
#######################################################
#                                                     #
#                        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:    51      58_B - 108_B       4.87    23.10
  LONGEST_CONTINUOUS_SEGMENT:    51      59_B - 109_B       4.88    23.15
  LONGEST_CONTINUOUS_SEGMENT:    51      60_B - 110_B       4.91    23.25
  LONGEST_CONTINUOUS_SEGMENT:    51      61_B - 111_B       4.96    23.28
  LCS_AVERAGE:     17.40

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    29     177_B - 205_B       1.72    30.99
  LONGEST_CONTINUOUS_SEGMENT:    29     178_B - 206_B       1.68    31.37
  LCS_AVERAGE:      7.85

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    28     178_B - 205_B       0.98    31.10
  LCS_AVERAGE:      5.79

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    6   16      0    3    4    4    6    8    9   12   13   15   17   21   23   26   27   31   34   40   44   47 
LCS_GDT     D     5_B     D     5_B      3    6   16      0    3    4    6    6    8    9   12   13   15   17   21   24   26   31   34   42   49   52   59 
LCS_GDT     F     6_B     F     6_B      3    6   17      3    3    4    6    6    8   10   13   16   22   26   35   37   49   49   55   59   65   68   73 
LCS_GDT     T     7_B     T     7_B      3   12   18      3    3    4    8   10   12   23   25   29   33   38   44   50   55   59   64   67   69   71   73 
LCS_GDT     G     8_B     G     8_B      8   12   19      3    4   11   14   19   23   26   30   37   45   48   51   55   59   62   64   67   69   71   73 
LCS_GDT     A     9_B     A     9_B      8   12   19      6    7    8   11   11   12   17   20   25   31   42   44   55   58   62   64   67   69   71   73 
LCS_GDT     R    10_B     R    10_B      8   12   20      6    7    8   11   11   14   17   29   37   42   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     E    11_B     E    11_B      8   12   20      6    7   11   16   21   23   27   35   40   46   48   51   55   59   62   64   67   69   71   73 
LCS_GDT     R    12_B     R    12_B      8   12   20      6    7    8   11   11   12   23   25   35   42   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     F    13_B     F    13_B      8   12   20      6    7    8   11   11   14   17   22   30   42   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     L    14_B     L    14_B      8   12   20      6    7    8   16   21   24   30   35   40   46   48   51   55   59   62   64   67   69   71   73 
LCS_GDT     A    15_B     A    15_B      8   12   20      4    7    8   11   11   12   14   22   35   40   43   51   55   59   62   64   67   69   71   73 
LCS_GDT     G    16_B     G    16_B      4   12   20      3    3    5   11   11   12   15   20   27   39   42   44   54   59   62   64   67   69   71   73 
LCS_GDT     D    17_B     D    17_B      4   12   20      3    4    7   11   11   12   16   24   30   39   42   44   49   54   58   64   67   69   71   73 
LCS_GDT     V    18_B     V    18_B      3   12   20      3    3    6   11   11   13   17   24   30   39   42   44   49   59   62   64   67   69   71   73 
LCS_GDT     T    19_B     T    19_B      3    4   20      3    3    4    7    8   12   23   25   30   39   42   51   55   59   62   64   67   69   71   73 
LCS_GDT     I    20_B     I    20_B      3    4   20      3    4    4    7   10   18   22   26   35   42   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     V    21_B     V    21_B      3    4   20      3    4    4    6    8   14   17   24   28   39   42   51   55   59   62   64   67   69   71   73 
LCS_GDT     L    22_B     L    22_B      3    4   20      3    4    4    8   11   18   22   30   35   42   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     L    23_B     L    23_B      3    4   20      1    3    7   10   17   18   22   26   32   42   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     I    24_B     I    24_B      3    5   20      0    3    3    3    5    7    8   11   15   20   26   29   34   39   48   52   62   65   67   71 
LCS_GDT     A    25_B     A    25_B      5    9   20      3    4    5    5    8    9   10   11   14   15   19   25   29   36   44   47   52   61   65   68 
LCS_GDT     E    26_B     E    26_B      5    9   20      3    4    5    7    8    9   10   13   14   15   17   20   24   30   35   47   52   61   65   67 
LCS_GDT     S    27_B     S    27_B      6    9   20      3    4    6    7    8    9   11   13   14   15   17   18   21   23   24   30   40   48   53   57 
