
#######################################################
#                                                     #
#                        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:    71      44_B - 114_B       4.99    22.69
  LCS_AVERAGE:     26.13

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    55      59_B - 113_B       1.94    20.89
  LONGEST_CONTINUOUS_SEGMENT:    55      60_B - 114_B       1.95    20.79
  LCS_AVERAGE:     16.95

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    48      65_B - 112_B       1.00    20.71
  LCS_AVERAGE:     12.10

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      4   10   19      0    3    5    7   10   12   13   15   15   17   18   19   19   20   22   24   60   63   65   66 
LCS_GDT     D     5_B     D     5_B      4   10   19      3    4    5    7    9   12   13   15   15   17   18   19   19   21   24   24   41   53   58   64 
LCS_GDT     F     6_B     F     6_B      4   13   19      3    4    6    9   11   12   13   15   16   17   18   20   34   34   42   50   51   56   59   64 
LCS_GDT     T     7_B     T     7_B      4   13   19      3    4    6    9   11   12   14   15   16   17   18   20   29   31   39   43   51   56   59   64 
LCS_GDT     G     8_B     G     8_B     10   13   19      3    6   10   10   11   12   14   15   19   20   24   27   34   39   46   50   54   61   62   65 
LCS_GDT     A     9_B     A     9_B     10   13   19      4    7   10   10   11   12   14   15   19   20   24   30   34   39   46   50   54   61   62   65 
LCS_GDT     R    10_B     R    10_B     10   13   19      3    7   10   10   11   12   14   15   18   20   23   27   30   38   46   50   54   56   60   64 
LCS_GDT     E    11_B     E    11_B     10   13   19      5    7   10   10   11   12   14   15   19   20   24   27   31   38   46   50   54   56   60   64 
LCS_GDT     R    12_B     R    12_B     10   13   19      5    7   10   10   11   12   14   15   19   20   24   30   34   39   46   50   55   61   62   65 
LCS_GDT     F    13_B     F    13_B     10   13   19      5    7   10   10   11   12   14   15   19   20   24   30   34   39   46   50   54   61   62   65 
LCS_GDT     L    14_B     L    14_B     10   13   20      5    7   10   10   11   12   14   15   19   20   24   30   34   39   46   50   54   56   60   64 
LCS_GDT     A    15_B     A    15_B     10   13   20      5    7   10   10   11   12   14   15   19   20   24   30   34   39   46   50   54   56   60   64 
LCS_GDT     G    16_B     G    16_B     10   13   20      3    7   10   10   11   12   14   15   19   20   24   30   34   39   46   50   54   56   60   64 
LCS_GDT     D    17_B     D    17_B     10   13   20      3    7   10   10   11   12   14   15   19   20   24   30   34   39   46   50   55   61   62   65 
LCS_GDT     V    18_B     V    18_B      3   13   20      3    3    5    7   11   11   14   15   19   20   24   30   34   39   46   50   54   56   60   65 
LCS_GDT     T    19_B     T    19_B      3   12   20      3    3    4    8   10   11   13   15   19   20   24   30   34   42   46   50   55   61   62   65 
LCS_GDT     I    20_B     I    20_B      3    4   20      3    3    4    5    5    7   10   15   19   20   23   27   34   42   46   50   55   61   62   65 
LCS_GDT     V    21_B     V    21_B      3    3   20      3    3    4    5    7    8   11   13   15   19   23   25   31   39   46   50   54   68   81   82 
LCS_GDT     L    22_B     L    22_B      3    3   20      3    3    4    5    7    9   11   13   19   53   57   65   68   74   76   79   82   84   90   92 
LCS_GDT     L    23_B     L    23_B      3    3   20      3    3    4    5    6    8   11   14   16   21   22   49   52   66   75   78   81   84   86   91 
LCS_GDT     I    24_B     I    24_B      4    4   20      3    5    5    5    6    9   11   13   15   17   20   49   52   58   66   75   79   82   86   90 
LCS_GDT     A    25_B     A    25_B      4    4   20      3    4    4    4    6    8    9   12   15   18   18   47   51   54   59   65   71   77   82   86 
LCS_GDT     E    26_B     E    26_B      4    4   20      3    4    4    4    4    8    9   14   35   36   43   48   60   65   70   75   79   81   85   90 
LCS_GDT     S    27_B     S    27_B      4    4   20      4    5    5    5    6    9   11   13   16   18   20   31   36   58   59   63   74   81   83   86 
LCS_GDT     H    28_B     H    28_B      4    4   20      4    5    5    5    7    9   11   14   16   18   20   25   30   42   54   58   68   77   81   82 
LCS_GDT     D    29_B     D    29_B      4    4   20      4    5    5    5    6    9   11   13   14   17   20   22   25   29   54   58   68   77   81   82 
LCS_GDT     A    30_B     A    30_B      4    4   20      4    5    5    5    6    9   11   13   14   17   20   23   26   29   33   37   40   77   81   82 
LCS_GDT     P    31_B     P    31_B      4    4   20      3    3    4    4    5    7   11   13   16   18   22   24   27   53   58   64   69   77   81   82 
LCS_GDT     Y    32_B     Y    32_B      4    4   20      3    3    4    5    6    7   11   13   16   18   22   30   34   39   46   50   54   56   66   75 
LCS_GDT     R    33_B     R    33_B      4    4   20      3    3    4    4    6    7   11   13   16   19   22   30   34   39   46   50   54   58   67   75 
LCS_GDT     L    34_B     L    34_B      4    4   20      3    4    4    4    6   11   12   13   17   30   48   52   55   58   63   65   69   72   74   76 
LCS_GDT     A    35_B     A    35_B      4    6   20      3    4    5    5   13   20   32   35   42   47   52   57   60   62   64   65   69   72   74   76 
LCS_GDT     N    36_B     N    36_B      5    8   38      4    4    5    6    8   11   12   15   17   22   24   33   40   52   57   63   67   71   73   76 
LCS_GDT     P    37_B     P    37_B      5    8   40      4    4    5    6    8    9   10   12   16   18   22   24   27   31   33   37   40   43   46   54 
LCS_GDT     E    38_B     E    38_B      5    8   41      4    4    5    6    8    9   11   13   16   18   22   24   27   31   33   37   40   43   46   48 
LCS_GDT     D    39_B     D    39_B      5    8   42      4    4    5    6    8    9   10   11   16   18   22   24   27   31   43   48   51   56   61   63 
LCS_GDT     P    40_B     P    40_B      5    8   43      3    4    5    6    8    9   11   13   16   18   22   24   27   36   46   49   55   59   62   66 
LCS_GDT     E    41_B     E    41_B      4   30   65      3    4    5    6    8    9   10   11   12   14   17   23   44   46   50   53   55   59   63   66 
LCS_GDT     A    42_B     A    42_B     21   33   68      3    3   23   28   31   34   38   40   43   46   48   52   55   58   62   64   67   71   74   76 
