
#######################################################
#                                                     #
#                        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  251 ( 2082),  selected  239 , name one
# Molecule2: number of CA atoms  239 ( 1967),  selected  239 , 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:    47      63_A - 109_A       4.76    23.63
  LONGEST_CONTINUOUS_SEGMENT:    47      64_A - 110_A       4.82    24.04
  LCS_AVERAGE:     16.10

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    16      87_A - 102_A       1.74    26.11
  LCS_AVERAGE:      3.45

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:     9      46_A - 54_A        0.96    26.83
  LCS_AVERAGE:      1.77

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  239
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     N     2_A     N     2_A      0   10   45      0    3    7   12   18   24   30   36   43   48   52   62   68   71   76   83   90   94  100  104 
LCS_GDT     S     3_A     S     3_A      3   10   45      1    3    8   12   18   24   30   36   43   48   52   62   67   70   75   81   89   94   98  104 
LCS_GDT     T     4_A     T     4_A      3   10   45      2    4    8   11   17   22   28   36   43   48   52   62   68   72   77   85   91   95  103  111 
LCS_GDT     E     5_A     E     5_A      5   10   45      4    5    6   11   14   17   24   32   38   43   52   62   67   70   75   82   90   94   98  102 
LCS_GDT     N     6_A     N     6_A      5   10   45      4    5    6   11   15   22   26   33   39   48   52   62   68   72   77   85   91   95  103  111 
LCS_GDT     K     7_A     K     7_A      5   10   45      4    5    8   12   18   24   30   36   43   48   52   62   68   74   77   85   91  100  107  112 
LCS_GDT     N     8_A     N     8_A      6   10   45      4    6    9   15   20   26   30   37   43   50   56   65   75   79   87   94   99  105  108  112 
LCS_GDT     F     9_A     F     9_A      6   10   45      4    6    8   15   19   26   30   40   44   52   57   65   75   79   87   94   99  105  108  112 
LCS_GDT     V    10_A     V    10_A      6   10   45      4    7   13   17   23   33   37   42   49   61   68   75   82   84   90   96  100  105  108  112 
LCS_GDT     I    11_A     I    11_A      6   10   45      4    7   13   17   26   33   37   42   49   61   68   75   82   84   90   96  100  105  108  112 
LCS_GDT     S    12_A     S    12_A      6    9   45      3    7   13   20   26   33   37   42   49   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     I    13_A     I    13_A      6    8   45      3    5   12   20   26   33   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     S    14_A     S    14_A      4    8   45      3    4    8   13   20   26   35   42   48   54   62   74   81   83   90   96  100  105  108  112 
LCS_GDT     T    15_A     T    15_A      3    8   45      3    7   13   20   26   33   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     A    16_A     A    16_A      3    8   45      3    7   13   20   26   33   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     E    17_A     E    17_A      3    8   45      3    7   12   20   26   33   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     Q    18_A     Q    18_A      3    5   45      4    5    8   14   21   30   37   42   50   61   69   75   82   84   90   95  100  105  108  112 
LCS_GDT     R    19_A     R    19_A      3    5   45      4    4    8   14   21   30   37   42   49   61   69   75   82   84   90   95  100  105  108  112 
LCS_GDT     R    20_A     R    20_A      3    4   45      4    4   13   20   26   33   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     N    21_A     N    21_A      3    4   45      3    6   13   16   26   33   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     H    22_A     H    22_A      3    4   45      3    5    8   12   20   30   37   39   49   58   63   74   81   84   88   94   99  105  108  111 
LCS_GDT     I    23_A     I    23_A      3    4   45      3    5    8   15   22   33   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     I    24_A     I    24_A      3    4   45      3    5   12   20   23   29   36   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     E    25_A     E    25_A      3    4   45      3    4   13   16   26   33   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     Q    26_A     Q    26_A      3    4   45      3    3    8   12   20   30   37   42   49   59   69   75   82   84   90   95  100  105  108  112 
LCS_GDT     F    27_A     F    27_A      3    4   45      3    4    8   20   22   29   36   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     T    28_A     T    28_A      3    4   45      3    5   12   20   23   29   36   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     H    29_A     H    29_A      3   10   45      3    4    8   13   21   30   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     Q    30_A     Q    30_A      4   10   45      3    3    7   12   18   30   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     N    31_A     N    31_A      4   10   45      3    4   10   14   20   29   36   41   49   61   68   75   82   84   90   96  100  105  108  112 
LCS_GDT     I    32_A     I    32_A      5   10   45      4    6   10   14   20   25   35   41   47   56   66   74   82   84   90   96  100  105  108  112 
LCS_GDT     P    33_A     P    33_A      5   10   45      4    6    9   13   19   22   26   34   42   49   54   62   70   76   83   89   94  104  108  112 
LCS_GDT     F    34_A     F    34_A      5   10   45      4    6    9   14   19   24   29   36   43   49   55   62   70   78   84   89   95  104  108  112 
LCS_GDT     E    35_A     E    35_A      5   10   45      4    6    9   12   19   22   26   32   41   45   54   62   70   74   77   85   90   96  103  111 
LCS_GDT     F    36_A     F    36_A      5   10   45      3    5    8   13   19   22   28   34   42   49   54   62   70   77   83   89   92   99  107  112 
LCS_GDT     F    37_A     F    37_A      4   10   45      3    7   10   14   19   22   26   33   42   49   54   61   70   74   78   89   92   96  104  111 
LCS_GDT     D    38_A     D    38_A      4   10   45      3    6   10   15   19   25   29   34   42   49   54   61   70   74   83   89   92   97  104  111 
LCS_GDT     A    39_A     A    39_A      3   10   45      3    6   13   15   26   33   37   42   48   52   58   67   75   82   88   96  100  105  108  112 
LCS_GDT     F    40_A     F    40_A      3   10   45      3    6   13   15   26   33   37   42   48   52   57   64   75   79   87   96   99  105  108  112 
LCS_GDT     T    41_A     T    41_A      3   10   45      3    6    9   15   26   33   37   42   49   54   63   74   81   84   90   96  100  105  108  112 
LCS_GDT     P    42_A     P    42_A      3    8   45      3    3    4    8   18   23   34   41   49   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     S    43_A     S    43_A      3    7   45      3    5    7   13   26   33   37   42   49   54   61   67   75   81   88   96  100  105  108  112 
LCS_GDT     D    44_A     D    44_A      3    4   45      3    5    7   13   19   22   28   34   42   51   59   65   75   80   88   96   99  105  108  112 
LCS_GDT     K    45_A     K    45_A      3    4   45      3    3    4    9   15   22   29   39   48   54   61   66   75   81   88   96  100  105  108  112 
