
#######################################################
#                                                     #
#                        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  214 ( 1657),  selected  207 , name one
# Molecule2: number of CA atoms  207 ( 1517),  selected  207 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:B  -ch2:B  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    85      31_B - 115_B       4.76    19.54
  LONGEST_CONTINUOUS_SEGMENT:    85      32_B - 116_B       4.72    19.56
  LONGEST_CONTINUOUS_SEGMENT:    85      33_B - 117_B       4.85    19.55
  LCS_AVERAGE:     29.82

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    65      49_B - 113_B       1.99    19.36
  LCS_AVERAGE:     18.76

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    49      62_B - 110_B       0.98    18.76
  LONGEST_CONTINUOUS_SEGMENT:    49      63_B - 111_B       0.95    18.74
  LCS_AVERAGE:     12.08

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  207
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     P     4_B     P     4_B      3    7   20      0    3    3    5    6   10   12   14   16   17   19   23   32   32   34   38   40   46   50   58 
LCS_GDT     D     5_B     D     5_B      3   14   20      3    3    3    7   10   13   14   15   16   17   32   35   39   42   46   50   57   62   65   71 
LCS_GDT     F     6_B     F     6_B      4   14   20      3    4    7   10   12   13   16   28   30   32   35   40   44   53   55   59   63   68   75   79 
LCS_GDT     T     7_B     T     7_B      4   14   20      3    4    4    7   12   13   14   15   17   29   33   40   44   53   55   59   65   70   75   79 
LCS_GDT     G     8_B     G     8_B     10   14   20      9    9   10   11   12   13   14   15   17   26   39   47   50   56   61   67   72   76   78   84 
LCS_GDT     A     9_B     A     9_B     10   14   20      9    9   10   11   12   13   14   15   17   28   42   47   51   56   61   67   72   76   78   84 
LCS_GDT     R    10_B     R    10_B     10   14   20      9    9   10   11   12   13   14   15   17   22   25   29   48   55   61   67   72   76   78   84 
LCS_GDT     E    11_B     E    11_B     10   14   20      9    9   10   11   12   13   14   15   17   22   25   38   48   55   61   67   72   76   78   84 
LCS_GDT     R    12_B     R    12_B     10   14   20      9    9   10   11   12   13   14   15   30   39   43   47   51   56   61   67   72   76   78   84 
LCS_GDT     F    13_B     F    13_B     10   14   20      9    9   10   11   12   13   14   15   22   39   43   47   50   56   61   67   72   76   78   84 
LCS_GDT     L    14_B     L    14_B     10   14   20      9    9   10   11   12   13   14   15   17   22   25   30   36   55   60   67   72   76   78   84 
LCS_GDT     A    15_B     A    15_B     10   14   20      9    9   10   11   12   13   14   15   17   22   25   30   36   55   60   66   72   76   78   84 
LCS_GDT     G    16_B     G    16_B     10   14   20      9    9   10   11   12   13   14   15   17   22   25   37   44   55   60   67   72   76   78   84 
LCS_GDT     D    17_B     D    17_B     10   14   20      4    4   10   11   12   13   14   15   20   23   29   37   44   52   60   67   72   76   78   84 
LCS_GDT     V    18_B     V    18_B      5   14   20      4    4    7   11   12   13   14   15   20   24   28   34   40   52   56   65   72   76   78  105 
LCS_GDT     T    19_B     T    19_B      3   13   20      0    3    9   10   11   13   15   25   35   39   43   47   51   56   61   67   72   91  101  113 
LCS_GDT     I    20_B     I    20_B      3    3   20      0    3    3   27   27   29   30   31   35   39   43   47   51   56   66   80   95  103  107  113 
LCS_GDT     V    21_B     V    21_B      3    4   20      3    3   13   18   25   29   30   31   35   39   43   60   65   76   81   88  103  107  109  113 
LCS_GDT     L    22_B     L    22_B      3    4   20      3    3    5   16   18   29   30   31   37   44   48   57   66   76   83   93  103  107  109  113 
LCS_GDT     L    23_B     L    23_B      3    5   20      3    3    4    5    9   12   14   20   22   29   38   42   53   66   77   84   95  103  107  113 
LCS_GDT     I    24_B     I    24_B      3    5   22      3    3    4    5    9   11   12   15   20   28   35   39   43   46   70   88   96  103  107  113 
LCS_GDT     A    25_B     A    25_B      4    5   24      3    4    4    5    9   11   12   15   20   25   30   34   42   45   46   52   58   65   71   86 
LCS_GDT     E    26_B     E    26_B      4    5   24      3    4    4    5    5    7    9   13   19   24   25   29   31   34   39   49   55   60   76   93 
LCS_GDT     S    27_B     S    27_B      4    5   24      3    4    4    5    7   10   12   14   16   21   21   25   26   29   42   44   47   52   63   93 
LCS_GDT     H    28_B     H    28_B      4    6   24      3    4    4    5    5   10   12   13   16   21   22   60   71   76   81   93  103  107  109  113 
LCS_GDT     D    29_B     D    29_B      3    6   24      3    3    3    7    7   10   12   15   16   21   24   60   65   76   81   93  103  107  109  113 
LCS_GDT     A    30_B     A    30_B      4    6   24      3    4    4    5    7   10   12   15   16   18   20   60   65   71   81   88  101  107  109  113 
LCS_GDT     P    31_B     P    31_B      4    6   85      3    4    4    5    7    7   11   20   34   46   57   70   80   85   90   95  103  107  109  113 
LCS_GDT     Y    32_B     Y    32_B      4    7   85      3    4    4    5    8   10   12   15   20   23   34   71   78   82   88   95  102  107  109  113 
LCS_GDT     R    33_B     R    33_B      5    9   85      3    4    6    7    8   10   12   16   39   60   67   72   80   82   88   95  103  107  109  113 
LCS_GDT     L    34_B     L    34_B      5    9   85      3    4    6   17   33   53   61   64   66   72   73   75   77   82   85   88   92   97  102  107 
LCS_GDT     A    35_B     A    35_B      5    9   85      3    4    6    7    8   10   12   15   65   72   73   75   77   80   83   87   92   94   96  100 
LCS_GDT     N    36_B     N    36_B      5    9   85      1    4    6    7    8   10   62   68   70   71   73   75   76   78   80   82   84   88   93   96 
LCS_GDT     P    37_B     P    37_B      5    9   85      3    4    6    7    8   38   48   61   70   71   72   75   76   77   80   84   89   92   95   97 
LCS_GDT     E    38_B     E    38_B      5    9   85      3    4   10   19   22   24   26   31   35   47   59   65   71   75   76   78   79   84   85   87 
LCS_GDT     D    39_B     D    39_B      5    9   85      3    4    6    7    8   19   24   26   29   36   42   58   68   74   76   78   79   84   85   87 