LCS_GDT     H    28_B     H    28_B      6    9   20      3    4    6    7    8   10   12   14   14   15   18   22   26   29   33   38   46   50   53   56 
LCS_GDT     D    29_B     D    29_B      6    9   20      3    4    6    7    8   10   13   15   15   20   26   29   36   40   45   47   53   56   60   65 
LCS_GDT     A    30_B     A    30_B      6    9   20      3    4    6    7    8   10   13   14   15   17   22   26   36   40   40   44   50   53   57   65 
LCS_GDT     P    31_B     P    31_B      6    9   19      3    4    6    7    8   10   13   16   16   19   24   31   35   40   40   44   47   50   57   62 
LCS_GDT     Y    32_B     Y    32_B      6    9   19      3    4    6    7    8   11   17   19   23   28   30   32   36   40   43   48   54   59   64   66 
LCS_GDT     R    33_B     R    33_B      4    9   19      3    4    5    5    8   10   13   20   23   28   29   33   35   38   43   47   54   59   64   67 
LCS_GDT     L    34_B     L    34_B      5    9   19      4    5    5    7    8   10   13   14   15   17   20   26   30   32   36   43   47   50   55   58 
LCS_GDT     A    35_B     A    35_B      5    9   19      4    5    6    7    8   10   13   14   15   16   18   24   27   29   32   36   40   46   49   52 
LCS_GDT     N    36_B     N    36_B      5    9   25      4    5    6    7    8   10   13   14   15   16   20   26   30   32   34   35   38   42   45   50 
LCS_GDT     P    37_B     P    37_B      5    9   26      4    5    6    7    8   10   13   14   18   20   23   26   30   32   34   35   38   42   45   50 
LCS_GDT     E    38_B     E    38_B      6    9   26      4    6    6    7    8   10   13   14   18   20   23   26   30   32   34   35   38   42   45   46 
LCS_GDT     D    39_B     D    39_B      6    7   26      3    6    6    8   10   12   16   17   18   20   23   26   30   32   34   35   38   42   45   46 
LCS_GDT     P    40_B     P    40_B      6    7   26      4    6    6    6    7   12   16   17   18   20   23   26   30   32   34   35   38   42   45   46 
LCS_GDT     E    41_B     E    41_B      6   14   26      4    6    6    6    6   12   14   15   18   19   21   26   30   32   34   35   38   42   45   46 
LCS_GDT     A    42_B     A    42_B     12   14   26      4    6    6   12   13   13   14   15   17   20   22   26   30   32   34   35   38   42   45   46 
LCS_GDT     D    43_B     D    43_B     12   14   26      4   11   11   12   13   13   15   17   18   20   23   26   30   32   34   35   38   42   45   46 
LCS_GDT     L    44_B     L    44_B     12   14   26      5   11   11   12   13   13   16   17   18   20   23   26   30   32   34   35   38   42   45   46 
LCS_GDT     S    45_B     S    45_B     12   14   26      9   11   11   12   13   13   16   17   18   20   23   26   28   31   34   35   38   41   45   46 
LCS_GDT     D    46_B     D    46_B     12   14   26      9   11   11   12   13   13   16   17   18   20   23   26   28   31   32   35   38   41   45   46 
LCS_GDT     E    47_B     E    47_B     12   14   26      9   11   11   12   13   13   16   17   18   20   23   25   28   31   32   35   38   42   45   50 
LCS_GDT     Q    48_B     Q    48_B     12   14   26      9   11   11   12   13   13   16   17   18   20   23   26   28   32   34   35   38   42   45   50 
LCS_GDT     L    49_B     L    49_B     12   14   26      9   11   11   12   13   13   16   17   18   20   23   26   30   32   34   35   38   42   45   50 
LCS_GDT     E    50_B     E    50_B     12   14   26      9   11   11   12   13   13   16   17   18   20   23   26   30   32   34   39   41   46   50   55 
LCS_GDT     R    51_B     R    51_B     12   14   26      9   11   11   12   13   13   16   17   18   20   23   26   30   32   34   39   43   46   50   55 
LCS_GDT     A    52_B     A    52_B     12   14   26      9   11   11   12   13   13   14   17   18   20   23   26   30   32   34   36   43   46   50   55 
LCS_GDT     L    53_B     L    53_B     12   14   26      9   11   11   12   13   13   16   17   18   20   23   26   30   32   36   39   47   50   53   55 
LCS_GDT     A    54_B     A    54_B     11   14   26      3    5    7   10   13   13   16   17   20   28   29   33   35   38   40   43   47   51   57   65 
LCS_GDT     A    55_B     A    55_B      8    9   26      5    8    8    9   10   11   15   20   23   28   29   33   36   40   42   47   56   64   67   70 
LCS_GDT     Y    56_B     Y    56_B      8    9   26      5    8    8    9   10   11   15   20   23   28   29   33   35   38   41   43   48   50   59   62 