LCS_GDT     L    46_A     L    46_A      9   10   45      3    3    8   10   18   25   34   40   48   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     T    47_A     T    47_A      9   14   44      4    7   10   20   23   28   36   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     D    48_A     D    48_A      9   14   42      4    7    9   12   19   27   35   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     H    49_A     H    49_A      9   14   42      4    7   10   13   20   28   36   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     L    50_A     L    50_A      9   14   42      3    7   10   20   23   28   36   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     Q    51_A     Q    51_A      9   14   42      3    7   12   20   23   28   36   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     R    52_A     R    52_A      9   14   42      3    7   12   20   23   28   36   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     Y    53_A     Y    53_A      9   14   42      4    7    9   13   21   28   36   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     L    54_A     L    54_A      9   14   42      3    4    9   13   23   28   36   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     P    55_A     P    55_A      4   14   42      3    4    8   14   18   24   32   42   49   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     N    56_A     N    56_A      4   14   42      4    4    8   13   21   30   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     V    57_A     V    57_A      4   14   42      4    4    7   14   18   29   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     A    58_A     A    58_A      4   14   42      4    4    5   11   16   20   32   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     N    59_A     N    59_A      4   14   42      4    4    8   10   16   21   32   37   42   48   54   75   82   84   90   96  100  105  108  112 
LCS_GDT     A    60_A     A    60_A      4   14   42      3    4    8   16   19   27   36   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     A    61_A     A    61_A      4    5   42      3    3    5    7   10   12   28   36   43   52   67   75   82   84   90   96  100  105  108  112 
LCS_GDT     Q    62_A     Q    62_A      4    6   46      3    6    9   15   21   30   37   42   49   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     L    63_A     L    63_A      4    6   47      3    6   10   14   21   30   37   42   49   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     T    64_A     T    64_A      4    6   47      3    6    9   14   21   30   37   42   49   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     M    65_A     M    65_A      4    6   47      3    6    9   12   18   29   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     G    66_A     G    66_A      4    6   47      3    3    7   10   16   24   37   39   49   59   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     E    67_A     E    67_A      4    6   47      3    4    7   12   21   30   37   42   49   58   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     K    68_A     K    68_A      3    4   47      3    6    9   11   19   28   36   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     G    69_A     G    69_A      3    4   47      3    4    8   12   21   28   36   41   49   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     C    70_A     C    70_A      3    4   47      3    6   10   14   20   28   36   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     L    71_A     L    71_A      3    4   47      3    5   12   20   23   28   36   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     M    72_A     M    72_A      3    4   47      3    5    7   14   17   26   37   42   49   52   57   66   72   77   85   92   99  105  108  112 
LCS_GDT     S    73_A     S    73_A      3    4   47      3    6   10   16   26   33   37   42   49   52   58   66   75   81   88   96  100  105  108  112 
LCS_GDT     H    74_A     H    74_A      3    4   47      3    6   10   15   26   33   37   42   49   54   62   72   79   84   88   96  100  105  108  112 
LCS_GDT     F    75_A     F    75_A      3    4   47      3    5    8   14   18   27   35   42   48   52   57   63   68   76   80   86   92  101  108  112 
LCS_GDT     M    76_A     M    76_A      3    4   47      3    5    8   11   17   23   27   34   40   44   50   59   63   67   71   77   81   88   96  100 
LCS_GDT     L    77_A     L    77_A      3    4   47      3    5    8   11   17   25   34   38   44   49   56   63   67   71   76   83   90   95  104  111 
LCS_GDT     W    78_A     W    78_A      3    4   47      3    5    7   13   18   24   34   38   44   49   56   63   68   71   76   83   91   95  100  109 
LCS_GDT     K    79_A     K    79_A      3    4   47      3    5    8   11   17   23   27   31   36   41   47   48   54   62   65   67   74   80   88   97 
LCS_GDT     K    80_A     K    80_A      3    4   47      3    5    7    9   13   19   24   29   36   40   44   48   54   58   61   67   71   78   84   93 
LCS_GDT     C    81_A     C    81_A      3    4   47      3    5    7   11   17   23   27   30   36   41   47   55   62   70   74   79   86   94   98  102 
LCS_GDT     I    82_A     I    82_A      3    4   47      3    5    7   11   16   23   27   30   36   40   44   48   54   58   64   69   73   85   90   97 
LCS_GDT     D    83_A     D    83_A      3   11   47      3    5    7   11   15   20   25   29   35   38   44   48   54   58   60   65   68   72   77   80 
LCS_GDT     E    84_A     E    84_A      7   12   47      4    5    7   10   19   21   24   28   35   38   44   48   54   58   60   65   71   75   81   86 
LCS_GDT     N    85_A     N    85_A      7   12   47      4    5    8   15   19   21   25   30   35   40   44   48   54   58   64   68   73   80   84   92 
LCS_GDT     L    86_A     L    86_A      7   12   47      4    5   10   15   19   23   27   30   38   43   48   56   62   70   75   80   86   94   98  102 
LCS_GDT     D    87_A     D    87_A      7   16   47      4    9   10   16   22   26   30   36   43   48   52   62   68   71   76   83   91   95  100  104 
LCS_GDT     Y    88_A     Y    88_A      7   16   47      4    9   11   16   22   26   30   36   43   48   55   62   68   74   83   87   97  104  108  112 
LCS_GDT     I    89_A     I    89_A      7   16   47      3    6   11   16   20   26   32   40   48   52   57   65   70   78   87   92   99  105  108  112 
LCS_GDT     T    90_A     T    90_A      7   16   47      3    7   12   17   26   33   37   42   49   61   68   75   82   84   90   96  100  105  108  112 
LCS_GDT     L    91_A     L    91_A      6   16   47      3    6   12   20   26   33   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     F    92_A     F    92_A      6   16   47      3    6   11   16   21   30   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     E    93_A     E    93_A      6   16   47      3    6    8   16   21   30   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     D    94_A     D    94_A      3   16   47      3    5    9   15   19   29   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     D    95_A     D    95_A      6   16   47      3    7   11   16   19   24   30   33   37   44   51   56   62   76   83   84   89   98  104  109 
LCS_GDT     I    96_A     I    96_A      6   16   47      3    7    9   16   19   26   30   33   37   46   51   61   68   76   83   84   89   95  104  107 
LCS_GDT     L    97_A     L    97_A      6   16   47      3    7   11   16   20   26   30   33   42   46   49   55   62   68   75   80   89   93   97  103 
LCS_GDT     L    98_A     L    98_A      6   16   47      3    7   11   16   19   25   29   35   42   46   54   62   68   76   83   84   89   95  104  107 
LCS_GDT     G    99_A     G    99_A      6   16   47      3    9   11   16   22   26   30   36   43   48   54   59   62   76   83   84   89   95  104  107 
LCS_GDT     E   100_A     E   100_A      6   16   47      3    7   11   16   22   26   30   36   43   48   54   59   68   76   83   84   89   95  104  107 
