185_A     3.848     0    0.264   1.576     5.703   39.524   57.381
LGA    A   186_A      A   186_A     1.746     0    0.317   0.318     3.422   57.500   62.286
LGA    K   187_A      K   187_A     3.258     0    0.092   0.399     5.323   55.357   44.815
LGA    K   188_A      K   188_A     2.337     0    0.569   0.964     4.281   55.952   53.862
LGA    P   189_A      P   189_A     2.590     0    0.188   0.523     5.052   57.500   49.932
LGA    L   190_A      L   190_A     4.390     0    0.594   1.397     9.559   45.238   24.881
LGA    P   191_A      P   191_A     3.388     0    0.078   0.254     3.928   50.119   50.068
LGA    L   192_A      L   192_A     1.939     0    0.115   0.994     4.016   65.000   64.524
LGA    T   193_A      T   193_A     1.916     0    0.091   0.095     2.795   79.405   70.952
LGA    V   194_A      V   194_A     2.000     0    0.210   1.366     4.154   66.786   64.354
LGA    V   195_A      V   195_A     2.379     0    0.047   1.123     3.766   64.762   59.592
LGA    L   196_A      L   196_A     2.020     0    0.075   0.651     4.092   54.167   63.690
LGA    N   197_A      N   197_A     4.325     0    0.066   1.300    10.447   54.286   30.000
LGA    G   198_A      G   198_A     3.048     0    0.628   0.628     3.940   50.119   50.119

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      198     792    792  100.00    1543   1543  100.00               198
SUMMARY(RMSD_GDC):    13.144         13.114                 13.610           32.874   28.877

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  198  198    4.0     89    2.38    35.606    31.009     3.588

LGA_LOCAL      RMSD:   2.380  Number of atoms:   89  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  14.079  Number of assigned atoms:  198 
Std_ASGN_ATOMS RMSD:  13.144  Standard rmsd on all 198 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.782179 * X  +  -0.323269 * Y  +  -0.532628 * Z  +  20.671072
  Y_new =   0.332509 * X  +  -0.506368 * Y  +   0.795631 * Z  + -62.062630
  Z_new =  -0.526909 * X  +  -0.799430 * Y  +  -0.288581 * Z  + -16.004612 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  0.401961  0.554960 -1.917222   [DEG:   23.0306   31.7968 -109.8487 ]
ZXZ: -2.551672  1.863540 -2.558843   [DEG: -146.2000  106.7730 -146.6109 ]
 
# END of job