LCS_GDT     L    57_B     L    57_B      8    9   49      6    8    8    9   10   13   17   20   23   28   30   33   36   40   44   47   52   58   65   67 
LCS_GDT     T    58_B     T    58_B      8    9   51      6    8    8    9   10   13   17   20   23   28   31   39   44   58   61   64   67   69   71   73 
LCS_GDT     L    59_B     L    59_B      8    9   51      6    8    8    9   10   11   17   20   23   28   31   35   43   55   61   64   67   69   71   73 
LCS_GDT     V    60_B     V    60_B      8    9   51      6    8    8    9   10   13   17   20   23   28   31   35   39   48   54   59   67   68   69   72 
LCS_GDT     E    61_B     E    61_B      8    9   51      6    8    8    9   10   12   19   22   27   34   38   45   53   59   62   64   67   69   71   73 
LCS_GDT     T    62_B     T    62_B      8    9   51      6    8    8   11   17   20   26   32   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     L    63_B     L    63_B      4   18   51      3    4    4    6   10   14   25   33   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     F    64_B     F    64_B     16   19   51     13   15   17   18   21   26   31   36   40   43   47   49   54   59   62   64   67   69   71   73 
LCS_GDT     P    65_B     P    65_B     16   19   51     13   15   17   27   28   28   31   36   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     E    66_B     E    66_B     16   19   51     13   15   17   21   28   29   31   36   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     L    67_B     L    67_B     16   19   51     13   15   17   18   25   29   31   36   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     Y    68_B     Y    68_B     16   19   51     13   15   17   18   28   29   31   36   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     A    69_B     A    69_B     16   19   51     13   15   17   18   22   26   31   36   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     E    70_B     E    70_B     16   19   51     13   15   17   18   22   26   31   36   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     M    71_B     M    71_B     16   19   51     13   15   17   18   22   26   31   36   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     K    72_B     K    72_B     16   19   51     13   15   17   18   22   26   31   36   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     A    73_B     A    73_B     16   19   51     13   15   17   18   22   26   31   36   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     A    74_B     A    74_B     16   19   51     13   15   17   18   22   26   31   36   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     L    75_B     L    75_B     16   19   51     13   15   17   18   22   26   31   36   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     A    76_B     A    76_B     16   19   51     13   15   17   18   22   26   31   36   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     A    77_B     A    77_B     16   19   51     10   15   17   18   22   26   31   36   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     A    78_B     A    78_B     16   19   51     10   15   17   18   22   26   31   35   40   44   47   50   55   58   62   64   67   69   71   73 
LCS_GDT     K    79_B     K    79_B     16   19   51      6   10   17   18   22   26   31   32   37   41   45   49   53   56   60   64   67   69   71   73 
LCS_GDT     T    80_B     T    80_B      3   19   51      3    6    9   18   22   26   31   36   40   44   47   49   54   58   61   64   67   69   71   73 
LCS_GDT     P    81_B     P    81_B      3   19   51      3    3    3   10   12   15   21   27   32   36   44   49   53   56   57   59   63   66   68   73 
LCS_GDT     E    82_B     E    82_B      3   19   51      3    5   10   18   22   26   31   36   40   44   47   49   53   56   60   64   67   69   71   73 