LCS_GDT     P    40_B     P    40_B      5    9   85      3    4    6    7    8   10   12   15   19   25   38   65   72   75   80   81   83   87   92   96 
LCS_GDT     E    41_B     E    41_B      5   40   85      3    4    6    7    8   10   14   20   27   36   51   65   72   75   77   81   83   87   88   95 
LCS_GDT     A    42_B     A    42_B     18   41   85      3   10   19   22   29   41   48   50   58   64   71   73   74   76   80   81   83   87   88   95 
LCS_GDT     D    43_B     D    43_B     21   43   85      3   10   15   19   22   37   43   53   61   70   71   73   76   77   80   84   85   91   95   97 
LCS_GDT     L    44_B     L    44_B     33   45   85      9   16   31   35   49   52   60   66   70   71   73   75   76   78   82   84   89   92   95   97 
LCS_GDT     S    45_B     S    45_B     34   45   85      8   22   33   44   52   61   65   68   70   72   73   75   77   80   82   86   91   94   95   98 
LCS_GDT     D    46_B     D    46_B     34   47   85      9   22   33   44   54   61   65   68   70   72   73   75   77   80   82   87   92   94   96  100 
LCS_GDT     E    47_B     E    47_B     34   47   85      9   22   33   44   54   61   65   68   70   72   73   75   77   80   83   87   92   94   96  100 
LCS_GDT     Q    48_B     Q    48_B     34   64   85      9   20   33   44   52   61   65   68   70   72   73   75   77   80   82   87   92   94   96  100 
LCS_GDT     L    49_B     L    49_B     34   65   85      9   22   33   44   54   61   65   68   70   72   73   75   77   80   83   87   92   94   96  100 
LCS_GDT     E    50_B     E    50_B     34   65   85      9   23   33   47   56   61   65   68   70   72   73   75   77   80   84   87   92   94   96  100 
LCS_GDT     R    51_B     R    51_B     34   65   85      9   22   33   47   56   61   65   68   70   72   73   75   77   80   84   87   92   94   96  100 
LCS_GDT     A    52_B     A    52_B     34   65   85      9   23   33   47   56   61   65   68   70   72   73   75   77   80   84   87   92   94   96  100 
LCS_GDT     L    53_B     L    53_B     34   65   85      9   23   34   51   58   61   65   68   70   72   73   75   77   80   84   87   92   97   99  107 
LCS_GDT     A    54_B     A    54_B     34   65   85      9   23   34   53   58   61   65   68   70   72   73   75   77   81   85   87   93  100  108  111 
LCS_GDT     A    55_B     A    55_B     34   65   85      9   23   34   53   58   61   65   68   70   72   73   75   77   81   85   87   92  100  107  111 
LCS_GDT     Y    56_B     Y    56_B     34   65   85      8   23   34   53   58   61   65   68   70   72   73   75   77   81   85   91   97  107  109  111 
LCS_GDT     L    57_B     L    57_B     34   65   85      9   22   35   55   58   61   65   68   70   72   73   75   80   82   88   95  103  107  109  113 
LCS_GDT     T    58_B     T    58_B     34   65   85     12   23   35   55   58   61   65   68   70   72   73   75   80   82   88   95  103  107  109  113 
LCS_GDT     L    59_B     L    59_B     34   65   85     12   23   35   55   58   61   65   68   70   72   73   75   80   82   88   95  103  107  109  113 
LCS_GDT     V    60_B     V    60_B     44   65   85     12   23   40   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     E    61_B     E    61_B     48   65   85     12   23   42   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     T    62_B     T    62_B     49   65   85     12   23   42   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     L    63_B     L    63_B     49   65   85     12   23   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     F    64_B     F    64_B     49   65   85     12   30   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     P    65_B     P    65_B     49   65   85     12   33   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     E    66_B     E    66_B     49   65   85     11   23   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     L    67_B     L    67_B     49   65   85      8   30   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     Y    68_B     Y    68_B     49   65   85      8   23   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     A    69_B     A    69_B     49   65   85     13   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     E    70_B     E    70_B     49   65   85     12   30   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     M    71_B     M    71_B     49   65   85     13   23   42   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     K    72_B     K    72_B     49   65   85      9   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     A    73_B     A    73_B     49   65   85     19   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     A    74_B     A    74_B     49   65   85     10   30   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     L    75_B     L    75_B     49   65   85     19   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     A    76_B     A    76_B     49   65   85     19   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     A    77_B     A    77_B     49   65   85      9   31   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     A    78_B     A    78_B     49   65   85     15   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     K    79_B     K    79_B     49   65   85     19   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     T    80_B     T    80_B     49   65   85     19   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     P    81_B     P    81_B     49   65   85     19   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     E    82_B     E    82_B     49   65   85     19   35   46   55   58   61   63   68   70   72   73   75   80   83   88   93  100  107  109  111 