LCS_GDT     D    43_B     D    43_B     25   33   69      3    5   18   24   31   35   38   40   45   47   49   52   57   60   62   65   69   72   74   76 
LCS_GDT     L    44_B     L    44_B     26   33   71      3   19   28   29   31   35   38   40   45   47   49   52   57   60   62   65   69   72   74   76 
LCS_GDT     S    45_B     S    45_B     26   33   71     15   19   28   29   31   37   40   42   45   51   53   54   58   60   62   65   69   72   74   76 
LCS_GDT     D    46_B     D    46_B     26   33   71     15   19   28   29   32   38   40   42   45   51   53   54   58   60   62   65   69   72   74   76 
LCS_GDT     E    47_B     E    47_B     26   33   71     15   19   28   29   31   35   38   41   45   51   53   54   58   60   62   65   69   72   74   76 
LCS_GDT     Q    48_B     Q    48_B     26   33   71     15   19   28   29   31   35   38   40   45   51   53   54   58   60   62   65   69   72   74   76 
LCS_GDT     L    49_B     L    49_B     26   33   71     15   19   28   29   31   38   40   42   45   51   53   54   58   60   62   65   69   72   74   76 
LCS_GDT     E    50_B     E    50_B     26   33   71     15   19   28   29   32   35   40   42   45   51   53   54   58   60   62   65   69   72   74   76 
LCS_GDT     R    51_B     R    51_B     26   33   71     15   19   28   29   31   35   38   41   45   51   53   54   58   60   62   65   69   72   74   76 
LCS_GDT     A    52_B     A    52_B     26   33   71     15   19   28   29   31   35   38   40   45   51   53   54   58   61   64   65   69   72   74   76 
LCS_GDT     L    53_B     L    53_B     26   33   71     15   19   28   30   33   38   40   42   45   51   53   56   58   62   64   65   69   72   74   76 
LCS_GDT     A    54_B     A    54_B     26   33   71     15   19   28   29   31   35   38   42   45   51   53   56   60   62   64   65   69   72   74   76 
LCS_GDT     A    55_B     A    55_B     26   33   71     15   19   28   29   31   35   38   40   45   51   53   57   60   62   64   65   69   72   74   76 
LCS_GDT     Y    56_B     Y    56_B     26   33   71     15   19   28   29   31   35   38   42   49   53   58   59   60   62   64   65   69   72   74   76 
LCS_GDT     L    57_B     L    57_B     26   33   71     15   19   28   30   33   38   40   44   51   56   58   59   60   63   64   65   71   74   81   86 
LCS_GDT     T    58_B     T    58_B     26   51   71     15   19   28   29   31   35   40   47   51   56   58   59   60   63   64   68   70   74   80   86 
LCS_GDT     L    59_B     L    59_B     26   55   71     15   19   28   29   31   38   43   49   54   56   58   59   60   65   68   70   75   83   86   91 
LCS_GDT     V    60_B     V    60_B     26   55   71     10   19   28   30   41   47   52   54   54   56   58   62   64   68   76   78   82   84   90   92 
LCS_GDT     E    61_B     E    61_B     26   55   71      9   19   28   38   44   50   52   54   54   57   60   64   66   69   76   79   82   84   90   92 
LCS_GDT     T    62_B     T    62_B     26   55   71      9   17   28   30   41   47   52   54   54   57   60   64   66   68   72   76   79   84   90   92 
LCS_GDT     L    63_B     L    63_B     26   55   71      9   17   28   31   41   47   52   54   54   57   60   64   66   68   76   79   82   84   90   92 
LCS_GDT     F    64_B     F    64_B     46   55   71      9   19   37   46   49   50   52   54   54   57   60   65   69   74   76   79   82   84   90   92 
LCS_GDT     P    65_B     P    65_B     48   55   71      9   20   42   47   49   50   52   54   54   57   60   65   69   74   76   79   82   84   90   92 
LCS_GDT     E    66_B     E    66_B     48   55   71      9   20   42   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   90   92 
LCS_GDT     L    67_B     L    67_B     48   55   71      9   39   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   90   92 
LCS_GDT     Y    68_B     Y    68_B     48   55   71      7   33   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   90   92 
LCS_GDT     A    69_B     A    69_B     48   55   71     11   36   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   90   92 
LCS_GDT     E    70_B     E    70_B     48   55   71      7   39   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   90   92 
LCS_GDT     M    71_B     M    71_B     48   55   71     19   39   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   90   92 
LCS_GDT     K    72_B     K    72_B     48   55   71      8   39   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   90   92 
LCS_GDT     A    73_B     A    73_B     48   55   71     19   39   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   90   92 
LCS_GDT     A    74_B     A    74_B     48   55   71      8   39   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   90   92 
LCS_GDT     L    75_B     L    75_B     48   55   71     19   39   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   90   92 
LCS_GDT     A    76_B     A    76_B     48   55   71     19   39   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   90   92 
LCS_GDT     A    77_B     A    77_B     48   55   71     19   39   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   90   92 
LCS_GDT     A    78_B     A    78_B     48   55   71     19   39   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   87   91 
LCS_GDT     K    79_B     K    79_B     48   55   71     19   39   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   87   91 
LCS_GDT     T    80_B     T    80_B     48   55   71     19   39   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   86   91 
LCS_GDT     P    81_B     P    81_B     48   55   71     14   39   45   47   49   50   52   54   54   56   59   65   68   74   76   79   82   84   86   91 
LCS_GDT     E    82_B     E    82_B     48   55   71     12   39   45   47   49   50   52   54   54   56   59   65   68   74   76   79   82   84   86   91 
LCS_GDT     E    83_B     E    83_B     48   55   71     19   39   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   86   91 
LCS_GDT     K    84_B     K    84_B     48   55   71     19   39   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   87   91 
LCS_GDT     I    85_B     I    85_B     48   55   71     19   39   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   87   91 
LCS_GDT     A    86_B     A    86_B     48   55   71     19   39   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   87   91 
LCS_GDT     V    87_B     V    87_B     48   55   71     12   39   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   87   92 
LCS_GDT     F    88_B     F    88_B     48   55   71     12   39   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   87   92 