LCS_GDT     E    83_B     E    83_B     15   17   51     10   14   15   16   21   26   31   36   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     K    84_B     K    84_B     15   17   51     10   14   15   16   21   25   31   36   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     I    85_B     I    85_B     15   17   51     10   14   15   16   21   26   31   36   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     A    86_B     A    86_B     15   17   51     10   14   15   16   22   26   31   36   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     V    87_B     V    87_B     15   17   51     10   14   15   16   21   26   31   36   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     F    88_B     F    88_B     15   17   51     10   14   15   16   22   26   31   36   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     R    89_B     R    89_B     15   17   51     10   14   15   18   22   26   31   36   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     E    90_B     E    90_B     15   17   51     10   14   15   16   22   26   31   36   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     Y    91_B     Y    91_B     15   17   51     10   14   15   16   22   26   31   36   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     N    92_B     N    92_B     15   17   51     10   14   15   18   22   26   31   36   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     A    93_B     A    93_B     15   17   51      7   14   15   16   22   26   31   36   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     R    94_B     R    94_B     15   17   51      7   14   15   16   21   26   31   36   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     F    95_B     F    95_B     15   17   51      7   14   15   16   21   26   31   36   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     L    96_B     L    96_B     15   17   51      8   14   15   16   21   26   31   36   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     A    97_B     A    97_B     15   17   51      3   11   15   16   21   26   31   36   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     E    98_B     E    98_B      9   17   51      3    3   11   16   21   26   31   36   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     F    99_B     F    99_B     10   14   51      5    7   16   19   30   35   39   41   43   46   48   51   55   59   62   64   67   69   71   73 
LCS_GDT     D   100_B     D   100_B     10   14   51      5    7   16   19   30   35   39   41   43   46   48   51   55   59   62   64   67   69   71   73 
LCS_GDT     A   101_B     A   101_B     11   14   51      5    7   16   18   30   35   39   41   43   46   48   51   55   59   62   64   67   69   71   73 
LCS_GDT     L   102_B     L   102_B     11   14   51      6   10   16   18   30   35   39   41   43   46   48   51   55   59   62   64   67   69   71   73 
LCS_GDT     I   103_B     I   103_B     11   14   51      6   10   14   18   26   34   39   41   43   46   48   51   55   59   62   64   67   69   71   73 
LCS_GDT     D   104_B     D   104_B     11   14   51      7   10   16   18   27   35   39   41   43   46   48   51   55   59   62   64   67   69   71   73 
LCS_GDT     Q   105_B     Q   105_B     11   14   51      7   10   16   19   30   35   39   41   43   46   48   50   54   58   62   64   67   69   71   73 
LCS_GDT     A   106_B     A   106_B     11   14   51      7   10   16   18   30   35   39   41   43   46   48   50   53   56   57   62   66   69   71   73 
LCS_GDT     F   107_B     F   107_B     11   14   51      7   10   16   18   29   35   39   41   43   46   48   50   52   56   57   60   65   68   71   73 
LCS_GDT     A   108_B     A   108_B     11   14   51      7   10   16   19   30   35   39   41   43   46   48   50   52   55   57   59   61   66   71   71 
LCS_GDT     R   109_B     R   109_B     11   14   51      7   10   16   19   30   35   39   41   43   46   48   50   52   54   56   59   61   64   68   70 
LCS_GDT     L   110_B     L   110_B     11   14   51      7   10   16   18   30   35   39   41   43   46   48   50   52   54   54   56   60   64   68   70 
LCS_GDT     K   111_B     K   111_B     11   14   51      4    8   10   17   30   35   39   41   43   46   48   50   52   54   54   56   60   64   68   70 
LCS_GDT     A   112_B     A   112_B      3   14   50      3    3    5    9   13   18   24   34   39   46   48   50   52   54   56   59   61   64   68   70 
LCS_GDT     D   113_B     D   113_B      3    4   25      3    3    4    4    4    5    8   10   16   22   26   28   33   37   52   52   58   64   68   70 
LCS_GDT     S   114_B     S   114_B      5    9   25      3    4    6    7   12   13   15   17   20   24   28   31   33   48   52   52   59   64   68   70 
LCS_GDT     L   115_B     L   115_B      5    9   25      3    4    7   10   13   15   17   21   27   46   48   49   52   54   54   59   61   64   68   70 
LCS_GDT     T   116_B     T   116_B      7    9   25      3    5    7   10   13   14   15   17   18   19   25   36   49   54   57   59   61   66   71   73 