LCS_GDT     E    83_B     E    83_B     49   65   85     19   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     K    84_B     K    84_B     49   65   85     19   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     I    85_B     I    85_B     49   65   85     19   35   46   55   58   60   63   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     A    86_B     A    86_B     49   65   85     19   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     V    87_B     V    87_B     49   65   85     15   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     F    88_B     F    88_B     49   65   85     15   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     R    89_B     R    89_B     49   65   85     19   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     E    90_B     E    90_B     49   65   85     19   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     Y    91_B     Y    91_B     49   65   85     13   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     N    92_B     N    92_B     49   65   85     19   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     A    93_B     A    93_B     49   65   85     19   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     R    94_B     R    94_B     49   65   85     19   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     F    95_B     F    95_B     49   65   85     19   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     L    96_B     L    96_B     49   65   85     19   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     A    97_B     A    97_B     49   65   85     19   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     E    98_B     E    98_B     49   65   85     15   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     F    99_B     F    99_B     49   65   85     15   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     D   100_B     D   100_B     49   65   85      5   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     A   101_B     A   101_B     49   65   85     15   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     L   102_B     L   102_B     49   65   85     15   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     I   103_B     I   103_B     49   65   85     15   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     D   104_B     D   104_B     49   65   85     15   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     Q   105_B     Q   105_B     49   65   85     15   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     A   106_B     A   106_B     49   65   85     13   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     F   107_B     F   107_B     49   65   85     15   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     A   108_B     A   108_B     49   65   85     15   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     R   109_B     R   109_B     49   65   85     10   30   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     L   110_B     L   110_B     49   65   85     15   35   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     K   111_B     K   111_B     49   65   85      4   26   46   55   58   61   65   68   70   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     A   112_B     A   112_B     45   65   85      5   15   21   47   56   60   62   67   69   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     D   113_B     D   113_B     26   65   85      3    8   25   47   55   60   61   64   69   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     S   114_B     S   114_B      7   63   85      8   17   21   27   33   38   54   58   61   67   70   74   80   85   90   95  103  107  109  113 
LCS_GDT     L   115_B     L   115_B      7   59   85      6   11   17   27   32   36   40   43   51   63   67   72   80   85   90   95  103  107  109  113 
LCS_GDT     T   116_B     T   116_B      7   25   85      6   15   21   27   32   36   38   42   44   47   55   62   65   71   81   92   97  101  106  111 
LCS_GDT     L   117_B     L   117_B      7   25   85      6   15   19   27   32   36   38   42   44   46   49   55   63   65   70   76   86   96  104  111 
LCS_GDT     K   118_B     K   118_B      7   25   79      6   11   17   25   32   36   38   41   43   46   48   50   52   58   63   68   71   79   83   88 
LCS_GDT     I   119_B     I   119_B      7   25   69      6   11   17   25   32   36   38   41   43   45   47   50   51   54   56   61   66   72   75   80 
LCS_GDT     H   120_B     H   120_B      7   25   60      3    6   11   14   23   27   37   41   43   45   47   50   51   54   56   58   60   61   65   69 
LCS_GDT     L   121_B     L   121_B      7   25   60      3   11   17   20   32   36   38   41   43   45   47   50   51   54   56   58   60   61   65   69 
LCS_GDT     S   122_B     S   122_B      6   28   60      3   10   17   20   28   35   38   41   43   45   47   50   51   54   56   58   60   61   65   69 
LCS_GDT     Q   123_B     Q   123_B      6   28   60      2    5   17   25   32   36   38   41   43   45   47   50   51   54   56   58   60   61   65   69 
LCS_GDT     G   124_B     G   124_B      7   28   60      4    9   17   25   32   36   38   41   43   45   47   50   51   54   56   58   60   61   65   67 
LCS_GDT     K   125_B     K   125_B      8   28   60      4    4   13   20   23   31   37   41   43   45   47   50   51   54   56   58   61   63   69   74 
LCS_GDT     G   126_B     G   126_B     13   28   60      4   10   17   27   32   36   38   41   43   46   48   50   53   57   60   62   69   73   78   83 
LCS_GDT     S   127_B     S   127_B     13   28   60      4    9   17   26   32   36   38   41   43   46   48   50   53   58   64   68   73   77   83   88 
LCS_GDT     Y   128_B     Y   128_B     13   28   60      3   11   17   27   32   36   38   41   44   46   48   51   60   65   69   73   76   83   92   98 
LCS_GDT     E   129_B     E   129_B     13   29   60      6   11   17   26   32   36   38   42   44   46   49   56   62   65   70   75   81   92   98  107 
LCS_GDT     I   130_B     I   130_B     21   33   60      6   11   21   27   32   36   40   45   50   58   61   64   72   78   83   92  101  107  109  113 
LCS_GDT     I   131_B     I   131_B     21   34   60      4   15   21   27   32   36   40   45   50   58   61   67   72   78   86   95  103  107  109  113 
LCS_GDT     F   132_B     F   132_B     21   37   60      8   17   21   27   33   37   43   48   53   59   67   74   80   85   90   95  103  107  109  113 
LCS_GDT     P   133_B     P   133_B     21   37   60      8   17   21   27   33   37   43   48   61   65   70   74   80   85   90   95  103  107  109  113 
LCS_GDT     P   134_B     P   134_B     21   37   60      8   17   21   27   33   37   43   56   63   66   70   74   80   85   90   95  103  107  109  113 
LCS_GDT     E   135_B     E   135_B     21   37   60      3   15   21   27   33   53   61   64   66   72   73   75   80   85   90   95  103  107  109  113 
LCS_GDT     V   136_B     V   136_B     21   37   60      9   17   21   27   33   37   43   56   62   65   71   74   80   85   90   95  103  107  109  113 
LCS_GDT     Q   137_B     Q   137_B     21   37   60      5   15   21   27   33   37   43   48   53   60   67   74   80   85   90   95  103  107  109  113 
LCS_GDT     A   138_B     A   138_B     21   37   60      8   17   21   27   33   37   43   48   56   61   67   74   80   85   90   95  103  107  109  113 
LCS_GDT     D   139_B     D   139_B     21   37   60     11   17   21   27   33   37   43   48   56   61   67   74   80   85   90   95  103  107  109  113 