LCS_GDT     N   101_A     N   101_A      3   16   47      3    4    6   12   18   25   29   36   41   48   54   62   68   76   83   84   89   95  104  107 
LCS_GDT     A   102_A     A   102_A      3   16   47      3    5   11   16   19   25   30   37   47   54   60   66   74   78   84   95   99  102  107  110 
LCS_GDT     N   103_A     N   103_A      3    4   47      3    7   10   15   22   33   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     K   104_A     K   104_A      3    4   47      3    4   10   16   19   27   34   42   48   56   61   66   78   84   90   96  100  105  108  111 
LCS_GDT     F   105_A     F   105_A      3    4   47      3    6   10   14   19   25   34   40   48   56   61   67   78   84   90   96  100  105  108  111 
LCS_GDT     L   106_A     L   106_A      5    7   47      3    7   11   16   22   33   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     A   107_A     A   107_A      5    7   47      3    6    8   15   22   26   32   35   49   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     E   108_A     E   108_A      5    7   47      3    6    9   16   17   25   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     G   109_A     G   109_A      5    7   47      3    6    7   12   20   33   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     D   110_A     D   110_A      5    7   47      3    6    8   13   20   27   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     W   111_A     W   111_A      4    7   43      3    4    8   13   17   24   29   37   42   49   57   75   79   84   90   96  100  105  108  112 
LCS_GDT     L   112_A     L   112_A      4    7   41      3    7   10   20   26   33   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     K   113_A     K   113_A      4    4   39      3    6   12   17   22   27   35   41   49   61   68   75   82   84   88   94  100  105  108  112 
LCS_GDT     V   114_A     V   114_A      4    4   39      3    5    9   20   26   33   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     R   115_A     R   115_A      4    4   34      3    4   10   14   21   30   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     F   116_A     F   116_A      4    4   34      3    4    7   20   26   33   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     N   117_A     N   117_A      3    4   34      3    7   10   16   22   33   37   42   49   56   66   72   79   83   87   94   99  105  108  112 
LCS_GDT     F   118_A     F   118_A      3    5   34      3    7   13   15   20   26   35   40   48   52   57   66   72   78   87   92   99  104  108  112 
LCS_GDT     Q   119_A     Q   119_A      4    7   34      3    4   13   15   20   27   35   40   48   52   57   66   70   78   86   92   98  104  108  112 
LCS_GDT     E   120_A     E   120_A      4   10   34      3    5    8   16   26   33   37   42   49   57   66   74   82   84   88   94   99  105  108  112 
LCS_GDT     I   121_A     I   121_A      4   10   34      3    4    5   12   17   23   29   34   39   45   62   75   82   84   88   96  100  105  108  112 
LCS_GDT     F   122_A     F   122_A      5   10   34      3    6    8   12   21   30   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     V   123_A     V   123_A      5   10   34      4    5    8   13   20   29   36   40   48   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     L   124_A     L   124_A      5   10   34      4    5    8   10   17   26   31   40   48   56   61   66   74   79   87   96  100  102  107  110 
LCS_GDT     R   125_A     R   125_A      5   10   34      3    5    8   12   16   20   30   32   37   46   52   62   68   77   83   85   90   95  104  107 
LCS_GDT     L   126_A     L   126_A      5   10   34      4    5    8   12   16   20   30   32   37   41   44   54   62   67   75   84   89   95   99  103 
LCS_GDT     E   127_A     E   127_A      5   10   34      3    4    8   10   15   19   26   29   32   36   41   48   55   58   61   68   73   77   79   83 
LCS_GDT     T   128_A     T   128_A      3   10   34      3    4    5   10   11   12   19   27   33   37   41   46   51   58   59   63   68   72   77   80 
LCS_GDT     F   129_A     F   129_A      3   10   34      3    4    8    9   13   18   22   29   33   39   42   46   51   58   60   63   68   72   77   80 
LCS_GDT     L   130_A     L   130_A      4   10   34      3    3    5    8   12   14   22   29   33   39   42   46   49   56   60   63   68   72   77   80 
LCS_GDT     M   131_A     M   131_A      4    7   34      3    3    6   11   15   19   25   29   33   39   42   46   51   58   60   63   68   72   77   80 
LCS_GDT     P   132_A     P   132_A      4    8   34      3    3    5    8   11   13   21   26   33   35   41   45   51   58   60   63   68   72   77   80 
LCS_GDT     V   133_A     V   133_A      4    8   28      3    3    5    8   15   17   22   29   33   39   42   46   51   58   60   63   68   72   77   80 
LCS_GDT     Q   134_A     Q   134_A      4    8   28      3    3    5    9   13   16   20   29   33   39   42   46   51   58   59   63   68   72   77   80 
LCS_GDT     L   135_A     L   135_A      4    8   28      3    3    6    8   13   17   22   29   33   39   42   46   49   58   59   62   67   72   77   80 
LCS_GDT     E   136_A     E   136_A      3    8   28      3    3    6    8   13   15   20   29   33   39   42   46   51   58   59   62   67   72   77   80 
LCS_GDT     K   137_A     K   137_A      3    8   28      3    3    4    7   13   15   20   29   33   39   42   46   49   53   58   61   67   72   73   78 
LCS_GDT     Q   138_A     Q   138_A      3    8   28      3    3    4    7   10   12   15   29   33   39   42   46   49   51   55   60   66   69   73   77 
LCS_GDT     T   139_A     T   139_A      3    8   28      3    3    6    8   10   12   15   29   33   39   42   46   49   51   54   60   66   69   73   77 
LCS_GDT     Q   140_A     Q   140_A      3    7   28      3    3    6    7    9   12   15   16   22   26   30   35   39   48   53   60   66   68   72   78 
LCS_GDT     I   141_A     I   141_A      3    7   28      3    4    6    8   11   12   14   17   23   29   35   37   45   48   54   60   64   68   71   78 
LCS_GDT     P   142_A     P   142_A      4    7   28      3    4    6    8   11   12   15   16   23   29   32   37   45   48   54   59   64   68   71   77 
LCS_GDT     P   143_A     P   143_A      4    7   28      3    4    5    7   11   12   15   19   23   29   32   37   45   48   54   59   64   68   71   77 
LCS_GDT     F   144_A     F   144_A      4   12   28      3    4    7    9   11   12   15   16   18   20   24   30   33   43   49   53   59   61   67   71 
LCS_GDT     Q   145_A     Q   145_A      4   12   28      3    6    7    9   11   12   15   16   18   19   22   26   32   38   40   51   53   59   63   68 
LCS_GDT     Q   146_A     Q   146_A      4   12   28      3    6    7    9   11   12   14   15   17   19   22   27   33   41   49   53   59   61   67   71 
LCS_GDT     R   147_A     R   147_A      5   12   28      3    3    5    9   11   12   15   16   18   19   23   30   35   43   49   53   59   61   67   71 
LCS_GDT     D   148_A     D   148_A      5   12   28      3    6    7    9   11   12   15   16   18   23   28   36   44   48   54   59   64   68   71   77 
LCS_GDT     I   149_A     I   149_A      5   12   28      3    6    7    9   11   12   14   15   17   24   31   37   44   48   54   59   62   68   71   77 
LCS_GDT     D   150_A     D   150_A      5   12   28      3    6    7    9   12   15   18   21   24   30   35   40   45   49   54   60   64   68   72   78 
LCS_GDT     I   151_A     I   151_A      5   12   28      3    6    7    9   12   15   18   21   24   37   42   46   49   51   54   60   66   69   73   78 
LCS_GDT     L   152_A     L   152_A      4   12   28      3    4    6    8   12   15   18   21   33   39   42   46   49   51   55   60   66   69   73   78 