LCS_GDT     R    89_B     R    89_B     48   55   71     19   39   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   87   92 
LCS_GDT     E    90_B     E    90_B     48   55   71     19   39   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   87   92 
LCS_GDT     Y    91_B     Y    91_B     48   55   71     12   36   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   90   92 
LCS_GDT     N    92_B     N    92_B     48   55   71     12   39   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   90   92 
LCS_GDT     A    93_B     A    93_B     48   55   71     19   39   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   90   92 
LCS_GDT     R    94_B     R    94_B     48   55   71     19   39   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   90   92 
LCS_GDT     F    95_B     F    95_B     48   55   71     19   39   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   90   92 
LCS_GDT     L    96_B     L    96_B     48   55   71     19   39   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   90   92 
LCS_GDT     A    97_B     A    97_B     48   55   71     19   39   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   90   92 
LCS_GDT     E    98_B     E    98_B     48   55   71     19   39   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   90   92 
LCS_GDT     F    99_B     F    99_B     48   55   71     14   39   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   90   92 
LCS_GDT     D   100_B     D   100_B     48   55   71      7   39   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   90   92 
LCS_GDT     A   101_B     A   101_B     48   55   71     12   39   45   47   49   50   52   54   54   56   59   65   69   74   76   79   82   84   90   92 
LCS_GDT     L   102_B     L   102_B     48   55   71     14   39   45   47   49   50   52   54   54   57   60   65   69   74   76   79   82   84   90   92 
LCS_GDT     I   103_B     I   103_B     48   55   71     12   39   45   47   49   50   52   54   54   57   60   65   69   74   76   79   82   84   90   92 
LCS_GDT     D   104_B     D   104_B     48   55   71     12   39   45   47   49   50   52   54   54   57   60   65   69   74   76   79   82   84   90   92 
LCS_GDT     Q   105_B     Q   105_B     48   55   71     19   39   45   47   49   50   52   54   54   57   60   65   69   74   76   79   82   84   90   92 
LCS_GDT     A   106_B     A   106_B     48   55   71     14   39   45   47   49   50   52   54   54   57   60   65   69   74   76   79   82   84   90   92 
LCS_GDT     F   107_B     F   107_B     48   55   71     12   39   45   47   49   50   52   54   54   57   60   65   69   74   76   79   82   84   90   92 
LCS_GDT     A   108_B     A   108_B     48   55   71     14   39   45   47   49   50   52   54   54   57   60   65   69   74   76   79   82   84   90   92 
LCS_GDT     R   109_B     R   109_B     48   55   71      6   37   45   47   49   50   52   54   54   57   60   65   69   74   76   79   82   84   90   92 
LCS_GDT     L   110_B     L   110_B     48   55   71      6   25   45   47   49   50   52   54   54   57   60   65   69   74   76   79   82   84   90   92 
LCS_GDT     K   111_B     K   111_B     48   55   71      5   25   45   47   49   50   52   54   54   57   60   65   69   74   76   79   82   84   90   92 
LCS_GDT     A   112_B     A   112_B     48   55   71      9   16   22   46   49   50   52   54   54   57   60   65   69   74   76   79   82   84   90   92 
LCS_GDT     D   113_B     D   113_B      6   55   71      6   18   22   29   39   46   51   54   54   57   60   65   69   74   76   79   82   84   90   92 
LCS_GDT     S   114_B     S   114_B     11   55   71      3   15   22   29   33   46   51   51   54   55   60   65   69   74   76   79   82   84   90   92 
LCS_GDT     L   115_B     L   115_B     11   53   70      4   12   20   29   33   37   41   44   51   55   60   64   69   74   76   79   82   84   90   92 
LCS_GDT     T   116_B     T   116_B     11   38   70      6   14   20   29   33   37   41   44   46   48   56   64   66   68   71   76   80   84   90   91 
LCS_GDT     L   117_B     L   117_B     11   38   68      6   14   22   29   33   37   41   44   46   49   56   64   66   68   71   74   79   84   90   91 
LCS_GDT     K   118_B     K   118_B     11   38   66      7   14   21   28   33   37   40   43   46   48   50   53   62   67   68   71   74   76   81   85 
LCS_GDT     I   119_B     I   119_B     11   38   62      7   14   21   28   33   37   40   43   45   48   49   51   55   62   67   70   71   74   78   79 
LCS_GDT     H   120_B     H   120_B     11   38   61      7   14   18   26   31   37   40   41   45   47   49   51   54   56   58   61   67   72   74   75 
LCS_GDT     L   121_B     L   121_B     11   38   61      7   14   18   25   31   37   40   41   43   47   49   51   52   55   57   59   62   65   73   74 
LCS_GDT     S   122_B     S   122_B     11   38   61      7   14   18   21   31   37   40   41   43   45   47   51   52   55   57   58   59   62   66   68 
LCS_GDT     Q   123_B     Q   123_B     11   38   61      6   13   18   21   31   37   40   41   43   45   47   51   52   55   57   58   59   62   64   68 
LCS_GDT     G   124_B     G   124_B     11   38   61      3   12   16   23   31   37   40   41   43   45   47   51   52   55   57   58   59   62   64   68 
LCS_GDT     K   125_B     K   125_B     11   38   61      3    9   17   22   32   37   40   41   43   47   49   51   52   55   57   59   61   65   67   71 
LCS_GDT     G   126_B     G   126_B     13   38   61      3   12   17   27   33   36   40   41   45   47   49   51   53   55   57   61   64   72   74   77 
LCS_GDT     S   127_B     S   127_B     13   38   61      7   14   18   27   33   37   40   43   45   48   49   51   55   59   63   69   71   73   78   79 
LCS_GDT     Y   128_B     Y   128_B     20   38   61      7   15   21   29   33   37   41   44   46   48   53   62   66   67   69   73   76   79   84   88 
LCS_GDT     E   129_B     E   129_B     21   38   61      6   15   22   29   33   37   41   44   46   51   59   64   66   68   71   74   79   84   90   92 
LCS_GDT     I   130_B     I   130_B     22   38   61      6   16   22   29   33   37   41   47   53   57   60   64   66   68   72   76   82   84   90   92 
LCS_GDT     I   131_B     I   131_B     22   38   61      9   16   22   29   33   37   41   47   53   57   60   64   66   68   72   79   82   84   90   92 
LCS_GDT     F   132_B     F   132_B     22   38   61      9   18   22   29   33   37   43   49   53   57   60   65   69   74   76   79   82   84   90   92 
LCS_GDT     P   133_B     P   133_B     22   38   61      9   18   22   29   33   37   43   49   53   57   60   65   69   74   76   79   82   84   90   92 