LCS_GDT     P   140_B     P   140_B     21   37   60     11   17   21   27   33   37   43   48   53   60   67   74   80   85   90   95  103  107  109  113 
LCS_GDT     E   141_B     E   141_B     21   37   60     11   17   21   27   33   37   43   48   53   60   67   74   80   85   90   95  103  107  109  113 
LCS_GDT     R   142_B     R   142_B     21   37   60     11   17   21   27   33   37   43   49   56   61   67   74   80   85   90   95  103  107  109  113 
LCS_GDT     A   143_B     A   143_B     21   37   60     11   17   21   27   33   37   43   48   53   60   67   74   80   85   90   95  103  107  109  113 
LCS_GDT     A   144_B     A   144_B     21   37   60     11   17   21   27   33   37   43   48   53   59   66   74   80   85   90   95  103  107  109  113 
LCS_GDT     A   145_B     A   145_B     21   37   60     11   17   21   27   33   37   43   48   54   60   67   74   80   85   90   95  103  107  109  113 
LCS_GDT     I   146_B     I   146_B     21   37   60     11   17   21   27   33   37   43   48   54   61   67   74   80   85   90   95  103  107  109  113 
LCS_GDT     E   147_B     E   147_B     21   37   60     11   17   21   27   33   37   43   48   53   59   65   74   80   85   90   95  103  107  109  113 
LCS_GDT     A   148_B     A   148_B     21   37   60     11   17   21   27   33   37   43   48   53   59   65   74   80   85   90   95  103  107  109  113 
LCS_GDT     L   149_B     L   149_B     21   37   60     11   17   21   27   33   37   43   48   53   59   67   74   80   85   90   95  103  107  109  113 
LCS_GDT     W   150_B     W   150_B     21   37   60     11   17   21   27   33   37   43   48   53   59   65   74   80   85   90   95  103  107  109  113 
LCS_GDT     K   151_B     K   151_B     20   37   60     11   16   19   27   33   36   41   48   53   59   64   69   78   85   90   95  103  107  109  113 
LCS_GDT     P   152_B     P   152_B     20   37   60      8   16   19   27   33   36   43   48   53   59   65   74   78   85   90   95  103  107  109  113 
LCS_GDT     T   153_B     T   153_B     20   37   60     11   16   21   27   33   37   43   48   53   59   65   74   78   85   90   95  103  107  109  113 
LCS_GDT     L   154_B     L   154_B     20   37   60     11   16   21   27   33   37   43   48   53   59   64   69   78   85   90   95  103  107  109  113 
LCS_GDT     D   155_B     D   155_B     20   37   60     11   16   21   27   33   37   43   48   53   59   64   69   78   85   90   95  103  107  109  113 
LCS_GDT     Q   156_B     Q   156_B     20   37   60     11   16   20   26   33   37   43   48   53   59   65   74   78   85   90   95  103  107  109  113 
LCS_GDT     L   157_B     L   157_B     20   37   60     11   16   20   26   32   37   43   48   53   59   64   69   78   85   90   95  103  107  109  113 
LCS_GDT     L   158_B     L   158_B     20   37   60     11   16   21   26   33   37   43   48   53   59   64   69   76   84   90   95  103  107  109  113 
LCS_GDT     A   159_B     A   159_B     20   37   60     11   16   20   26   32   37   43   48   53   59   64   69   78   85   90   95  103  107  109  113 
LCS_GDT     V   160_B     V   160_B     20   37   60     11   16   19   26   32   37   43   48   53   59   64   69   78   85   90   95  103  107  109  113 
LCS_GDT     L   161_B     L   161_B     20   37   60     11   16   19   26   32   37   43   48   53   59   62   69   77   85   90   95  103  107  109  113 
LCS_GDT     Q   162_B     Q   162_B     20   37   60     11   16   20   26   32   37   43   48   53   59   64   69   78   85   90   95  103  107  109  113 
LCS_GDT     E   163_B     E   163_B     20   37   59     11   16   19   24   32   37   43   48   53   59   64   69   78   85   90   95  103  107  109  113 
LCS_GDT     K   164_B     K   164_B     20   37   56      4   16   19   22   25   34   41   48   53   59   62   69   76   85   90   95  103  107  109  113 
LCS_GDT     H   165_B     H   165_B     20   37   49     11   16   19   26   32   37   43   48   53   59   62   67   72   78   86   93  103  107  109  113 
LCS_GDT     K   166_B     K   166_B     20   37   49      7   16   20   26   32   37   43   48   53   59   64   69   77   85   90   93  103  107  109  113 
LCS_GDT     G   167_B     G   167_B     20   37   49      4    4   19   26   32   37   43   48   53   59   62   66   72   76   83   88   99  106  109  113 
LCS_GDT     K   168_B     K   168_B     20   37   49      4   16   19   26   32   37   43   48   53   59   62   67   72   78   86   93  103  107  109  113 
LCS_GDT     P   169_B     P   169_B     20   37   49      4    9   19   26   32   37   43   48   53   59   62   67   72   78   86   93  103  107  109  113 
LCS_GDT     A   170_B     A   170_B     20   35   49      4    4    4   21   22   29   38   45   50   58   61   64   69   75   81   85   92   98  107  113 
LCS_GDT     T   171_B     T   171_B      3   32   49      3    3    5   18   25   34   42   48   53   59   62   67   72   78   86   93  103  107  109  113 
LCS_GDT     T   172_B     T   172_B      6   25   49      4    6    7   10   15   18   21   25   35   38   41   47   51   57   72   80   89   96  102  113 
LCS_GDT     V   173_B     V   173_B      6   13   49      4    6    7    8   15   18   21   24   35   38   42   47   51   55   61   67   72   84   95  101 
LCS_GDT     T   174_B     T   174_B      6   30   49      4    6    7   10   13   18   21   24   35   38   41   47   51   55   61   67   72   76   78   84 
LCS_GDT     Y   175_B     Y   175_B      6   30   49      4    5    7   10   15   18   28   29   35   39   43   47   51   56   61   67   72   76   78   84 
LCS_GDT     E   176_B     E   176_B      6   30   41      3    6    7   10   15   25   28   29   35   39   43   47   51   56   61   67   72   76   78   84 
LCS_GDT     I   177_B     I   177_B     27   30   41     11   25   27   27   27   29   30   31   34   39   43   47   51   56   61   67   72   76   78   84 
LCS_GDT     S   178_B     S   178_B     27   30   41     21   25   27   27   27   29   30   31   34   39   43   47   51   56   61   67   72   76   78   84 
LCS_GDT     A   179_B     A   179_B     27   30   41     21   25   27   27   27   29   30   31   34   39   43   47   51   56   61   67   72   76   78   84 
LCS_GDT     E   180_B     E   180_B     27   30   41     21   25   27   27   27   29   30   31   34   39   43   47   51   56   61   67   72   76   78   84 
LCS_GDT     T   181_B     T   181_B     27   30   41     21   25   27   27   27   29   30   31   34   39   43   47   51   56   61   67   72   76   78   84 