LCS_GDT     T   153_A     T   153_A      4   12   28      3    4    6    9   13   17   22   29   33   39   42   46   51   58   59   63   68   72   77   80 
LCS_GDT     S   154_A     S   154_A      4   12   28      2    4    6    9   13   16   20   27   33   39   42   46   51   58   59   63   68   72   77   80 
LCS_GDT     K   155_A     K   155_A      4   12   38      0    3    5   12   14   19   22   27   33   36   41   45   51   58   59   63   68   72   77   80 
LCS_GDT     H   156_A     H   156_A      4    8   38      3    5    9   12   16   19   24   29   33   39   42   46   51   58   60   63   68   75   80   88 
LCS_GDT     F   157_A     F   157_A      4    8   38      3    5   10   13   18   22   27   30   34   39   42   49   55   60   65   68   73   77   81   84 
LCS_GDT     G   158_A     G   158_A      4    8   38      3    4    7   12   18   22   27   30   37   42   49   55   59   65   70   80   85   91   94  103 
LCS_GDT     T   159_A     T   159_A      7   10   38      2    4    8   16   22   26   32   37   47   54   60   66   74   80   88   94  100  102  107  110 
LCS_GDT     A   160_A     A   160_A      7   10   38      0    5    8   16   22   26   32   37   43   48   54   62   69   77   83   87   95   97  104  107 
LCS_GDT     G   161_A     G   161_A      7   10   38      2    5   10   16   22   26   32   40   48   56   61   66   75   84   90   95  100  102  107  111 
LCS_GDT     Y   162_A     Y   162_A      7   10   38      3    6   10   12   21   30   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     V   163_A     V   163_A      7   10   38      4    6   10   20   23   30   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     I   164_A     I   164_A      7   10   38      4    7   10   17   26   33   37   42   49   57   66   75   82   84   88   96  100  105  108  112 
LCS_GDT     S   165_A     S   165_A      7   10   38      4    6   13   16   22   27   35   41   49   52   57   66   71   78   87   92   99  105  108  112 
LCS_GDT     Q   166_A     Q   166_A      5   10   38      3    7    9   15   22   26   30   36   43   48   54   62   68   71   77   83   91   95  100  109 
LCS_GDT     G   167_A     G   167_A      3   10   38      4    5   10   16   20   27   35   40   48   52   57   63   70   76   83   87   92  100  106  112 
LCS_GDT     A   168_A     A   168_A      3   10   38      3    5   10   14   26   33   37   42   49   52   57   66   73   79   87   92   99  105  108  112 
LCS_GDT     A   169_A     A   169_A      3    4   38      4    9   10   15   22   26   35   40   48   52   57   63   68   76   80   87   92  100  106  112 
LCS_GDT     K   170_A     K   170_A      3    4   38      3    9   10   15   22   26   34   38   44   49   56   61   68   71   76   83   91   95  100  104 
LCS_GDT     Y   171_A     Y   171_A      3    4   38      3    4    7   12   20   27   37   42   49   52   57   66   70   76   86   92   97  104  108  112 
LCS_GDT     L   172_A     L   172_A      3    4   38      3    6    9   16   26   33   37   42   49   52   57   66   72   78   87   92   99  105  108  112 
LCS_GDT     I   173_A     I   173_A      3    4   38      3    5    8   14   20   27   34   40   48   52   57   63   68   71   76   82   91   95  100  107 
LCS_GDT     A   174_A     A   174_A      3    4   38      3    9   10   15   22   26   35   41   48   52   57   63   68   71   76   82   91   95  100  107 
LCS_GDT     L   175_A     L   175_A      3    4   38      3    3    7   13   25   33   37   42   49   52   57   66   72   78   87   92   99  105  108  112 
LCS_GDT     F   176_A     F   176_A      3    4   38      3    5    9   15   26   33   37   42   49   52   57   66   72   77   85   92   97  104  108  112 
LCS_GDT     E   177_A     E   177_A      4    6   38      3    3    7   13   20   27   35   41   48   52   57   63   64   70   73   79   87   91   97  102 
LCS_GDT     K   178_A     K   178_A      4    6   38      3    9   10   15   26   33   37   42   49   52   57   63   70   76   81   87   91  101  107  110 
LCS_GDT     L   179_A     L   179_A      4    6   38      3    4    9   13   22   26   32   37   49   52   57   66   72   78   86   92   99  105  108  112 
LCS_GDT     T   180_A     T   180_A      4    6   38      3    4    6    9   12   19   27   37   43   48   55   66   73   79   87   94   99  105  108  112 
LCS_GDT     T   181_A     T   181_A      6    9   38      3    4    6    8   10   14   23   36   43   48   55   66   72   79   87   94   99  105  108  112 
LCS_GDT     E   182_A     E   182_A      6    9   38      3    6    9   16   22   26   32   37   43   49   63   71   79   84   88   95   99  105  108  112 
LCS_GDT     E   183_A     E   183_A      6    9   38      4    9   10   13   18   26   30   39   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     I   184_A     I   184_A      6    9   38      3    6   10   16   22   26   32   41   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     K   185_A     K   185_A      6    9   38      3    5   10   13   22   26   37   42   48   58   67   75   82   84   90   96  100  105  108  112 
LCS_GDT     P   186_A     P   186_A      6    9   38      4    5   10   16   22   30   37   40   48   58   67   75   82   84   90   96  100  105  108  112 
LCS_GDT     I   187_A     I   187_A      3    9   38      3    4    7   16   22   30   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     D   188_A     D   188_A      3    9   38      3    5   10   13   18   24   31   36   42   54   59   66   74   78   87   94   98  102  107  110 
LCS_GDT     E   189_A     E   189_A      3    9   38      3    5    9   14   18   24   31   36   42   48   52   64   72   77   84   93   98  102  107  110 
LCS_GDT     I   190_A     I   190_A      4    4   38      3    5   10   13   19   30   37   42   49   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     M   191_A     M   191_A      4    4   38      3    5    9   14   19   30   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     F   192_A     F   192_A      4    7   38      4    5    7   11   17   22   31   36   42   54   59   66   74   78   84   91   95  102  107  110 
LCS_GDT     N   193_A     N   193_A      4    7   38      3    4   10   11   16   24   28   36   42   48   52   60   72   77   83   87   95  100  107  108 
LCS_GDT     Q   194_A     Q   194_A      4    7   38      3    5   10   13   16   29   36   40   48   56   62   75   81   84   90   96  100  102  107  110 
LCS_GDT     Q   195_A     Q   195_A      4    7   38      3    6    8   14   18   29   36   40   48   56   67   75   81   84   90   96  100  102  107  110 
LCS_GDT     I   196_A     I   196_A      4    7   38      3    6    8   13   18   29   36   40   47   56   67   75   81   84   90   96  100  102  107  110 
LCS_GDT     N   197_A     N   197_A      4    7   38      3    6    9   14   18   24   32   39   47   56   61   69   79   83   90   96  100  102  107  110 
LCS_GDT     A   198_A     A   198_A      4   10   38      0    4    9   14   18   29   36   40   47   58   67   75   81   84   90   96  100  102  107  110 
LCS_GDT     T   199_A     T   199_A      3   10   38      3    3    7   10   21   30   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     D   200_A     D   200_A      3   10   38      3    4   10   20   23   30   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     Y   201_A     Y   201_A      3   10   38      3    5    8   17   21   30   37   42   50   61   69   75   82   84   90   96  100  105  108  112 
LCS_GDT     R   202_A     R   202_A      4   10   38      3    4   10   13   20   29   36   40   48   61   69   75   82   84   90   96  100  105  108  111 
LCS_GDT     V   203_A     V   203_A      4   10   38      3    4   10   12   19   24   31   40   48   56   61   70   75   81   90   96  100  102  107  110 