LCS_GDT     P   134_B     P   134_B     22   38   61      9   17   22   29   33   37   43   51   53   57   60   65   69   74   76   79   82   84   90   92 
LCS_GDT     E   135_B     E   135_B     22   38   61      9   18   22   29   33   45   50   51   53   57   60   65   69   74   76   79   82   84   90   92 
LCS_GDT     V   136_B     V   136_B     22   38   61     11   18   22   29   33   37   43   50   53   57   60   65   69   74   76   79   82   84   90   92 
LCS_GDT     Q   137_B     Q   137_B     22   38   61      6   16   22   29   33   37   43   49   53   57   60   65   69   74   76   79   82   84   90   92 
LCS_GDT     A   138_B     A   138_B     22   38   61      9   18   22   29   33   37   43   49   53   57   60   65   69   74   76   79   82   84   90   92 
LCS_GDT     D   139_B     D   139_B     22   38   61      9   18   22   29   33   37   43   49   53   57   60   65   69   74   76   79   82   84   90   92 
LCS_GDT     P   140_B     P   140_B     22   38   61      5   18   22   29   33   37   43   49   53   57   60   64   69   74   76   79   82   84   90   92 
LCS_GDT     E   141_B     E   141_B     22   38   61     11   18   22   29   33   37   43   49   53   57   60   64   69   74   76   79   82   84   90   92 
LCS_GDT     R   142_B     R   142_B     22   38   61     11   18   22   29   33   37   43   49   53   57   60   65   69   74   76   79   82   84   90   92 
LCS_GDT     A   143_B     A   143_B     22   38   61     11   18   22   29   33   37   43   49   53   57   60   65   69   74   76   79   82   84   90   92 
LCS_GDT     A   144_B     A   144_B     22   38   61     11   18   22   29   33   37   43   49   53   57   60   64   69   74   76   79   82   84   90   92 
LCS_GDT     A   145_B     A   145_B     22   38   61     11   18   22   29   33   37   43   49   53   57   60   65   69   74   76   79   82   84   90   92 
LCS_GDT     I   146_B     I   146_B     22   38   61     11   18   22   29   33   37   43   49   53   57   60   65   69   74   76   79   82   84   90   92 
LCS_GDT     E   147_B     E   147_B     22   38   61     11   18   22   29   33   37   43   49   53   57   60   64   69   74   76   79   82   84   90   92 
LCS_GDT     A   148_B     A   148_B     22   34   61     11   18   22   29   33   37   43   49   53   57   60   64   66   74   76   79   82   84   90   92 
LCS_GDT     L   149_B     L   149_B     22   33   61     11   18   22   29   33   37   43   49   53   57   60   65   69   74   76   79   82   84   90   92 
LCS_GDT     W   150_B     W   150_B     22   33   61     11   18   22   28   32   37   43   49   53   57   60   64   69   74   76   79   82   84   90   92 
LCS_GDT     K   151_B     K   151_B     22   33   61      7   17   22   27   32   37   42   49   53   57   60   64   66   68   72   79   82   84   90   92 
LCS_GDT     P   152_B     P   152_B     22   33   61      7   15   20   25   32   37   43   49   53   57   60   64   69   74   76   79   82   84   90   92 
LCS_GDT     T   153_B     T   153_B     22   33   61      4   17   21   25   32   37   43   49   53   57   60   64   67   74   76   79   82   84   90   92 
LCS_GDT     L   154_B     L   154_B     22   33   61      7   17   21   25   32   37   43   49   53   57   60   64   66   68   72   76   79   84   90   92 
LCS_GDT     D   155_B     D   155_B     22   33   61      7   17   21   25   32   37   43   49   53   57   60   64   66   68   72   76   82   84   90   92 
LCS_GDT     Q   156_B     Q   156_B     22   33   61      7   17   21   25   31   35   43   49   53   57   60   64   66   68   76   79   82   84   90   92 
LCS_GDT     L   157_B     L   157_B     22   33   61     10   17   21   25   31   35   43   49   53   57   60   64   66   68   72   76   79   84   90   92 
LCS_GDT     L   158_B     L   158_B     22   33   61     10   15   20   25   31   36   43   49   53   57   60   64   66   68   72   76   79   84   90   92 
LCS_GDT     A   159_B     A   159_B     22   33   61     10   17   21   25   31   35   43   49   53   57   60   64   66   68   72   76   79   84   90   92 
LCS_GDT     V   160_B     V   160_B     22   33   61     10   17   21   25   31   35   43   49   53   57   60   64   66   68   72   76   79   84   90   92 
LCS_GDT     L   161_B     L   161_B     22   33   61     10   17   21   25   31   35   43   49   53   57   60   64   66   68   72   76   79   84   90   92 
LCS_GDT     Q   162_B     Q   162_B     22   33   61     10   17   21   25   31   35   43   49   53   57   60   64   66   68   72   76   79   84   90   92 
LCS_GDT     E   163_B     E   163_B     22   33   61     10   17   21   24   31   35   43   49   53   57   60   64   66   68   72   76   79   84   90   92 
LCS_GDT     K   164_B     K   164_B     22   33   60     10   17   21   24   27   30   39   47   53   56   60   64   66   68   72   76   79   84   90   92 
LCS_GDT     H   165_B     H   165_B     22   33   60     10   17   21   25   31   35   43   49   53   57   60   64   66   68   72   76   79   84   90   92 
LCS_GDT     K   166_B     K   166_B     22   33   50      6   17   21   25   31   35   43   49   53   57   60   64   66   68   72   76   79   84   90   92 
LCS_GDT     G   167_B     G   167_B     22   33   50      7   17   21   25   31   35   43   49   53   57   60   64   66   68   72   76   79   84   90   92 
LCS_GDT     K   168_B     K   168_B     22   33   50     10   17   21   25   31   35   43   49   53   57   60   64   66   68   71   76   79   84   90   92 
LCS_GDT     P   169_B     P   169_B     22   33   50      6   17   21   25   31   35   43   49   53   57   60   64   66   68   71   76   79   84   90   92 
LCS_GDT     A   170_B     A   170_B     22   33   50      5   14   21   25   31   35   43   49   53   57   60   64   66   68   71   76   79   84   90   92 
LCS_GDT     T   171_B     T   171_B      9   34   50      3    3    9   18   25   30   36   46   51   56   60   64   66   68   72   76   79   84   90   92 
LCS_GDT     T   172_B     T   172_B     14   34   50      5   10   18   24   30   38   40   42   45   53   58   62   66   68   71   74   79   84   90   92 
LCS_GDT     V   173_B     V   173_B     14   34   50      5    9   15   22   30   38   40   42   45   49   53   54   59   63   69   74   79   84   90   92 
LCS_GDT     T   174_B     T   174_B     21   34   50      5    8   18   24   33   38   40   42   45   51   53   54   58   59   59   60   62   70   76   78 
LCS_GDT     Y   175_B     Y   175_B     29   34   50      5    9   18   30   33   38   40   42   45   51   53   54   58   59   59   60   62   63   65   66 
LCS_GDT     E   176_B     E   176_B     29   34   50      5    7   12   24   33   38   40   42   45   51   53   54   58   59   59   60   62   63   65   66 