LCS_GDT     L   182_B     L   182_B     27   30   41     21   25   27   27   27   29   30   31   35   39   43   47   51   56   61   67   72   76   78   84 
LCS_GDT     R   183_B     R   183_B     27   30   41     21   25   27   27   27   29   30   31   35   39   43   47   51   56   61   67   72   76   78   84 
LCS_GDT     A   184_B     A   184_B     27   30   41     17   25   27   27   27   29   30   31   35   39   43   47   51   56   61   67   72   76   78   84 
LCS_GDT     A   185_B     A   185_B     27   30   41     21   25   27   27   27   29   30   31   35   39   43   47   51   56   61   67   72   76   78   84 
LCS_GDT     V   186_B     V   186_B     27   30   41     21   25   27   27   27   29   30   31   35   39   43   47   51   56   61   67   72   78   86  100 
LCS_GDT     A   187_B     A   187_B     27   30   41     14   25   27   27   27   29   30   31   35   39   43   47   51   56   61   67   72   76   78   84 
LCS_GDT     A   188_B     A   188_B     27   30   41     21   25   27   27   27   29   30   31   35   39   43   47   51   56   61   67   72   76   78   84 
LCS_GDT     L   189_B     L   189_B     27   30   41     21   25   27   27   27   29   30   31   35   39   43   47   51   56   61   67   88   94   96  100 
LCS_GDT     A   190_B     A   190_B     27   30   41     21   25   27   27   27   29   30   31   35   39   43   47   51   56   61   67   74   80   87   94 
LCS_GDT     R   191_B     R   191_B     27   30   41     21   25   27   27   27   29   30   31   34   39   43   47   51   56   61   67   72   76   78   84 
LCS_GDT     A   192_B     A   192_B     27   30   41     21   25   27   27   27   29   30   31   34   39   43   47   51   56   61   67   72   76   78   84 
LCS_GDT     A   193_B     A   193_B     27   30   41     12   25   27   27   27   29   30   31   34   39   43   47   51   56   61   67   72   83   86   88 
LCS_GDT     E   194_B     E   194_B     27   30   41     21   25   27   27   27   29   30   31   34   39   43   47   51   56   61   67   72   76   78   84 
LCS_GDT     A   195_B     A   195_B     27   30   41     21   25   27   27   27   29   30   31   34   39   43   47   51   56   61   67   72   76   78   84 
LCS_GDT     A   196_B     A   196_B     27   30   41     21   25   27   27   27   29   30   31   34   39   43   47   51   56   61   67   72   76   78   84 
LCS_GDT     L   197_B     L   197_B     27   30   41     21   25   27   27   27   29   30   31   34   39   43   47   51   56   61   67   72   76   78   84 
LCS_GDT     R   198_B     R   198_B     27   30   41     21   25   27   27   27   29   30   31   34   39   43   47   51   56   61   67   72   76   78   84 
LCS_GDT     R   199_B     R   199_B     27   30   41     21   25   27   27   27   29   30   31   34   38   43   47   51   56   61   67   72   76   78   84 
LCS_GDT     K   200_B     K   200_B     27   30   41     21   25   27   27   27   29   30   31   34   39   43   47   51   56   61   67   72   76   78   84 
LCS_GDT     V   201_B     V   201_B     27   30   41     10   25   27   27   27   29   30   31   34   39   43   47   51   56   61   67   72   76   78   84 
LCS_GDT     G   202_B     G   202_B     27   30   41     21   25   27   27   27   29   30   31   34   37   43   47   51   56   61   67   72   76   78   84 
LCS_GDT     S   203_B     S   203_B     27   30   41      8   25   27   27   27   29   30   31   34   37   40   46   49   54   59   65   70   75   78   84 
LCS_GDT     L   204_B     L   204_B      5   30   41      4    4    5    8   12   25   28   29   31   33   37   40   48   52   57   61   65   73   77   83 
LCS_GDT     E   205_B     E   205_B      5   30   41      4    4    5    5    6    9   17   19   29   30   31   33   43   48   54   61   70   73   77   84 
LCS_GDT     S   206_B     S   206_B      5   30   41      4    4    5    5    7   11   24   28   29   32   37   43   49   54   58   65   72   76   78   84 
LCS_GDT     S   207_B     S   207_B      5    6   41      3    4    5    6    7    8   10   11   15   18   25   32   33   35   38   55   62   70   76   84 
LCS_GDT     G   208_B     G   208_B      3    5   41      3    3    4    6    7    8   10   10   12   17   20   26   31   35   36   43   51   70   75   83 
LCS_GDT     L   209_B     L   209_B      3    5   41      3    3    4    6    7    8   10   10   15   26   28   32   34   38   42   49   52   66   75   81 
LCS_GDT     E   210_B     E   210_B      3    5   41      1    3    3   11   15   17   19   26   27   32   34   36   37   41   46   49   51   54   54   57 
LCS_AVERAGE  LCS_A:  20.22  (  12.08   18.76   29.82 )

GLOBAL_DISTANCE_TEST (summary information about detected largest sets of residues (represented by selected AToms) that can fit under specified thresholds)
GDT DIST_CUTOFF  0.50   1.00   1.50   2.00   2.50   3.00   3.50   4.00   4.50   5.00   5.50   6.00   6.50   7.00   7.50   8.00   8.50   9.00   9.50  10.00
GDT NUMBER_AT     21     35     46     55     58     61     65     68     70     72     73     75     80     85     90     95    103    107    109    113 
GDT PERCENT_AT  10.14  16.91  22.22  26.57  28.02  29.47  31.40  32.85  33.82  34.78  35.27  36.23  38.65  41.06  43.48  45.89  49.76  51.69  52.66  54.59
GDT RMS_LOCAL    0.34   0.68   0.88   1.21   1.39   1.71   2.03   2.14   2.29   2.53   2.56   2.70   4.28   4.67   4.92   5.22   5.59   5.75   5.85   6.14
GDT RMS_ALL_AT  21.26  18.64  18.70  18.92  19.08  19.39  19.80  19.83  19.93  19.36  19.43  19.54  17.56  17.81  17.76  17.55  17.55  17.51  17.49  17.53

# Checking swapping
#   possible swapping detected:  E    26_B      E    26_B
#   possible swapping detected:  D    39_B      D    39_B
#   possible swapping detected:  E    41_B      E    41_B
#   possible swapping detected:  D    43_B      D    43_B
#   possible swapping detected:  E    47_B      E    47_B
#   possible swapping detected:  F    64_B      F    64_B
#   possible swapping detected:  E    66_B      E    66_B
#   possible swapping detected:  E    70_B      E    70_B
#   possible swapping detected:  E    98_B      E    98_B
#   possible swapping detected:  E   129_B      E   129_B
#   possible swapping detected:  E   147_B      E   147_B
#   possible swapping detected:  E   176_B      E   176_B
#   possible swapping detected:  E   180_B      E   180_B
#   possible swapping detected:  E   194_B      E   194_B

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    P     4_B      P     4_B    34.777     0    0.451   0.592    36.444    0.000    0.000
LGA    D     5_B      D     5_B    33.992     3    0.524   0.499    34.758    0.000    0.000
LGA    F     6_B      F     6_B    29.251     0    0.240   1.306    30.900    0.000    0.000