LCS_GDT     Y   204_A     Y   204_A      4   10   38      3    6   10   12   18   26   31   38   48   54   61   66   74   78   84   91   95  100  107  110 
LCS_GDT     Q   205_A     Q   205_A      4   10   38      3    4   10   12   18   21   30   32   37   41   52   62   68   76   83   84   89   95  104  107 
LCS_GDT     L   206_A     L   206_A      3   10   38      2    5    8   11   20   26   30   32   37   41   49   62   68   76   83   84   89   95  104  107 
LCS_GDT     N   207_A     N   207_A      3   10   38      2    4    8   12   18   21   30   32   37   41   44   48   52   57   71   80   84   87   92   95 
LCS_GDT     P   208_A     P   208_A      3   10   38      1    3    6   10   14   18   21   32   37   39   44   48   52   54   58   63   68   72   76   84 
LCS_GDT     A   209_A     A   209_A      3    6   38      3    3    7   10   14   18   30   32   37   40   44   48   55   58   59   67   73   77   92   95 
LCS_GDT     I   210_A     I   210_A      3    6   38      3    4    8   13   20   26   30   33   39   46   53   57   62   68   75   80   89   95   97  103 
LCS_GDT     C   211_A     C   211_A      3    6   38      4    5    8   15   18   26   32   37   43   48   54   59   62   67   74   80   85   91   97  103 
LCS_GDT     V   212_A     V   212_A      3    6   38      4    9   10   16   22   26   32   37   43   48   54   59   62   65   70   74   77   79   92   95 
LCS_GDT     Q   213_A     Q   213_A      3    6   38      3    4   10   16   22   26   32   37   43   48   54   59   62   65   70   74   77   79   83   86 
LCS_GDT     E   214_A     E   214_A      3    6   38      3    3    7   10   16   21   30   33   42   47   54   59   62   65   70   74   77   79   83   86 
LCS_GDT     L   215_A     L   215_A      3    6   38      3    4    6   10   17   21   30   36   43   48   54   59   62   65   70   74   77   79   83   86 
LCS_GDT     Q   216_A     Q   216_A      3    5   38      3    6    9   13   22   26   32   37   43   48   54   59   62   65   70   74   77   79   82   85 
LCS_GDT     L   217_A     L   217_A      3    4   38      3    6    9   13   17   24   32   37   43   48   54   59   62   65   70   74   77   79   82   85 
LCS_GDT     N   218_A     N   218_A      4    5   38      3    6    9   13   17   24   30   37   43   48   54   59   62   65   70   74   77   79   82   85 
LCS_GDT     Q   219_A     Q   219_A      4    5   21      3    5   10   15   19   21   24   29   33   37   41   46   51   55   63   67   70   77   80   84 
LCS_GDT     E   220_A     E   220_A      4    5   17      3    4    9   10   17   19   23   27   31   38   44   48   50   55   59   67   70   74   80   84 
LCS_GDT     A   221_A     A   221_A      4    5   17      3    5    7   13   17   20   30   37   43   48   54   59   62   65   70   74   77   79   82   85 
LCS_GDT     S   222_A     S   222_A      3    5   19      3    3    3    9   14   20   30   37   43   48   54   59   62   65   70   74   77   79   82   85 
LCS_GDT     L   223_A     L   223_A      3    4   19      3    3    4    9   15   24   32   37   43   48   54   59   62   65   70   74   77   79   82   85 
LCS_GDT     L   224_A     L   224_A      3    4   19      3    3    4    7   10   14   21   30   37   46   54   57   62   65   70   74   77   79   82   85 
LCS_GDT     V   225_A     V   225_A      3    4   19      2    3    4    6    8   16   18   20   23   29   37   48   57   65   70   74   77   79   81   84 
LCS_GDT     S   226_A     S   226_A      3    4   19      3    3    4    7   10   16   18   20   23   27   32   36   41   45   51   57   68   72   76   83 
LCS_GDT     N   227_A     N   227_A      3    4   19      3    3    4    7   10   16   18   20   23   27   30   36   42   53   61   67   69   76   81   84 
LCS_GDT     L   228_A     L   228_A      4    4   19      3    4    5    6    7   13   16   20   21   23   27   34   39   45   50   54   63   66   70   77 
LCS_GDT     E   229_A     E   229_A      4    4   19      3    4    4    7    8   10   16   20   21   23   27   34   39   47   50   54   63   66   70   77 
LCS_GDT     Q   230_A     Q   230_A      4    4   19      3    4    4    6   12   14   15   18   19   23   27   36   41   47   50   55   63   71   75   80 
LCS_GDT     E   231_A     E   231_A      4    4   19      3    4    4    7    8   13   15   16   19   23   25   36   41   47   50   54   63   66   68   75 
LCS_GDT     R   232_A     R   232_A      4    4   19      3    3    5    6    8   10   11   12   12   14   16   17   19   30   34   43   50   57   65   72 
LCS_GDT     K   233_A     K   233_A      4    4   19      3    3    4    7    8   10   11   12   12   14   16   17   18   19   28   37   45   54   61   67 
LCS_GDT     I   234_A     I   234_A      4    4   19      3    3    4    4    7    7    9   11   12   14   16   22   25   29   36   46   53   58   65   72 
LCS_GDT     N   235_A     N   235_A      3    4   19      3    3    5    7    8   10   11   12   12   14   16   17   18   19   22   27   34   45   52   57 
LCS_GDT     L   236_A     L   236_A      3    4   19      3    3    5    6    8   10   11   12   12   14   16   17   18   19   19   19   22   23   26   30 
LCS_GDT     K   237_A     K   237_A      3    4   19      0    3    5    7    8   10   11   12   12   14   16   17   18   19   19   19   19   20   21   21 
LCS_GDT     Y   238_A     Y   238_A      3    4   19      3    3    5    7    8   10   11   12   12   14   16   17   18   19   19   19   20   22   22   27 
LCS_GDT     E   239_A     E   239_A      3    4   19      3    3    5    6    8    9   10   12   12   14   15   17   18   19   19   19   19   20   21   22 
LCS_GDT     K   240_A     K   240_A      3    4   19      3    3    5    6    8    9    9   12   12   14   15   17   18   19   19   19   19   20   21   21 
LCS_AVERAGE  LCS_A:   7.11  (   1.77    3.45   16.10 )

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      4      9     13     20     26     33     37     42     50     61     69     75     82     84     90     96    100    105    108    112 
GDT PERCENT_AT   1.67   3.77   5.44   8.37  10.88  13.81  15.48  17.57  20.92  25.52  28.87  31.38  34.31  35.15  37.66  40.17  41.84  43.93  45.19  46.86
GDT RMS_LOCAL    0.13   0.71   8.84   7.23   1.82   2.12   2.25   2.56   3.21   3.58   3.84   4.07   4.32   4.41   5.76   5.05   6.06   5.61   5.75   6.10
GDT RMS_ALL_AT  28.55  20.35  29.16  25.95  27.64  27.62  27.66  27.67  25.07  25.02  24.81  24.94  24.93  25.00  24.80  25.10  24.94  25.45  25.48  25.88

# Checking swapping
#   possible swapping detected:  E     5_A      E     5_A
#   possible swapping detected:  F     9_A      F     9_A
#   possible swapping detected:  E    25_A      E    25_A
#   possible swapping detected:  F    34_A      F    34_A
#   possible swapping detected:  E    35_A      E    35_A
#   possible swapping detected:  F    37_A      F    37_A
#   possible swapping detected:  F    40_A      F    40_A
#   possible swapping detected:  D    44_A      D    44_A
#   possible swapping detected:  Y    53_A      Y    53_A
#   possible swapping detected:  E    67_A      E    67_A
#   possible swapping detected:  F    75_A      F    75_A
#   possible swapping detected:  E    84_A      E    84_A
#   possible swapping detected:  D    87_A      D    87_A
#   possible swapping detected:  E    93_A      E    93_A
#   possible swapping detected:  E   100_A      E   100_A
#   possible swapping detected:  F   105_A      F   105_A
#   possible swapping detected:  D   110_A      D   110_A
#   possible swapping detected:  E   120_A      E   120_A
#   possible swapping detected:  E   127_A      E   127_A
#   possible swapping detected:  F   157_A      F   157_A
#   possible swapping detected:  D   188_A      D   188_A
#   possible swapping detected:  E   189_A      E   189_A
#   possible swapping detected:  E   220_A      E   220_A
#   possible swapping detected:  E   229_A      E   229_A
#   possible swapping detected:  E   239_A      E   239_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    N     2_A      N     2_A    21.723     0    0.357   1.354    23.686    0.000    0.000
LGA    S     3_A      S     3_A    22.702     0    0.536   0.774    24.271    0.000    0.000