LCS_GDT     I   177_B     I   177_B     29   34   42     13   26   27   30   33   38   40   42   45   51   53   54   58   59   59   60   62   63   65   66 
LCS_GDT     S   178_B     S   178_B     29   34   42     15   26   27   30   33   38   40   42   45   51   53   54   58   59   59   60   62   63   65   66 
LCS_GDT     A   179_B     A   179_B     29   34   42     13   26   27   30   33   38   40   42   45   51   53   54   58   59   59   60   62   63   65   66 
LCS_GDT     E   180_B     E   180_B     29   34   42     15   26   27   30   33   38   40   42   45   51   53   54   58   59   59   60   62   63   65   66 
LCS_GDT     T   181_B     T   181_B     29   34   42     18   26   27   30   33   38   40   42   45   51   53   54   58   59   59   60   62   63   65   66 
LCS_GDT     L   182_B     L   182_B     29   34   42     18   26   27   30   33   38   40   42   45   51   53   54   58   59   59   60   62   63   65   66 
LCS_GDT     R   183_B     R   183_B     29   34   42     18   26   27   30   33   38   40   42   45   51   53   54   58   59   59   60   62   63   65   66 
LCS_GDT     A   184_B     A   184_B     29   34   42     18   26   27   30   33   38   40   42   45   51   53   54   58   59   59   60   62   63   65   66 
LCS_GDT     A   185_B     A   185_B     29   34   42     18   26   27   30   33   38   40   42   45   51   53   54   58   59   59   60   62   63   65   66 
LCS_GDT     V   186_B     V   186_B     29   34   42     18   26   27   30   33   38   40   42   45   51   53   54   58   59   59   60   62   63   69   76 
LCS_GDT     A   187_B     A   187_B     29   34   42     18   26   27   30   33   38   40   42   45   51   53   54   58   59   59   60   62   63   65   66 
LCS_GDT     A   188_B     A   188_B     29   34   42     15   26   27   30   33   38   40   42   45   51   53   54   58   59   59   60   62   63   65   66 
LCS_GDT     L   189_B     L   189_B     29   34   42     11   23   27   30   33   38   40   42   45   51   53   54   58   59   59   62   67   71   74   76 
LCS_GDT     A   190_B     A   190_B     29   34   42     15   26   27   30   33   38   40   42   45   51   53   54   58   59   59   60   62   63   65   72 
LCS_GDT     R   191_B     R   191_B     29   34   42     18   26   27   30   33   38   40   42   45   51   53   54   58   59   59   60   62   63   65   66 
LCS_GDT     A   192_B     A   192_B     29   34   42     18   26   27   30   33   38   40   42   45   51   53   54   58   59   59   60   67   71   74   76 
LCS_GDT     A   193_B     A   193_B     29   34   42     18   26   27   30   33   38   40   42   45   51   53   54   58   59   59   63   67   71   74   76 
LCS_GDT     E   194_B     E   194_B     29   34   42     18   26   27   30   33   38   40   42   45   51   53   54   58   59   59   60   62   63   65   66 
LCS_GDT     A   195_B     A   195_B     29   34   42     18   26   27   30   33   38   40   42   45   51   53   54   58   59   59   60   62   63   65   66 
LCS_GDT     A   196_B     A   196_B     29   34   42     18   26   27   30   33   38   40   42   45   51   53   54   58   59   59   60   62   63   65   66 
LCS_GDT     L   197_B     L   197_B     29   34   42     18   26   27   30   33   38   40   42   45   51   53   54   58   59   59   60   62   63   65   66 
LCS_GDT     R   198_B     R   198_B     29   34   42     18   26   27   30   33   38   40   42   45   51   53   54   58   59   59   60   62   63   65   66 
LCS_GDT     R   199_B     R   199_B     29   34   42     18   26   27   30   33   38   40   42   45   51   53   54   58   59   59   60   62   63   65   66 
LCS_GDT     K   200_B     K   200_B     29   34   42     18   26   27   30   33   38   40   42   45   51   53   54   58   59   59   60   62   63   65   66 
LCS_GDT     V   201_B     V   201_B     29   34   42     15   26   27   30   33   38   40   42   45   51   53   54   58   59   59   60   62   63   65   66 
LCS_GDT     G   202_B     G   202_B     29   34   42     18   26   27   30   33   38   40   42   45   51   53   54   58   59   59   60   62   63   65   66 
LCS_GDT     S   203_B     S   203_B     29   34   42      8   26   27   30   33   38   40   42   45   51   53   54   58   59   59   60   62   63   65   66 
LCS_GDT     L   204_B     L   204_B     28   34   42      3    4    4   13   22   32   36   40   44   49   53   54   58   59   59   60   62   63   65   66 
LCS_GDT     E   205_B     E   205_B      4   34   42      3    4    4    5    6   11   23   34   41   44   52   54   56   59   59   60   62   63   65   66 
LCS_GDT     S   206_B     S   206_B      4   32   42      3    4    4    5    7   13   27   35   44   51   53   54   58   59   59   60   62   63   65   66 
LCS_GDT     S   207_B     S   207_B      4    6   42      3    3    4    4    6    7    9   11   29   40   49   54   58   59   59   60   62   63   65   66 
LCS_GDT     G   208_B     G   208_B      4    5   42      0    3    4    4    6    7    7   11   11   12   16   18   28   43   46   55   60   62   63   65 
LCS_GDT     L   209_B     L   209_B      3    5   42      0    3    3    4    5    5    5   11   11   13   22   25   38   47   56   58   60   62   63   65 
LCS_GDT     E   210_B     E   210_B      3    5   42      1    3    3    4    5    6    9   11   11   13   16   17   20   23   33   50   53   57   61   64 
LCS_AVERAGE  LCS_A:  18.39  (  12.10   16.95   26.13 )

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     19     39     45     47     49     50     52     54     54     57     60     65     69     74     76     79     82     84     90     92 
GDT PERCENT_AT   9.18  18.84  21.74  22.71  23.67  24.15  25.12  26.09  26.09  27.54  28.99  31.40  33.33  35.75  36.71  38.16  39.61  40.58  43.48  44.44
GDT RMS_LOCAL    0.35   0.65   0.77   0.93   1.07   1.22   1.49   1.75   1.75   2.99   3.13   3.78   4.33   4.47   4.63   4.87   5.09   5.21   5.88   6.11
GDT RMS_ALL_AT  20.66  20.70  20.71  20.72  20.72  20.73  20.79  20.84  20.84  22.77  22.75  20.63  20.94  20.95  20.91  20.95  21.00  21.04  21.92  21.75

# Checking swapping
#   possible swapping detected:  F     6_B      F     6_B
#   possible swapping detected:  F    13_B      F    13_B
#   possible swapping detected:  E    26_B      E    26_B
#   possible swapping detected:  E    41_B      E    41_B
#   possible swapping detected:  E    47_B      E    47_B
#   possible swapping detected:  F    64_B      F    64_B
#   possible swapping detected:  E    70_B      E    70_B
#   possible swapping detected:  F   107_B      F   107_B
#   possible swapping detected:  F   132_B      F   132_B
#   possible swapping detected:  E   147_B      E   147_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    31.960     0    0.046   0.080    32.923    0.000    0.000
LGA    D     5_B      D     5_B    34.437     3    0.643   0.582    36.681    0.000    0.000