LGA    T     7_B      T     7_B    33.866     0    0.612   1.272    38.204    0.000    0.000
LGA    G     8_B      G     8_B    31.567     0    0.330   0.330    31.954    0.000    0.000
LGA    A     9_B      A     9_B    26.530     0    0.027   0.043    28.117    0.000    0.000
LGA    R    10_B      R    10_B    26.395     6    0.039   0.039    28.053    0.000    0.000
LGA    E    11_B      E    11_B    31.355     0    0.018   1.426    36.217    0.000    0.000
LGA    R    12_B      R    12_B    29.959     0    0.083   1.596    30.368    0.000    0.000
LGA    F    13_B      F    13_B    26.450     0    0.040   1.095    27.871    0.000    0.000
LGA    L    14_B      L    14_B    30.104     3    0.055   0.058    32.191    0.000    0.000
LGA    A    15_B      A    15_B    33.467     0    0.041   0.040    34.233    0.000    0.000
LGA    G    16_B      G    16_B    30.512     0    0.165   0.165    31.136    0.000    0.000
LGA    D    17_B      D    17_B    28.336     0    0.511   1.063    31.874    0.000    0.000
LGA    V    18_B      V    18_B    21.525     0    0.654   1.018    24.122    0.000    0.000
LGA    T    19_B      T    19_B    22.708     0    0.663   0.540    26.663    0.000    0.000
LGA    I    20_B      I    20_B    20.677     0    0.585   0.814    21.809    0.000    0.000
LGA    V    21_B      V    21_B    18.063     0    0.554   0.652    19.311    0.000    0.000
LGA    L    22_B      L    22_B    17.471     0    0.489   0.435    19.291    0.000    0.000
LGA    L    23_B      L    23_B    21.419     0    0.490   1.443    26.339    0.000    0.000
LGA    I    24_B      I    24_B    19.410     0    0.473   1.306    22.934    0.000    0.000
LGA    A    25_B      A    25_B    20.229     0    0.187   0.202    21.777    0.000    0.000
LGA    E    26_B      E    26_B    25.190     0    0.127   0.938    28.963    0.000    0.000
LGA    S    27_B      S    27_B    27.139     0    0.261   0.498    28.808    0.000    0.000
LGA    H    28_B      H    28_B    21.020     0    0.164   1.407    25.004    0.000    0.000
LGA    D    29_B      D    29_B    22.611     0    0.434   0.442    25.540    0.000    0.000
LGA    A    30_B      A    30_B    21.129     0    0.643   0.646    21.863    0.000    0.000
LGA    P    31_B      P    31_B    16.701     0    0.546   0.525    17.625    0.000    0.000
LGA    Y    32_B      Y    32_B    13.845     0    0.380   1.125    19.922    0.000    0.000
LGA    R    33_B      R    33_B    13.812     0    0.211   1.424    20.053    0.000    0.000
LGA    L    34_B      L    34_B     6.859     0    0.121   0.214     9.452   13.333   13.333
LGA    A    35_B      A    35_B     5.715     0    0.598   0.601     7.760   33.571   28.286
LGA    N    36_B      N    36_B     3.717     3    0.163   0.170     6.676   40.714   22.024
LGA    P    37_B      P    37_B     5.462     0    0.099   0.255    10.086   20.238   23.673
LGA    E    38_B      E    38_B    11.303     4    0.679   0.621    12.401    0.714    0.317
LGA    D    39_B      D    39_B    12.232     0    0.083   1.134    16.976    0.714    0.357
LGA    P    40_B      P    40_B     8.535     0    0.105   0.362    12.226    6.190    3.537
LGA    E    41_B      E    41_B     9.493     0    0.633   0.717    14.517    1.310    0.582
LGA    A    42_B      A    42_B     8.700     0    0.644   0.591     9.777    8.690    7.048
LGA    D    43_B      D    43_B     7.839     0    0.361   1.114    11.945    7.976    4.048
LGA    L    44_B      L    44_B     5.458     0    0.627   1.520     7.911   17.976   23.274
LGA    S    45_B      S    45_B     4.085     0    0.068   0.576     4.365   41.905   40.317
LGA    D    46_B      D    46_B     3.567     0    0.031   0.697     4.348   45.119   45.952
LGA    E    47_B      E    47_B     3.605     0    0.026   0.744     4.992   45.000   42.116
LGA    Q    48_B      Q    48_B     3.899     0    0.016   1.229     9.027   45.000   28.201
LGA    L    49_B      L    49_B     3.365     0    0.020   1.020     4.951   51.905   47.798
LGA    E    50_B      E    50_B     2.028     4    0.018   0.018     2.594   69.048   37.884
LGA    R    51_B      R    51_B     2.068     0    0.031   1.230     8.731   68.810   45.671
LGA    A    52_B      A    52_B     2.368     0    0.013   0.020     2.913   64.762   63.238
LGA    L    53_B      L    53_B     1.674     0    0.027   1.386     4.290   75.000   63.214
LGA    A    54_B      A    54_B     0.932     0    0.034   0.039     1.164   83.690   85.048
LGA    A    55_B      A    55_B     1.352     0    0.006   0.014     1.702   77.143   78.000
LGA    Y    56_B      Y    56_B     1.649     0    0.043   0.141     1.934   72.857   77.857
LGA    L    57_B      L    57_B     1.605     0    0.105   1.384     4.042   75.000   67.560
LGA    T    58_B      T    58_B     1.730     0    0.025   0.168     1.969   72.857   72.857
LGA    L    59_B      L    59_B     1.784     0    0.039   0.910     3.465   72.857   68.988
LGA    V    60_B      V    60_B     1.669     0    0.041   1.181     3.283   72.857   69.592
LGA    E    61_B      E    61_B     1.668     0    0.017   1.006     4.707   72.857   62.434
LGA    T    62_B      T    62_B     1.797     0    0.021   0.236     2.213   72.857   71.701
LGA    L    63_B      L    63_B     1.499     0    0.099   0.339     1.950   79.286   78.214
LGA    F    64_B      F    64_B     1.517     0    0.031   0.236     1.640   72.857   75.974
LGA    P    65_B      P    65_B     1.755     0    0.039   0.052     1.779   72.857   72.857
LGA    E    66_B      E    66_B     1.904     0    0.047   1.291     4.508   72.857   60.635
LGA    L    67_B      L    67_B     2.122     0    0.070   1.326     4.197   64.762   64.405
LGA    Y    68_B      Y    68_B     2.003     0    0.085   0.141     2.253   70.833   69.484
LGA    A    69_B      A    69_B     1.870     0    0.022   0.025     1.913   72.857   72.857
LGA    E    70_B      E    70_B     1.934     0    0.048   0.622     3.178   72.857   67.672
LGA    M    71_B      M    71_B     1.969     0    0.045   0.795     3.325   72.857   66.964
LGA    K    72_B      K    72_B     1.792     0    0.043   0.726     1.944   72.857   75.767
LGA    A    73_B      A    73_B     1.760     0    0.059   0.068     1.999   77.143   76.286
LGA    A    74_B      A    74_B     1.283     0    0.016   0.021     1.466   83.690   83.238
LGA    L    75_B      L    75_B     0.996     0    0.052   1.275     3.419   85.952   75.595
LGA    A    76_B      A    76_B     1.095     0    0.048   0.051     1.426   88.333   86.952
LGA    A    77_B      A    77_B     0.756     0    0.021   0.025     1.093   88.214   86.857
LGA    A    78_B      A    78_B     0.862     0    0.058   0.087     0.946   90.476   90.476