LGA    T     4_A      T     4_A    18.333     0    0.175   1.346    20.292    0.000    0.000
LGA    E     5_A      E     5_A    20.816     0    0.465   1.077    27.614    0.000    0.000
LGA    N     6_A      N     6_A    15.862     0    0.110   1.014    17.852    0.000    0.000
LGA    K     7_A      K     7_A    13.303     0    0.626   0.874    18.451    0.000    0.000
LGA    N     8_A      N     8_A     8.205     0    0.029   1.016    10.069    4.167   11.369
LGA    F     9_A      F     9_A     6.844     0    0.068   1.418    15.972   18.929    7.532
LGA    V    10_A      V    10_A     2.880     0    0.051   0.724     4.260   55.952   57.959
LGA    I    11_A      I    11_A     0.717     0    0.063   0.927     3.201   81.667   80.000
LGA    S    12_A      S    12_A     0.617     0    0.094   0.678     1.448   90.595   87.540
LGA    I    13_A      I    13_A     1.999     0    0.478   0.933     5.872   65.476   47.262
LGA    S    14_A      S    14_A     4.119     0    0.335   0.647     6.753   47.857   36.984
LGA    T    15_A      T    15_A     0.897     0    0.441   0.732     2.685   81.548   78.027
LGA    A    16_A      A    16_A     1.258     0    0.466   0.507     3.528   71.905   70.476
LGA    E    17_A      E    17_A     1.252     0    0.074   1.413     7.287   75.833   47.090
LGA    Q    18_A      Q    18_A     5.152     0    0.151   1.142    12.948   28.690   14.180
LGA    R    19_A      R    19_A     6.360     0    0.242   2.134    10.965   24.286   10.087
LGA    R    20_A      R    20_A     2.046     0    0.185   1.144    10.462   58.452   32.294
LGA    N    21_A      N    21_A     1.442     0    0.177   0.863     6.536   65.595   49.464
LGA    H    22_A      H    22_A     5.802     0    0.289   0.439    12.007   27.738   12.238
LGA    I    23_A      I    23_A     2.572     0    0.178   0.748     5.655   47.619   50.119
LGA    I    24_A      I    24_A     5.208     0    0.119   0.340    10.363   33.690   18.512
LGA    E    25_A      E    25_A     1.962     0    0.327   0.735     5.241   54.643   49.524
LGA    Q    26_A      Q    26_A     3.620     0    0.310   1.287     9.853   46.905   27.354
LGA    F    27_A      F    27_A     4.318     0    0.263   1.219     7.664   31.548   54.242
LGA    T    28_A      T    28_A     7.676     0    0.193   1.160    11.042   15.714    9.184
LGA    H    29_A      H    29_A     3.356     0    0.289   1.230     6.821   35.357   32.905
LGA    Q    30_A      Q    30_A     4.242     0    0.409   0.987     7.079   26.905   28.201
LGA    N    31_A      N    31_A    10.060     0    0.144   1.421    14.469    2.500    1.250
LGA    I    32_A      I    32_A     9.842     0    0.325   0.866    12.129    0.238   10.119
LGA    P    33_A      P    33_A    15.583     0    0.187   0.311    17.918    0.000    0.000
LGA    F    34_A      F    34_A    13.010     0    0.171   0.484    14.515    0.000    1.602
LGA    E    35_A      E    35_A    14.664     0    0.208   0.531    19.831    0.000    0.000
LGA    F    36_A      F    36_A    11.451     0    0.228   1.383    12.514    0.000    7.273
LGA    F    37_A      F    37_A     9.778     0    0.198   0.667    10.538    1.190    3.333
LGA    D    38_A      D    38_A     8.816     0    0.101   0.696    14.858    8.690    4.345
LGA    A    39_A      A    39_A     1.964     0    0.488   0.507     4.552   58.571   63.143
LGA    F    40_A      F    40_A     1.997     0    0.382   1.323    10.888   71.310   34.675
LGA    T    41_A      T    41_A     2.565     0    0.153   0.333     5.638   47.857   56.259
LGA    P    42_A      P    42_A     7.740     0    0.361   0.556    11.240   14.762    8.639
LGA    S    43_A      S    43_A     2.665     0    0.688   0.903     5.295   39.405   50.635
LGA    D    44_A      D    44_A     6.904     0    0.388   1.035     9.302   12.738   11.012
LGA    K    45_A      K    45_A     4.840     0    0.572   0.984     8.520   20.238   26.931
LGA    L    46_A      L    46_A    10.719     0    0.555   0.779    16.778    1.190    0.595
LGA    T    47_A      T    47_A    11.239     0    0.124   1.261    13.216    0.000    0.000
LGA    D    48_A      D    48_A    11.378     0    0.355   0.737    13.604    0.000    0.060
LGA    H    49_A      H    49_A    12.666     0    0.092   1.534    13.814    0.000    2.429
LGA    L    50_A      L    50_A    13.318     0    0.228   0.676    14.439    0.000    0.000
LGA    Q    51_A      Q    51_A    13.534     0    0.108   1.343    14.261    0.000    0.000
LGA    R    52_A      R    52_A    13.548     0    0.229   1.741    15.159    0.000    0.260
LGA    Y    53_A      Y    53_A    14.574     0    0.065   0.638    15.927    0.000    0.000
LGA    L    54_A      L    54_A    15.013     0    0.303   0.356    16.993    0.000    0.000
LGA    P    55_A      P    55_A    18.710     0    0.138   0.384    21.037    0.000    0.000
LGA    N    56_A      N    56_A    20.580     0    0.351   1.203    20.820    0.000    0.000
LGA    V    57_A      V    57_A    17.764     0    0.114   0.790    18.643    0.000    0.000
LGA    A    58_A      A    58_A    16.210     0    0.439   0.414    19.116    0.000    0.000
LGA    N    59_A      N    59_A    19.512     0    0.629   1.297    20.266    0.000    0.000
LGA    A    60_A      A    60_A    18.708     0    0.401   0.402    18.770    0.000    0.000
LGA    A    61_A      A    61_A    20.376     0    0.481   0.441    22.943    0.000    0.000
LGA    Q    62_A      Q    62_A    21.436     0    0.401   1.097    22.250    0.000    0.000
LGA    L    63_A      L    63_A    19.242     0    0.086   0.355    20.094    0.000    0.000
LGA    T    64_A      T    64_A    18.388     0    0.140   0.285    18.843    0.000    0.000
LGA    M    65_A      M    65_A    15.454     0    0.293   1.095    16.466    0.000    0.000
LGA    G    66_A      G    66_A    14.528     0    0.229   0.229    15.486    0.000    0.000
LGA    E    67_A      E    67_A    16.209     0    0.418   0.965    23.076    0.000    0.000
LGA    K    68_A      K    68_A    10.906     0    0.048   0.497    14.286    0.714    0.370
LGA    G    69_A      G    69_A     6.345     0    0.228   0.228     7.766   11.071   11.071
LGA    C    70_A      C    70_A     9.151     0    0.323   0.449    12.155    3.571    2.381
LGA    L    71_A      L    71_A     7.779     0    0.183   0.965     8.076   10.833   11.786
LGA    M    72_A      M    72_A     3.187     0    0.190   0.893     6.448   42.381   40.833
LGA    S    73_A      S    73_A     1.360     0    0.146   0.264     2.101   72.976   75.873
LGA    H    74_A      H    74_A     2.378     0    0.227   0.423     6.633   58.690   42.238
LGA    F    75_A      F    75_A     3.747     0    0.203   1.369     7.937   35.119   27.446
LGA    M    76_A      M    76_A     9.187     0    0.282   0.695    14.434    4.762    2.381
LGA    L    77_A      L    77_A     7.587     0    0.374   0.778     9.260    7.262    6.845
LGA    W    78_A      W    78_A     7.577     0    0.234   1.340    11.539    4.286   41.531
LGA    K    79_A      K    79_A    14.082     0    0.269   1.239    16.505    0.000    0.000
LGA    K    80_A      K    80_A    16.937     0    0.374   0.777    21.119    0.000    0.000
LGA    C    81_A      C    81_A    14.496     0    0.266   0.772    15.998    0.000    0.000
LGA    I    82_A      I    82_A    18.103     0    0.229   0.360    21.767    0.000    0.000
LGA    D    83_A      D    83_A    24.242     0    0.133   0.845    25.723    0.000    0.000