LGA    F     6_B      F     6_B    29.979     0    0.163   0.223    31.506    0.000    0.000
LGA    T     7_B      T     7_B    35.614     0    0.595   1.276    40.003    0.000    0.000
LGA    G     8_B      G     8_B    33.450     0    0.195   0.195    33.830    0.000    0.000
LGA    A     9_B      A     9_B    28.543     0    0.054   0.058    30.112    0.000    0.000
LGA    R    10_B      R    10_B    29.682     6    0.626   0.616    31.622    0.000    0.000
LGA    E    11_B      E    11_B    36.051     0    0.119   0.969    40.906    0.000    0.000
LGA    R    12_B      R    12_B    34.102     0    0.041   1.249    34.762    0.000    0.000
LGA    F    13_B      F    13_B    29.248     0    0.308   1.243    30.722    0.000    0.000
LGA    L    14_B      L    14_B    33.611     3    0.066   0.065    36.313    0.000    0.000
LGA    A    15_B      A    15_B    38.655     0    0.117   0.125    40.101    0.000    0.000
LGA    G    16_B      G    16_B    33.801     0    0.625   0.625    35.063    0.000    0.000
LGA    D    17_B      D    17_B    30.512     0    0.532   0.517    31.172    0.000    0.000
LGA    V    18_B      V    18_B    23.772     0    0.048   1.234    26.028    0.000    0.000
LGA    T    19_B      T    19_B    23.949     0    0.376   0.959    28.407    0.000    0.000
LGA    I    20_B      I    20_B    21.328     0    0.567   0.814    22.454    0.000    0.000
LGA    V    21_B      V    21_B    17.608     0    0.584   0.736    20.478    0.000    0.000
LGA    L    22_B      L    22_B    11.814     0    0.321   0.302    14.163    0.119    0.238
LGA    L    23_B      L    23_B    14.243     0    0.509   1.135    18.369    0.000    0.000
LGA    I    24_B      I    24_B    12.673     0    0.569   0.622    15.739    0.000    0.000
LGA    A    25_B      A    25_B     9.761     0    0.152   0.162    10.333    0.357    0.571
LGA    E    26_B      E    26_B    10.346     0    0.076   1.178    12.913    0.000    0.000
LGA    S    27_B      S    27_B    13.988     0    0.261   0.530    15.885    0.000    0.000
LGA    H    28_B      H    28_B    14.731     0    0.725   1.306    22.210    0.000    0.000
LGA    D    29_B      D    29_B    14.094     0    0.442   0.495    14.729    0.000    0.000
LGA    A    30_B      A    30_B    14.429     0    0.551   0.590    15.984    0.000    0.000
LGA    P    31_B      P    31_B     8.722     0    0.620   0.767    11.525    0.714    3.810
LGA    Y    32_B      Y    32_B    13.503     0    0.183   1.307    16.319    0.000    0.000
LGA    R    33_B      R    33_B    13.880     0    0.558   0.836    22.818    0.000    0.000
LGA    L    34_B      L    34_B    10.951     0    0.618   0.627    12.244    0.000    0.000
LGA    A    35_B      A    35_B    13.784     0    0.179   0.196    18.148    0.000    0.000
LGA    N    36_B      N    36_B    20.458     3    0.172   0.181    21.810    0.000    0.000
LGA    P    37_B      P    37_B    24.064     0    0.323   0.553    27.224    0.000    0.000
LGA    E    38_B      E    38_B    28.541     4    0.028   0.027    30.043    0.000    0.000
LGA    D    39_B      D    39_B    25.683     0    0.042   0.450    27.429    0.000    0.000
LGA    P    40_B      P    40_B    23.024     0    0.464   0.678    26.087    0.000    0.000
LGA    E    41_B      E    41_B    22.983     0    0.025   1.119    24.435    0.000    0.000
LGA    A    42_B      A    42_B    21.800     0    0.327   0.321    21.806    0.000    0.000
LGA    D    43_B      D    43_B    19.975     0    0.378   0.825    22.539    0.000    0.000
LGA    L    44_B      L    44_B    19.332     0    0.040   0.088    20.406    0.000    0.000
LGA    S    45_B      S    45_B    21.490     0    0.049   0.170    22.297    0.000    0.000
LGA    D    46_B      D    46_B    20.504     0    0.030   0.426    22.281    0.000    0.000
LGA    E    47_B      E    47_B    19.793     0    0.016   0.819    23.050    0.000    0.000
LGA    Q    48_B      Q    48_B    18.167     0    0.012   0.171    20.864    0.000    0.000
LGA    L    49_B      L    49_B    16.458     0    0.010   0.109    18.671    0.000    0.000
LGA    E    50_B      E    50_B    15.763     4    0.036   0.039    16.582    0.000    0.000
LGA    R    51_B      R    51_B    15.271     0    0.016   1.212    21.789    0.000    0.000
LGA    A    52_B      A    52_B    13.165     0    0.007   0.029    14.098    0.000    0.000
LGA    L    53_B      L    53_B    11.911     0    0.022   1.249    12.715    0.000    0.000
LGA    A    54_B      A    54_B    11.570     0    0.038   0.039    12.500    0.000    0.000
LGA    A    55_B      A    55_B    10.640     0    0.025   0.030    11.179    0.833    0.667
LGA    Y    56_B      Y    56_B     8.420     0    0.028   0.143     9.405    6.667   10.516
LGA    L    57_B      L    57_B     7.359     0    0.027   1.295     9.292   11.310    7.679
LGA    T    58_B      T    58_B     7.597     0    0.016   0.139     9.001   11.190    7.415
LGA    L    59_B      L    59_B     6.607     0    0.023   1.060     8.461   20.238   15.714
LGA    V    60_B      V    60_B     4.061     0    0.076   1.181     5.374   39.167   36.735
LGA    E    61_B      E    61_B     3.493     0    0.031   0.490     3.991   46.667   50.212
LGA    T    62_B      T    62_B     4.934     0    0.010   0.245     6.561   31.429   25.986
LGA    L    63_B      L    63_B     4.279     0    0.063   0.379     5.787   42.143   35.595
LGA    F    64_B      F    64_B     2.004     0    0.077   0.134     3.143   69.048   65.065
LGA    P    65_B      P    65_B     1.622     0    0.054   0.066     2.482   77.143   71.837
LGA    E    66_B      E    66_B     1.351     0    0.048   0.978     5.199   85.952   66.931
LGA    L    67_B      L    67_B     0.720     0    0.025   0.191     1.922   90.476   84.940
LGA    Y    68_B      Y    68_B     0.869     0    0.070   0.112     2.445   90.476   77.460
LGA    A    69_B      A    69_B     0.271     0    0.038   0.047     0.624   95.238   96.190
LGA    E    70_B      E    70_B     1.020     0    0.040   0.609     1.534   83.690   84.497
LGA    M    71_B      M    71_B     1.447     0    0.083   0.805     3.892   81.429   73.452
LGA    K    72_B      K    72_B     1.108     0    0.038   0.352     1.673   81.429   81.534
LGA    A    73_B      A    73_B     1.172     0    0.062   0.070     1.188   81.429   81.429
LGA    A    74_B      A    74_B     1.412     0    0.019   0.023     1.535   81.429   79.714
LGA    L    75_B      L    75_B     1.313     0    0.022   0.363     1.660   81.429   80.357
LGA    A    76_B      A    76_B     1.153     0    0.023   0.026     1.197   81.429   81.429