LGA    K    79_B      K    79_B     1.250     0    0.035   1.013     4.378   79.286   62.169
LGA    T    80_B      T    80_B     1.922     0    0.034   0.886     4.169   68.810   63.129
LGA    P    81_B      P    81_B     3.245     0    0.011   0.044     3.907   51.786   50.136
LGA    E    82_B      E    82_B     3.766     4    0.011   0.013     4.112   46.667   24.868
LGA    E    83_B      E    83_B     2.539     4    0.015   0.020     2.937   60.952   34.286
LGA    K    84_B      K    84_B     2.107     0    0.025   0.480     3.241   64.762   63.175
LGA    I    85_B      I    85_B     3.621     0    0.033   0.985     4.446   48.333   44.345
LGA    A    86_B      A    86_B     3.335     0    0.013   0.013     3.587   53.571   51.524
LGA    V    87_B      V    87_B     1.328     0    0.019   0.116     1.983   79.286   84.082
LGA    F    88_B      F    88_B     2.047     0    0.014   0.134     3.739   66.786   55.541
LGA    R    89_B      R    89_B     3.119     0    0.015   0.913     6.998   55.357   40.130
LGA    E    90_B      E    90_B     2.294     0    0.010   0.147     2.920   68.810   63.175
LGA    Y    91_B      Y    91_B     0.385     0    0.145   1.374    10.781   86.071   47.857
LGA    N    92_B      N    92_B     2.160     0    0.009   0.403     4.458   64.881   55.060
LGA    A    93_B      A    93_B     2.831     0    0.041   0.043     3.225   60.952   58.762
LGA    R    94_B      R    94_B     1.751     0    0.047   1.297     3.086   70.833   64.372
LGA    F    95_B      F    95_B     1.399     0    0.046   1.237     6.455   77.143   55.801
LGA    L    96_B      L    96_B     2.367     0    0.045   1.063     6.483   64.762   48.274
LGA    A    97_B      A    97_B     2.269     0    0.041   0.048     2.394   66.786   66.381
LGA    E    98_B      E    98_B     1.150     0    0.030   0.780     3.142   81.429   71.693
LGA    F    99_B      F    99_B     1.396     0    0.086   0.212     3.573   81.429   66.234
LGA    D   100_B      D   100_B     1.236     0    0.020   0.357     1.855   81.429   80.357
LGA    A   101_B      A   101_B     1.397     0    0.035   0.037     1.545   79.286   79.714
LGA    L   102_B      L   102_B     1.127     0    0.044   0.971     3.643   81.429   71.667
LGA    I   103_B      I   103_B     1.562     0    0.014   0.512     2.979   75.000   70.000
LGA    D   104_B      D   104_B     1.764     0    0.008   0.365     3.440   77.143   66.310
LGA    Q   105_B      Q   105_B     1.169     0    0.055   1.104     4.279   81.429   69.259
LGA    A   106_B      A   106_B     1.616     0    0.027   0.031     1.891   75.000   74.571
LGA    F   107_B      F   107_B     1.652     0    0.080   0.829     3.951   77.143   60.693
LGA    A   108_B      A   108_B     1.467     0    0.041   0.049     1.677   81.429   79.714
LGA    R   109_B      R   109_B     1.814     0    0.019   1.050     6.124   75.000   54.978
LGA    L   110_B      L   110_B     1.719     3    0.189   0.194     2.766   68.929   43.571
LGA    K   111_B      K   111_B     1.895     2    0.095   0.506     3.033   63.214   50.582
LGA    A   112_B      A   112_B     4.885     0    0.108   0.134     6.168   28.333   26.952
LGA    D   113_B      D   113_B     6.482     0    0.655   0.726     7.177   17.500   15.893
LGA    S   114_B      S   114_B    10.448     0    0.336   0.751    12.202    0.119    0.079
LGA    L   115_B      L   115_B    11.367     0    0.438   0.680    12.953    0.000    1.905
LGA    T   116_B      T   116_B    16.796     0    0.089   0.104    20.390    0.000    0.000
LGA    L   117_B      L   117_B    18.324     0    0.075   0.817    20.848    0.000    0.000
LGA    K   118_B      K   118_B    24.308     0    0.097   0.881    27.030    0.000    0.000
LGA    I   119_B      I   119_B    26.860     0    0.113   0.500    29.890    0.000    0.000
LGA    H   120_B      H   120_B    33.781     0    0.185   0.997    35.410    0.000    0.000
LGA    L   121_B      L   121_B    36.607     0    0.090   1.436    40.077    0.000    0.000
LGA    S   122_B      S   122_B    42.410     0    0.558   0.882    43.778    0.000    0.000
LGA    Q   123_B      Q   123_B    44.315     4    0.597   0.598    46.509    0.000    0.000
LGA    G   124_B      G   124_B    42.479     0    0.584   0.584    43.513    0.000    0.000
LGA    K   125_B      K   125_B    39.763     4    0.132   0.207    41.771    0.000    0.000
LGA    G   126_B      G   126_B    33.742     0    0.144   0.144    35.525    0.000    0.000
LGA    S   127_B      S   127_B    31.186     0    0.243   0.546    32.584    0.000    0.000
LGA    Y   128_B      Y   128_B    26.270     0    0.082   0.857    28.113    0.000    0.000
LGA    E   129_B      E   129_B    24.756     0    0.116   0.761    30.239    0.000    0.000
LGA    I   130_B      I   130_B    19.115     0    0.034   0.190    21.400    0.000    0.000
LGA    I   131_B      I   131_B    18.126     0    0.056   0.142    22.355    0.000    0.000
LGA    F   132_B      F   132_B    14.099     0    0.034   0.653    15.796    0.000    0.000
LGA    P   133_B      P   133_B    11.839     0    0.025   0.164    12.308    0.000    0.204
LGA    P   134_B      P   134_B    11.030     0    0.674   0.641    11.757    0.000    0.000
LGA    E   135_B      E   135_B     7.202     4    0.135   0.134     8.685    5.595    4.868
LGA    V   136_B      V   136_B     9.714     0    0.163   0.306    11.703    0.833    1.224
LGA    Q   137_B      Q   137_B    13.442     4    0.050   0.055    14.803    0.000    0.000
LGA    A   138_B      A   138_B    12.744     0    0.200   0.207    13.858    0.000    0.000
LGA    D   139_B      D   139_B    12.158     0    0.053   0.229    13.062    0.000    0.000
LGA    P   140_B      P   140_B    15.149     0    0.058   0.201    16.303    0.000    0.000
LGA    E   141_B      E   141_B    14.732     0    0.031   0.696    17.488    0.000    0.000
LGA    R   142_B      R   142_B    11.356     0    0.066   0.733    12.421    0.000    6.797
LGA    A   143_B      A   143_B    13.369     0    0.017   0.027    14.411    0.000    0.000
LGA    A   144_B      A   144_B    16.091     0    0.012   0.023    17.054    0.000    0.000
LGA    A   145_B      A   145_B    13.467     0    0.013   0.020    14.189    0.000    0.000
LGA    I   146_B      I   146_B    11.877     0    0.023   0.280    13.299    0.000    0.000
LGA    E   147_B      E   147_B    15.835     0    0.022   0.688    18.696    0.000    0.000
LGA    A   148_B      A   148_B    16.370     0    0.032   0.038    16.461    0.000    0.000
LGA    L   149_B      L   149_B    13.368     0    0.056   1.353    14.259    0.000    0.000