LCS_GDT     L   117_B     L   117_B      7    9   25      3    5    7   10   13   14   15   17   18   19   31   43   47   51   54   57   60   64   68   72 
LCS_GDT     K   118_B     K   118_B      7    9   25      3    5    7   10   13   14   15   17   18   19   21   23   44   49   52   59   63   65   70   72 
LCS_GDT     I   119_B     I   119_B      7    9   25      3    5    7   10   13   14   15   17   18   19   21   23   26   30   32   37   53   58   65   71 
LCS_GDT     H   120_B     H   120_B      7    9   25      3    5    8   10   13   14   15   17   18   19   21   23   26   30   32   35   37   41   45   46 
LCS_GDT     L   121_B     L   121_B      7    9   25      3    5    7   10   13   14   15   17   18   19   21   23   25   30   32   35   37   41   45   46 
LCS_GDT     S   122_B     S   122_B      7    9   25      3    5    7   10   13   14   15   17   18   19   21   23   24   27   32   33   37   41   45   46 
LCS_GDT     Q   123_B     Q   123_B      3    7   25      3    3    4    5    7   12   15   16   17   19   21   23   24   25   30   33   37   41   45   46 
LCS_GDT     G   124_B     G   124_B      3    7   25      3    3    4    5    6    7    8    9    9   13   17   18   22   25   27   33   37   41   45   46 
LCS_GDT     K   125_B     K   125_B      3   10   25      3    3    4    9   12   13   15   16   17   19   21   23   26   29   32   33   37   41   45   46 
LCS_GDT     G   126_B     G   126_B      5   11   25      3    5    8   10   13   14   15   17   18   19   21   23   26   30   32   35   37   41   45   46 
LCS_GDT     S   127_B     S   127_B      5   11   25      3    5    8   10   13   14   15   17   18   19   21   23   26   29   32   37   47   53   59   64 
LCS_GDT     Y   128_B     Y   128_B      6   11   25      3    5    8   10   13   14   15   17   18   19   21   23   26   33   43   51   54   58   63   67 
LCS_GDT     E   129_B     E   129_B      6   11   25      3    5    8   10   13   14   15   17   18   19   30   43   47   50   52   56   60   63   67   70 
LCS_GDT     I   130_B     I   130_B      6   11   37      4    5    8   10   13   14   15   17   18   19   21   23   26   46   50   55   58   61   64   67 
LCS_GDT     I   131_B     I   131_B      6   11   38      4    5    8   10   12   13   15   17   21   23   30   36   40   42   43   48   56   59   61   65 
LCS_GDT     F   132_B     F   132_B      6   11   38      4    5    8   10   19   20   26   31   34   38   47   49   52   54   54   56   57   59   60   70 
LCS_GDT     P   133_B     P   133_B      6   11   38      4    5    7   10   19   33   39   41   43   46   48   50   52   54   54   56   57   59   60   70 
LCS_GDT     P   134_B     P   134_B      5   11   38      3    4    6    9   12   13   15   39   43   45   48   49   52   54   54   56   57   59   60   63 
LCS_GDT     E   135_B     E   135_B      4   11   38      3    3    5    5   12   12   20   33   43   45   47   49   51   54   54   56   57   59   60   63 
LCS_GDT     V   136_B     V   136_B      6   22   38      2    8   14   19   30   35   39   41   43   46   48   50   52   54   54   56   57   59   60   70 
LCS_GDT     Q   137_B     Q   137_B      8   22   38      3    5   16   18   29   34   37   40   43   46   48   50   52   54   54   56   57   59   61   70 
LCS_GDT     A   138_B     A   138_B      9   22   38      3    5   13   18   20   34   37   39   43   46   48   50   52   54   54   56   57   59   61   70 
LCS_GDT     D   139_B     D   139_B     11   23   38      6   10   16   19   30   35   39   41   43   46   48   50   52   54   54   56   57   59   60   70 
LCS_GDT     P   140_B     P   140_B     11   23   38      6    8   16   19   30   35   39   41   43   46   48   50   52   54   54   56   57   59   60   70 
LCS_GDT     E   141_B     E   141_B     11   24   38      6    8   16   19   30   35   39   41   43   46   48   50   52   54   54   56   57   59   60   70 
LCS_GDT     R   142_B     R   142_B     11   24   38      6    8   16   19   30   35   39   41   43   46   48   50   52   54   54   56   57   59   60   70 
LCS_GDT     A   143_B     A   143_B     11   24   38      6    8   14   19   30   35   39   41   43   46   48   50   52   54   54   56   57   59   60   70 
LCS_GDT     A   144_B     A   144_B     11   24   38      6    8   14   19   30   35   39   41   43   46   48   50   52   54   54   56   57   59   60   70 
LCS_GDT     A   145_B     A   145_B     11   24   38      6    8   14   19   30   35   39   41   43   46   48   50   52   54   54   56   57   59   60   70 