LGA    A    77_B      A    77_B     1.101     0    0.033   0.039     1.177   83.690   83.238
LGA    A    78_B      A    78_B     1.067     0    0.086   0.122     1.300   83.690   83.238
LGA    K    79_B      K    79_B     0.468     0    0.029   1.033     3.195   95.238   78.889
LGA    T    80_B      T    80_B     0.300     0    0.043   0.899     2.681   95.238   87.143
LGA    P    81_B      P    81_B     1.751     0    0.026   0.055     2.422   75.000   71.769
LGA    E    82_B      E    82_B     1.762     4    0.011   0.015     2.077   77.143   41.481
LGA    E    83_B      E    83_B     0.741     4    0.009   0.014     1.028   92.976   51.376
LGA    K    84_B      K    84_B     0.688     0    0.014   0.462     3.263   90.476   80.159
LGA    I    85_B      I    85_B     1.328     0    0.040   1.069     3.105   83.690   73.393
LGA    A    86_B      A    86_B     1.010     0    0.014   0.016     1.338   88.214   86.857
LGA    V    87_B      V    87_B     0.596     0    0.014   0.137     1.107   92.857   89.252
LGA    F    88_B      F    88_B     0.947     0    0.013   0.269     2.934   90.476   74.286
LGA    R    89_B      R    89_B     0.845     0    0.013   0.901     4.154   90.476   75.368
LGA    E    90_B      E    90_B     0.601     0    0.009   0.145     1.706   92.857   83.704
LGA    Y    91_B      Y    91_B     1.167     0    0.142   1.389    11.435   88.214   43.413
LGA    N    92_B      N    92_B     1.003     0    0.016   1.037     2.857   88.214   79.702
LGA    A    93_B      A    93_B     0.696     0    0.047   0.051     0.923   92.857   92.381
LGA    R    94_B      R    94_B     0.207     0    0.040   1.292     3.184  100.000   84.892
LGA    F    95_B      F    95_B     0.506     0    0.050   1.226     6.968   97.619   61.645
LGA    L    96_B      L    96_B     0.360     0    0.025   0.411     1.825  100.000   94.226
LGA    A    97_B      A    97_B     0.264     0    0.023   0.031     0.328  100.000  100.000
LGA    E    98_B      E    98_B     0.457     0    0.021   0.251     1.135   95.238   92.646
LGA    F    99_B      F    99_B     0.886     0    0.089   0.177     1.814   88.214   82.381
LGA    D   100_B      D   100_B     0.940     0    0.010   0.329     2.254   90.476   81.726
LGA    A   101_B      A   101_B     0.735     0    0.069   0.074     0.852   90.476   90.476
LGA    L   102_B      L   102_B     0.626     0    0.051   0.802     3.131   92.857   79.226
LGA    I   103_B      I   103_B     0.750     0    0.058   1.610     3.830   90.476   77.262
LGA    D   104_B      D   104_B     0.888     0    0.094   0.356     2.705   90.476   79.881
LGA    Q   105_B      Q   105_B     0.951     0    0.047   1.256     4.556   85.952   77.249
LGA    A   106_B      A   106_B     1.368     0    0.040   0.046     1.861   77.143   78.000
LGA    F   107_B      F   107_B     1.366     0    0.031   0.705     4.398   79.286   68.745
LGA    A   108_B      A   108_B     1.584     0    0.057   0.065     2.331   72.976   72.952
LGA    R   109_B      R   109_B     2.281     0    0.033   1.083     5.266   64.881   56.147
LGA    L   110_B      L   110_B     2.422     3    0.166   0.172     3.270   59.167   37.679
LGA    K   111_B      K   111_B     2.079     2    0.092   0.498     4.719   66.786   44.339
LGA    A   112_B      A   112_B     2.604     0    0.617   0.586     4.321   57.619   53.524
LGA    D   113_B      D   113_B     4.571     0    0.136   0.449     6.485   28.333   26.786
LGA    S   114_B      S   114_B     7.013     0    0.675   0.912     9.459    9.405    9.286
LGA    L   115_B      L   115_B     8.757     0    0.091   0.489    10.755    2.500    9.524
LGA    T   116_B      T   116_B    13.676     0    0.036   0.049    17.070    0.000    0.000
LGA    L   117_B      L   117_B    15.741     0    0.128   1.358    18.250    0.000    0.000
LGA    K   118_B      K   118_B    21.281     0    0.022   0.331    23.370    0.000    0.000
LGA    I   119_B      I   119_B    23.897     0    0.023   0.567    26.903    0.000    0.000
LGA    H   120_B      H   120_B    30.111     0    0.097   0.121    31.375    0.000    0.000
LGA    L   121_B      L   121_B    32.449     0    0.031   0.301    35.843    0.000    0.000
LGA    S   122_B      S   122_B    38.442     0    0.080   0.586    41.500    0.000    0.000
LGA    Q   123_B      Q   123_B    41.603     4    0.074   0.070    43.449    0.000    0.000
LGA    G   124_B      G   124_B    38.761     0    0.595   0.595    39.850    0.000    0.000
LGA    K   125_B      K   125_B    36.073     4    0.192   0.259    37.747    0.000    0.000
LGA    G   126_B      G   126_B    32.891     0    0.391   0.391    33.920    0.000    0.000
LGA    S   127_B      S   127_B    29.316     0    0.087   0.124    30.479    0.000    0.000
LGA    Y   128_B      Y   128_B    23.692     0    0.108   1.118    25.888    0.000    0.000
LGA    E   129_B      E   129_B    21.574     0    0.113   0.337    25.404    0.000    0.000
LGA    I   130_B      I   130_B    16.422     0    0.076   0.169    18.443    0.000    0.000
LGA    I   131_B      I   131_B    15.295     0    0.039   0.625    18.730    0.000    0.000
LGA    F   132_B      F   132_B    11.593     0    0.047   0.224    14.446    0.000    0.000
LGA    P   133_B      P   133_B     8.728     0    0.092   0.193     9.472    2.143    6.259
LGA    P   134_B      P   134_B     8.963     0    0.028   0.050     9.394    2.976    3.469
LGA    E   135_B      E   135_B     6.979     4    0.027   0.032     8.205    8.810    6.296
LGA    V   136_B      V   136_B     8.842     0    0.123   0.286    10.746    1.905    3.469
LGA    Q   137_B      Q   137_B    12.256     4    0.027   0.044    13.940    0.000    0.000
LGA    A   138_B      A   138_B    12.479     0    0.097   0.101    13.771    0.000    0.000
LGA    D   139_B      D   139_B    12.592     0    0.048   0.239    13.267    0.000    0.000
LGA    P   140_B      P   140_B    15.162     0    0.057   0.189    16.306    0.000    0.000
LGA    E   141_B      E   141_B    15.175     0    0.033   0.701    18.270    0.000    0.000
LGA    R   142_B      R   142_B    11.701     0    0.055   0.714    12.852    0.000    4.892
LGA    A   143_B      A   143_B    12.841     0    0.013   0.029    13.875    0.000    0.000
LGA    A   144_B      A   144_B    15.907     0    0.013   0.021    17.062    0.000    0.000
LGA    A   145_B      A   145_B    13.723     0    0.014   0.019    14.320    0.000    0.000
LGA    I   146_B      I   146_B    11.590     0    0.010   0.348    12.815    0.000    0.179
LGA    E   147_B      E   147_B    15.235     0    0.018   0.710    17.411    0.000    0.000
LGA    A   148_B      A   148_B    16.164     0    0.034   0.046    16.518    0.000    0.000