LGA    E    84_A      E    84_A    24.991     0    0.416   0.957    25.452    0.000    0.000
LGA    N    85_A      N    85_A    24.914     0    0.251   0.832    29.025    0.000    0.000
LGA    L    86_A      L    86_A    19.316     0    0.159   0.348    21.299    0.000    0.000
LGA    D    87_A      D    87_A    15.992     0    0.053   0.682    19.104    0.000    0.000
LGA    Y    88_A      Y    88_A     9.746     0    0.054   1.105    13.202    0.476    1.230
LGA    I    89_A      I    89_A     7.078     0    0.118   1.570    11.393   16.786    9.881
LGA    T    90_A      T    90_A     1.913     0    0.070   0.994     3.726   63.690   71.361
LGA    L    91_A      L    91_A     1.288     0    0.287   0.779     3.959   75.476   73.690
LGA    F    92_A      F    92_A     4.850     0    0.225   0.424     5.853   37.738   31.905
LGA    E    93_A      E    93_A     8.294     0    0.230   0.719    15.019    4.881    2.169
LGA    D    94_A      D    94_A     7.834     0    0.572   0.811    12.210    3.571    8.869
LGA    D    95_A      D    95_A    14.209     0    0.308   1.368    17.347    0.000    0.000
LGA    I    96_A      I    96_A    14.078     0    0.282   0.444    16.021    0.000    0.000
LGA    L    97_A      L    97_A    15.977     0    0.101   1.146    19.863    0.000    0.000
LGA    L    98_A      L    98_A    12.950     0    0.140   0.292    16.246    0.000    0.417
LGA    G    99_A      G    99_A    14.736     0    0.158   0.158    15.378    0.000    0.000
LGA    E   100_A      E   100_A    14.730     0    0.042   0.744    14.738    0.000    0.000
LGA    N   101_A      N   101_A    13.060     0    0.584   0.721    16.156    0.000    0.000
LGA    A   102_A      A   102_A     8.684     0    0.237   0.244    10.264   11.429    9.429
LGA    N   103_A      N   103_A     2.098     0    0.262   0.997     7.461   50.833   40.833
LGA    K   104_A      K   104_A     4.450     0    0.344   0.924     6.182   32.619   34.180
LGA    F   105_A      F   105_A     6.056     0    0.304   1.346    14.324   32.500   12.251
LGA    L   106_A      L   106_A     2.897     0    0.229   0.892     8.348   46.905   33.274
LGA    A   107_A      A   107_A     6.228     0    0.128   0.146     7.859   22.738   19.619
LGA    E   108_A      E   108_A     4.607     0    0.628   0.908     6.030   27.976   38.307
LGA    G   109_A      G   109_A     2.936     0    0.329   0.329     2.952   57.143   57.143
LGA    D   110_A      D   110_A     3.172     0    0.165   0.839     7.727   50.000   32.381
LGA    W   111_A      W   111_A     6.254     0    0.290   1.110    14.974   25.357    7.585
LGA    L   112_A      L   112_A     0.778     0    0.169   0.623     4.355   65.952   67.143
LGA    K   113_A      K   113_A     5.170     0    0.049   1.294    13.688   37.738   17.619
LGA    V   114_A      V   114_A     2.303     0    0.187   0.973     7.197   63.095   45.850
LGA    R   115_A      R   115_A     4.006     0    0.682   1.240    16.759   54.048   21.472
LGA    F   116_A      F   116_A     2.316     0    0.294   1.260     9.350   59.405   34.892
LGA    N   117_A      N   117_A     3.474     0    0.142   0.677     5.575   43.095   37.500
LGA    F   118_A      F   118_A     6.395     0    0.454   1.019     8.474   15.357   18.485
LGA    Q   119_A      Q   119_A     6.388     0    0.338   0.939     8.502   23.214   14.127
LGA    E   120_A      E   120_A     2.522     0    0.039   1.084     7.643   59.167   38.730
LGA    I   121_A      I   121_A     7.441     0    0.391   1.116    13.219    8.571    5.536
LGA    F   122_A      F   122_A     9.484     0    0.192   1.352    10.168    2.976    2.035
LGA    V   123_A      V   123_A    12.169     0    0.195   1.220    14.275    0.000    0.000
LGA    L   124_A      L   124_A    14.246     0    0.055   1.061    15.949    0.000    0.000
LGA    R   125_A      R   125_A    19.635     0    0.305   1.118    29.013    0.000    0.000
LGA    L   126_A      L   126_A    21.257     0    0.269   0.787    24.057    0.000    0.000
LGA    E   127_A      E   127_A    27.304     0    0.703   0.978    32.467    0.000    0.000
LGA    T   128_A      T   128_A    32.130     0    0.673   0.993    33.460    0.000    0.000
LGA    F   129_A      F   129_A    34.163     0    0.153   1.421    37.684    0.000    0.000
LGA    L   130_A      L   130_A    38.444     0    0.578   0.649    40.146    0.000    0.000
LGA    M   131_A      M   131_A    42.924     0    0.184   0.927    46.526    0.000    0.000
LGA    P   132_A      P   132_A    42.015     0    0.653   0.544    44.999    0.000    0.000
LGA    V   133_A      V   133_A    43.670     0    0.193   0.732    44.663    0.000    0.000
LGA    Q   134_A      Q   134_A    47.600     0    0.336   1.460    49.091    0.000    0.000
LGA    L   135_A      L   135_A    48.833     0    0.370   1.443    50.730    0.000    0.000
LGA    E   136_A      E   136_A    51.339     0    0.197   1.161    55.753    0.000    0.000
LGA    K   137_A      K   137_A    57.336     0    0.344   0.485    62.262    0.000    0.000
LGA    Q   138_A      Q   138_A    57.921     0    0.254   1.208    60.436    0.000    0.000
LGA    T   139_A      T   139_A    61.588     0    0.581   0.818    66.101    0.000    0.000
LGA    Q   140_A      Q   140_A    63.596     0    0.470   0.970    65.550    0.000    0.000
LGA    I   141_A      I   141_A    62.074     0    0.208   1.601    62.497    0.000    0.000
LGA    P   142_A      P   142_A    63.495     0    0.230   0.186    64.156    0.000    0.000
LGA    P   143_A      P   143_A    63.858     0    0.164   0.269    64.630    0.000    0.000
LGA    F   144_A      F   144_A    62.827     0    0.480   1.342    65.340    0.000    0.000
LGA    Q   145_A      Q   145_A    64.716     0    0.078   1.174    67.463    0.000    0.000
LGA    Q   146_A      Q   146_A    62.908     0    0.119   1.397    69.546    0.000    0.000
LGA    R   147_A      R   147_A    58.108     0    0.161   1.529    59.808    0.000    0.000
LGA    D   148_A      D   148_A    56.565     0    0.111   0.574    59.199    0.000    0.000
LGA    I   149_A      I   149_A    53.371     0    0.109   0.556    54.409    0.000    0.000
LGA    D   150_A      D   150_A    50.591     0    0.301   1.184    52.816    0.000    0.000
LGA    I   151_A      I   151_A    47.939     0    0.253   0.616    48.396    0.000    0.000
LGA    L   152_A      L   152_A    43.951     0    0.018   0.826    45.689    0.000    0.000
LGA    T   153_A      T   153_A    42.284     0    0.330   1.326    45.014    0.000    0.000
LGA    S   154_A      S   154_A    40.099     0    0.219   0.786    40.711    0.000    0.000
LGA    K   155_A      K   155_A    34.627     0    0.287   0.631    36.989    0.000    0.000
LGA    H   156_A      H   156_A    30.499     0    0.344   1.138    32.057    0.000    0.000
LGA    F   157_A      F   157_A    28.085     0    0.470   0.642    32.603    0.000    0.000
LGA    G   158_A      G   158_A    22.624     0    0.517   0.517    24.516    0.000    0.000
LGA    T   159_A      T   159_A    15.696     0    0.114   1.288    18.484    0.000    0.000
LGA    A   160_A      A   160_A    16.448     0    0.409   0.426    18.300    0.000    0.000
LGA    G   161_A      G   161_A    12.483     0    0.254   0.254    13.661    0.000    0.000
LGA    Y   162_A      Y   162_A     8.797     0    0.114   1.063    10.045    5.714   14.087
LGA    V   163_A      V   163_A     3.815     0    0.079   1.318     5.595   44.881   48.231
LGA    I   164_A      I   164_A     0.460     0    0.107   1.472     3.268   74.048   75.833
LGA    S   165_A      S   165_A     4.803     0    0.304   0.751     8.106   24.048   32.778
LGA    Q   166_A      Q   166_A    11.103     0    0.134   1.517    16.766    0.714    0.317
LGA    G   167_A      G   167_A     7.287     0    0.285   0.285     8.777   13.095   13.095