LGA    W   150_B      W   150_B    14.349     0    0.042   1.023    16.516    0.000    0.102
LGA    K   151_B      K   151_B    18.967     4    0.023   0.035    20.207    0.000    0.000
LGA    P   152_B      P   152_B    18.535     0    0.098   0.233    18.535    0.000    0.000
LGA    T   153_B      T   153_B    16.439     0    0.040   1.142    17.754    0.000    0.000
LGA    L   154_B      L   154_B    19.197     0    0.064   1.283    21.598    0.000    0.000
LGA    D   155_B      D   155_B    21.198     0    0.024   0.122    22.668    0.000    0.000
LGA    Q   156_B      Q   156_B    18.897     0    0.028   0.756    19.535    0.000    0.000
LGA    L   157_B      L   157_B    19.207     0    0.033   1.430    20.751    0.000    0.000
LGA    L   158_B      L   158_B    22.755     0    0.016   0.867    26.605    0.000    0.000
LGA    A   159_B      A   159_B    22.538     0    0.033   0.035    22.592    0.000    0.000
LGA    V   160_B      V   160_B    20.664     0    0.018   0.224    21.859    0.000    0.000
LGA    L   161_B      L   161_B    22.887     0    0.017   1.273    24.511    0.000    0.000
LGA    Q   162_B      Q   162_B    25.148     0    0.020   0.746    25.904    0.000    0.000
LGA    E   163_B      E   163_B    24.293     3    0.111   0.239    24.612    0.000    0.000
LGA    K   164_B      K   164_B    23.725     4    0.027   0.047    25.337    0.000    0.000
LGA    H   165_B      H   165_B    27.659     0    0.130   1.067    30.111    0.000    0.000
LGA    K   166_B      K   166_B    28.542     2    0.660   0.805    29.463    0.000    0.000
LGA    G   167_B      G   167_B    32.475     0    0.187   0.187    32.872    0.000    0.000
LGA    K   168_B      K   168_B    32.201     0    0.049   0.638    32.298    0.000    0.000
LGA    P   169_B      P   169_B    32.409     0    0.120   0.155    32.959    0.000    0.000
LGA    A   170_B      A   170_B    33.005     0    0.626   0.561    33.005    0.000    0.000
LGA    T   171_B      T   171_B    30.772     0    0.617   1.194    33.199    0.000    0.000
LGA    T   172_B      T   172_B    33.947     0    0.461   0.773    36.477    0.000    0.000
LGA    V   173_B      V   173_B    31.900     0    0.066   0.252    32.466    0.000    0.000
LGA    T   174_B      T   174_B    32.965     0    0.074   0.143    35.464    0.000    0.000
LGA    Y   175_B      Y   175_B    30.206     0    0.132   0.227    32.340    0.000    0.000
LGA    E   176_B      E   176_B    31.832     0    0.102   0.530    37.508    0.000    0.000
LGA    I   177_B      I   177_B    31.212     0    0.048   0.199    34.439    0.000    0.000
LGA    S   178_B      S   178_B    33.992     0    0.113   0.190    35.184    0.000    0.000
LGA    A   179_B      A   179_B    32.498     0    0.085   0.095    34.170    0.000    0.000
LGA    E   180_B      E   180_B    31.821     0    0.052   1.006    37.409    0.000    0.000
LGA    T   181_B      T   181_B    27.392     0    0.049   1.129    29.400    0.000    0.000
LGA    L   182_B      L   182_B    23.857     0    0.047   0.939    25.691    0.000    0.000
LGA    R   183_B      R   183_B    24.283     0    0.037   1.250    34.375    0.000    0.000
LGA    A   184_B      A   184_B    24.068     0    0.025   0.025    25.708    0.000    0.000
LGA    A   185_B      A   185_B    18.370     0    0.017   0.030    20.702    0.000    0.000
LGA    V   186_B      V   186_B    15.583     0    0.027   0.084    17.184    0.000    0.000
LGA    A   187_B      A   187_B    18.681     0    0.009   0.013    21.257    0.000    0.000
LGA    A   188_B      A   188_B    16.763     0    0.031   0.034    17.616    0.000    0.000
LGA    L   189_B      L   189_B    10.669     0    0.078   0.621    12.937    0.000    1.250
LGA    A   190_B      A   190_B    12.824     0    0.015   0.018    14.375    0.000    0.000
LGA    R   191_B      R   191_B    17.615     0    0.051   1.060    24.180    0.000    0.000
LGA    A   192_B      A   192_B    13.994     0    0.040   0.040    14.912    0.000    0.000
LGA    A   193_B      A   193_B    11.854     0    0.026   0.032    14.784    0.000    0.000
LGA    E   194_B      E   194_B    17.457     0    0.015   0.788    22.519    0.000    0.000
LGA    A   195_B      A   195_B    20.161     0    0.014   0.014    21.584    0.000    0.000
LGA    A   196_B      A   196_B    17.754     0    0.029   0.034    20.734    0.000    0.000
LGA    L   197_B      L   197_B    19.930     0    0.032   0.270    23.877    0.000    0.000
LGA    R   198_B      R   198_B    25.510     0    0.023   0.544    28.468    0.000    0.000
LGA    R   199_B      R   199_B    26.540     0    0.015   1.257    29.031    0.000    0.000
LGA    K   200_B      K   200_B    26.400     0    0.019   0.618    30.066    0.000    0.000
LGA    V   201_B      V   201_B    29.539     0    0.063   1.293    33.739    0.000    0.000
LGA    G   202_B      G   202_B    34.610     0    0.170   0.170    38.225    0.000    0.000
LGA    S   203_B      S   203_B    36.086     1    0.520   0.529    38.014    0.000    0.000
LGA    L   204_B      L   204_B    36.393     3    0.223   0.233    36.393    0.000    0.000
LGA    E   205_B      E   205_B    33.272     4    0.205   0.194    34.097    0.000    0.000
LGA    S   206_B      S   206_B    36.480     1    0.404   0.375    37.725    0.000    0.000
LGA    S   207_B      S   207_B    36.182     0    0.451   0.721    37.260    0.000    0.000
LGA    G   208_B      G   208_B    31.555     0    0.336   0.336    33.006    0.000    0.000
LGA    L   209_B      L   209_B    26.228     3    0.602   0.557    27.781    0.000    0.000
LGA    E   210_B      E   210_B    24.094     4    0.368   0.395    25.326    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      207     828    828  100.00    1517   1517  100.00               207
SUMMARY(RMSD_GDC):    15.467         15.413                 15.134           23.851   21.405

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  214  207    4.0     68    2.14    30.556    27.904     3.034

LGA_LOCAL      RMSD:   2.141  Number of atoms:   68  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  19.828  Number of assigned atoms:  207 
Std_ASGN_ATOMS RMSD:  15.467  Standard rmsd on all 207 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.127881 * X  +  -0.960139 * Y  +   0.248556 * Z  +  -8.942417
  Y_new =  -0.199515 * X  +   0.270395 * Y  +   0.941849 * Z  + -19.460684
  Z_new =  -0.971514 * X  +   0.070854 * Y  +  -0.226141 * Z  + -12.525807 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -2.140790  1.331539  2.837962   [DEG: -122.6583   76.2916  162.6032 ]
ZXZ:  2.883573  1.798911 -1.497993   [DEG:  165.2166  103.0700  -85.8287 ]
 
# END of job