LGA    L   149_B      L   149_B    12.969     0    0.064   1.353    13.922    0.000    0.238
LGA    W   150_B      W   150_B    13.348     0    0.028   1.097    15.032    0.000    0.340
LGA    K   151_B      K   151_B    17.472     4    0.061   0.063    18.810    0.000    0.000
LGA    P   152_B      P   152_B    16.384     0    0.077   0.219    16.586    0.000    0.000
LGA    T   153_B      T   153_B    13.628     0    0.064   1.160    14.989    0.000    0.000
LGA    L   154_B      L   154_B    17.177     0    0.021   0.417    18.649    0.000    0.000
LGA    D   155_B      D   155_B    18.870     0    0.018   0.086    20.094    0.000    0.000
LGA    Q   156_B      Q   156_B    16.418     0    0.012   1.120    17.092    0.000    0.000
LGA    L   157_B      L   157_B    17.182     0    0.013   1.416    19.161    0.000    0.000
LGA    L   158_B      L   158_B    21.057     0    0.016   0.923    25.331    0.000    0.000
LGA    A   159_B      A   159_B    20.213     0    0.019   0.026    20.287    0.000    0.000
LGA    V   160_B      V   160_B    18.381     0    0.014   0.197    19.862    0.000    0.000
LGA    L   161_B      L   161_B    21.350     0    0.018   0.223    22.993    0.000    0.000
LGA    Q   162_B      Q   162_B    23.454     0    0.012   0.717    24.314    0.000    0.000
LGA    E   163_B      E   163_B    21.714     3    0.057   0.191    22.129    0.000    0.000
LGA    K   164_B      K   164_B    22.162     4    0.091   0.113    23.781    0.000    0.000
LGA    H   165_B      H   165_B    25.642     0    0.452   0.935    28.506    0.000    0.000
LGA    K   166_B      K   166_B    25.794     2    0.573   0.743    26.583    0.000    0.000
LGA    G   167_B      G   167_B    29.938     0    0.174   0.174    30.489    0.000    0.000
LGA    K   168_B      K   168_B    30.393     0    0.035   0.632    30.682    0.000    0.000
LGA    P   169_B      P   169_B    31.593     0    0.091   0.152    32.469    0.000    0.000
LGA    A   170_B      A   170_B    29.965     0    0.563   0.518    30.771    0.000    0.000
LGA    T   171_B      T   171_B    29.246     0    0.058   0.851    31.664    0.000    0.000
LGA    T   172_B      T   172_B    29.542     0    0.307   0.802    33.553    0.000    0.000
LGA    V   173_B      V   173_B    26.040     0    0.067   0.273    27.204    0.000    0.000
LGA    T   174_B      T   174_B    28.212     0    0.051   0.141    31.262    0.000    0.000
LGA    Y   175_B      Y   175_B    26.632     0    0.183   0.268    29.042    0.000    0.000
LGA    E   176_B      E   176_B    29.682     0    0.041   0.970    35.449    0.000    0.000
LGA    I   177_B      I   177_B    28.515     0    0.076   0.190    31.224    0.000    0.000
LGA    S   178_B      S   178_B    31.674     0    0.052   0.128    33.580    0.000    0.000
LGA    A   179_B      A   179_B    29.880     0    0.070   0.088    31.470    0.000    0.000
LGA    E   180_B      E   180_B    30.803     0    0.023   1.167    37.060    0.000    0.000
LGA    T   181_B      T   181_B    26.107     0    0.042   1.168    28.170    0.000    0.000
LGA    L   182_B      L   182_B    21.462     0    0.062   1.189    23.678    0.000    0.000
LGA    R   183_B      R   183_B    22.721     0    0.018   1.211    33.298    0.000    0.000
LGA    A   184_B      A   184_B    22.929     0    0.023   0.031    24.323    0.000    0.000
LGA    A   185_B      A   185_B    16.284     0    0.255   0.259    18.899    0.000    0.000
LGA    V   186_B      V   186_B    14.768     0    0.043   0.072    16.040    0.000    0.000
LGA    A   187_B      A   187_B    19.899     0    0.091   0.093    22.438    0.000    0.000
LGA    A   188_B      A   188_B    17.241     0    0.646   0.633    18.322    0.000    0.000
LGA    L   189_B      L   189_B    12.212     0    0.039   0.294    13.845    0.000    4.107
LGA    A   190_B      A   190_B    15.900     0    0.030   0.034    18.814    0.000    0.000
LGA    R   191_B      R   191_B    21.287     0    0.062   0.870    28.620    0.000    0.000
LGA    A   192_B      A   192_B    18.204     0    0.043   0.042    19.580    0.000    0.000
LGA    A   193_B      A   193_B    17.519     0    0.014   0.024    21.208    0.000    0.000
LGA    E   194_B      E   194_B    23.600     0    0.035   1.005    30.006    0.000    0.000
LGA    A   195_B      A   195_B    26.030     0    0.022   0.022    27.939    0.000    0.000
LGA    A   196_B      A   196_B    24.108     0    0.018   0.039    27.556    0.000    0.000
LGA    L   197_B      L   197_B    27.087     0    0.061   1.105    31.352    0.000    0.000
LGA    R   198_B      R   198_B    32.810     0    0.022   1.553    35.847    0.000    0.000
LGA    R   199_B      R   199_B    33.252     0    0.019   0.728    36.002    0.000    0.000
LGA    K   200_B      K   200_B    33.384     0    0.021   0.758    37.512    0.000    0.000
LGA    V   201_B      V   201_B    37.753     0    0.087   1.257    42.153    0.000    0.000
LGA    G   202_B      G   202_B    42.301     0    0.279   0.279    45.741    0.000    0.000
LGA    S   203_B      S   203_B    42.833     1    0.544   0.555    45.595    0.000    0.000
LGA    L   204_B      L   204_B    44.336     3    0.270   0.280    44.784    0.000    0.000
LGA    E   205_B      E   205_B    42.057     4    0.375   0.366    43.261    0.000    0.000
LGA    S   206_B      S   206_B    44.949     1    0.101   0.107    46.434    0.000    0.000
LGA    S   207_B      S   207_B    44.298     0    0.630   0.841    44.298    0.000    0.000
LGA    G   208_B      G   208_B    41.999     0    0.599   0.599    42.688    0.000    0.000
LGA    L   209_B      L   209_B    36.605     3    0.600   0.554    38.125    0.000    0.000
LGA    E   210_B      E   210_B    33.237     4    0.369   0.393    34.918    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):    18.497         18.478                 18.019           21.490   19.244

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  214  207    4.0     54    1.75    26.449    24.005     2.925

LGA_LOCAL      RMSD:   1.746  Number of atoms:   54  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  20.836  Number of assigned atoms:  207 
Std_ASGN_ATOMS RMSD:  18.497  Standard rmsd on all 207 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.470371 * X  +  -0.066614 * Y  +  -0.879951 * Z  + -15.429109
  Y_new =   0.881942 * X  +   0.069935 * Y  +   0.466141 * Z  + -13.443519
  Z_new =   0.030488 * X  +  -0.995325 * Y  +   0.091645 * Z  + -14.918431 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  1.080837 -0.030493 -1.478980   [DEG:   61.9274   -1.7471  -84.7393 ]
ZXZ: -2.057949  1.479023  3.110971   [DEG: -117.9118   84.7418  178.2455 ]
 
# END of job