LGA    A   168_A      A   168_A     2.388     0    0.216   0.207     5.575   41.667   51.429
LGA    A   169_A      A   169_A     6.475     0    0.159   0.156     9.218   14.286   13.429
LGA    K   170_A      K   170_A     9.449     0    0.157   0.555    18.382    4.762    2.116
LGA    Y   171_A      Y   171_A     3.134     0    0.149   1.516     5.862   36.548   49.563
LGA    L   172_A      L   172_A     2.297     0    0.246   0.906     5.818   50.595   45.476
LGA    I   173_A      I   173_A     6.610     0    0.213   0.433    10.542   17.143   10.119
LGA    A   174_A      A   174_A     5.642     0    0.089   0.091     5.994   25.357   24.571
LGA    L   175_A      L   175_A     3.308     0    0.129   1.052     8.807   44.286   30.952
LGA    F   176_A      F   176_A     2.717     0    0.296   0.390     8.244   49.524   35.671
LGA    E   177_A      E   177_A     4.762     0    0.340   1.104    11.424   34.762   18.995
LGA    K   178_A      K   178_A     2.699     0    0.256   1.347     6.514   41.667   58.201
LGA    L   179_A      L   179_A     6.722     0    0.325   1.289     8.508   13.095   16.905
LGA    T   180_A      T   180_A    10.556     0    0.336   1.354    11.160    0.357    0.612
LGA    T   181_A      T   181_A    10.407     0    0.382   1.031    12.655    0.000    0.000
LGA    E   182_A      E   182_A    14.444     0    0.203   1.327    16.821    0.000    0.000
LGA    E   183_A      E   183_A    17.670     0    0.021   1.170    20.041    0.000    0.000
LGA    I   184_A      I   184_A    15.062     0    0.159   1.462    16.621    0.000    0.000
LGA    K   185_A      K   185_A    19.536     0    0.412   1.056    26.513    0.000    0.000
LGA    P   186_A      P   186_A    17.875     0    0.318   0.628    19.890    0.000    0.000
LGA    I   187_A      I   187_A    14.329     0    0.197   0.481    17.625    0.000    0.357
LGA    D   188_A      D   188_A    19.721     0    0.190   1.163    22.309    0.000    0.000
LGA    E   189_A      E   189_A    22.703     0    0.528   0.759    27.812    0.000    0.000
LGA    I   190_A      I   190_A    16.519     0    0.126   1.493    18.632    0.000    0.000
LGA    M   191_A      M   191_A    14.957     0    0.113   0.781    18.214    0.000    0.060
LGA    F   192_A      F   192_A    21.947     0    0.074   1.268    25.736    0.000    0.000
LGA    N   193_A      N   193_A    25.631     0    0.238   0.926    30.982    0.000    0.000
LGA    Q   194_A      Q   194_A    23.375     0    0.240   1.436    28.550    0.000    0.000
LGA    Q   195_A      Q   195_A    21.430     0    0.549   1.309    21.835    0.000    0.000
LGA    I   196_A      I   196_A    20.937     0    0.210   1.506    22.491    0.000    0.000
LGA    N   197_A      N   197_A    24.498     0    0.161   0.854    27.163    0.000    0.000
LGA    A   198_A      A   198_A    21.214     0    0.546   0.521    22.563    0.000    0.000
LGA    T   199_A      T   199_A    13.965     0    0.675   0.571    16.743    0.000    0.000
LGA    D   200_A      D   200_A    10.496     0    0.406   0.928    11.748    0.000    0.476
LGA    Y   201_A      Y   201_A    11.692     0    0.070   0.743    12.865    0.000    1.032
LGA    R   202_A      R   202_A    14.894     0    0.340   0.922    16.166    0.000    0.043
LGA    V   203_A      V   203_A    18.531     0    0.106   0.233    21.010    0.000    0.000
LGA    Y   204_A      Y   204_A    19.699     0    0.094   0.849    21.924    0.000    0.000
LGA    Q   205_A      Q   205_A    22.680     0    0.486   0.926    25.280    0.000    0.000
LGA    L   206_A      L   206_A    21.325     0    0.133   1.268    23.506    0.000    0.000
LGA    N   207_A      N   207_A    27.056     0    0.210   1.040    33.256    0.000    0.000
LGA    P   208_A      P   208_A    26.844     0    0.111   0.196    26.844    0.000    0.000
LGA    A   209_A      A   209_A    26.357     0    0.338   0.476    27.320    0.000    0.000
LGA    I   210_A      I   210_A    19.829     0    0.629   1.585    22.169    0.000    0.000
LGA    C   211_A      C   211_A    19.505     0    0.230   0.301    20.075    0.000    0.000
LGA    V   212_A      V   212_A    22.280     0    0.251   0.630    24.959    0.000    0.000
LGA    Q   213_A      Q   213_A    23.241     0    0.081   0.953    24.452    0.000    0.000
LGA    E   214_A      E   214_A    23.680     0    0.175   1.363    26.411    0.000    0.000
LGA    L   215_A      L   215_A    28.615     0    0.718   1.017    30.852    0.000    0.000
LGA    Q   216_A      Q   216_A    32.422     0    0.680   1.571    35.592    0.000    0.000
LGA    L   217_A      L   217_A    33.078     0    0.532   0.630    37.063    0.000    0.000
LGA    N   218_A      N   218_A    37.668     0    0.583   1.134    38.487    0.000    0.000
LGA    Q   219_A      Q   219_A    39.750     0    0.055   1.207    41.346    0.000    0.000
LGA    E   220_A      E   220_A    40.377     0    0.256   1.001    43.247    0.000    0.000
LGA    A   221_A      A   221_A    39.127     0    0.540   0.517    39.194    0.000    0.000
LGA    S   222_A      S   222_A    39.401     0    0.518   0.789    41.586    0.000    0.000
LGA    L   223_A      L   223_A    39.478     0    0.564   1.383    42.893    0.000    0.000
LGA    L   224_A      L   224_A    40.012     0    0.517   0.923    40.012    0.000    0.000
LGA    V   225_A      V   225_A    39.495     0    0.540   1.272    42.057    0.000    0.000
LGA    S   226_A      S   226_A    40.549     0    0.471   0.960    41.016    0.000    0.000
LGA    N   227_A      N   227_A    42.394     0    0.593   0.903    46.763    0.000    0.000
LGA    L   228_A      L   228_A    45.830     0    0.319   1.033    50.483    0.000    0.000
LGA    E   229_A      E   229_A    50.173     0    0.217   1.163    54.226    0.000    0.000
LGA    Q   230_A      Q   230_A    54.381     0    0.073   1.226    59.451    0.000    0.000
LGA    E   231_A      E   231_A    54.566     0    0.375   1.085    55.220    0.000    0.000
LGA    R   232_A      R   232_A    56.943     0    0.147   1.533    60.105    0.000    0.000
LGA    K   233_A      K   233_A    62.185     0    0.160   1.069    64.804    0.000    0.000
LGA    I   234_A      I   234_A    64.064     0    0.360   0.502    65.000    0.000    0.000
LGA    N   235_A      N   235_A    64.068     0    0.064   0.998    66.203    0.000    0.000
LGA    L   236_A      L   236_A    69.066     0    0.316   1.294    72.816    0.000    0.000
LGA    K   237_A      K   237_A    72.582     0    0.533   1.272    74.345    0.000    0.000
LGA    Y   238_A      Y   238_A    73.141     0    0.289   0.504    76.713    0.000    0.000
LGA    E   239_A      E   239_A    74.057     0    0.599   1.249    75.397    0.000    0.000
LGA    K   240_A      K   240_A    78.970     0    0.342   1.376    80.707    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      239     956    956  100.00    1967   1967  100.00               239
SUMMARY(RMSD_GDC):    19.733         19.772                 20.196           13.183   11.674

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  251  239    4.0     42    2.56    17.469    14.537     1.577

LGA_LOCAL      RMSD:   2.563  Number of atoms:   42  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  27.668  Number of assigned atoms:  239 
Std_ASGN_ATOMS RMSD:  19.733  Standard rmsd on all 239 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.582580 * X  +  -0.769590 * Y  +   0.261403 * Z  +   5.437108
  Y_new =  -0.770338 * X  +  -0.420264 * Y  +   0.479539 * Z  + -30.399639
  Z_new =  -0.259190 * X  +  -0.480739 * Y  +  -0.837682 * Z  + -23.987324 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -0.923297  0.262183 -2.620592   [DEG:  -52.9010   15.0220 -150.1488 ]
ZXZ:  2.642508  2.563821 -2.647119   [DEG:  151.4046  146.8961 -151.6687 ]
 
# END of job