LCS_GDT     I   146_B     I   146_B     11   24   38      6    8   14   19   30   35   39   41   43   46   48   50   52   54   54   56   57   59   60   70 
LCS_GDT     E   147_B     E   147_B     11   24   38      5    8   14   19   27   35   39   41   43   46   48   50   52   54   54   56   57   59   60   70 
LCS_GDT     A   148_B     A   148_B     15   24   38      5    9   17   19   30   35   39   41   43   46   48   50   52   54   54   56   57   59   60   64 
LCS_GDT     L   149_B     L   149_B     15   24   38      5    8   14   19   30   35   39   41   43   46   48   50   52   54   54   56   57   59   60   70 
LCS_GDT     W   150_B     W   150_B     17   24   38      6   16   17   19   25   33   38   41   43   46   48   50   52   54   54   56   57   59   60   70 
LCS_GDT     K   151_B     K   151_B     17   24   38      9   16   17   19   30   35   39   41   43   46   48   50   52   54   54   56   57   59   60   63 
LCS_GDT     P   152_B     P   152_B     17   24   38      6   16   17   19   30   35   39   41   43   46   48   50   52   54   54   56   57   59   60   63 
LCS_GDT     T   153_B     T   153_B     17   24   38      9   16   17   19   29   34   37   41   43   46   48   50   52   54   54   56   57   59   60   64 
LCS_GDT     L   154_B     L   154_B     17   24   38     10   16   17   19   29   35   39   41   43   46   48   50   52   54   54   56   57   59   60   63 
LCS_GDT     D   155_B     D   155_B     17   24   38     10   16   17   19   30   35   39   41   43   46   48   50   52   54   54   56   57   59   60   63 
LCS_GDT     Q   156_B     Q   156_B     17   24   38     10   16   17   19   30   34   39   41   43   46   48   50   52   54   54   56   57   59   60   63 
LCS_GDT     L   157_B     L   157_B     17   24   38     10   16   17   19   30   35   39   41   43   46   48   50   52   54   54   56   57   59   60   63 
LCS_GDT     L   158_B     L   158_B     17   24   38     10   16   17   19   30   35   39   41   43   46   48   50   52   54   54   56   57   59   60   63 
LCS_GDT     A   159_B     A   159_B     17   24   38     10   16   17   19   30   35   39   41   43   46   48   50   52   54   54   56   57   59   60   63 
LCS_GDT     V   160_B     V   160_B     17   24   38     10   16   17   19   30   35   39   41   43   46   48   50   52   54   54   56   57   59   60   63 
LCS_GDT     L   161_B     L   161_B     17   24   38     10   16   17   19   30   35   39   41   43   46   48   50   52   54   54   56   57   59   60   63 
LCS_GDT     Q   162_B     Q   162_B     17   24   38     10   16   17   19   28   33   39   41   43   45   48   50   52   54   54   56   57   59   60   63 
LCS_GDT     E   163_B     E   163_B     17   24   38     10   16   17   19   28   35   39   41   43   46   48   50   52   54   54   56   57   59   60   63 
LCS_GDT     K   164_B     K   164_B     17   24   38     10   16   17   19   28   35   39   41   43   46   48   50   52   54   54   56   57   59   60   63 
LCS_GDT     H   165_B     H   165_B     17   24   38     10   16   17   19   21   25   33   40   43   45   48   50   52   54   54   56   57   59   60   63 
LCS_GDT     K   166_B     K   166_B     17   24   38      6   12   17   19   21   24   30   39   43   45   48   50   52   54   54   56   57   59   60   63 
LCS_GDT     G   167_B     G   167_B      4   23   38      3    4    6   12   19   21   22   23   25   27   29   31   38   49   53   56   57   58   59   62 
LCS_GDT     K   168_B     K   168_B      4    6   38      3    4    4    6    9   13   17   23   25   27   29   31   33   34   36   39   41   47   55   62 
LCS_GDT     P   169_B     P   169_B      4    6   38      4    4    4    5    7    9   12   15   19   23   24   31   33   34   36   39   41   42   54   59 
LCS_GDT     A   170_B     A   170_B      4    6   38      4    4    4    5    6    9   14   18   21   27   29   31   33   34   36   39   44   47   54   62 
LCS_GDT     T   171_B     T   171_B      4    6   38      4    4    4    6    7    9   12   18   19   23   24   30   32   34   42   43   44   47   54   59 
LCS_GDT     T   172_B     T   172_B      4    6   38      4    4    4    6    7    9   14   18   21   25   29   31   34   38   42   43   44   47   54   62 
LCS_GDT     V   173_B     V   173_B      4    6   38      3    3    4    6    7   10   15   18   21   25   29   31   34   38   42   45   55   58   60   63 
LCS_GDT     T   174_B     T   174_B      4    6   38      3    3    4    6    8   13   19   23   25   28   29   31   33   34   36   39   41   44   53   62 
LCS_GDT     Y   175_B     Y   175_B      4    6   38      3    3    5    7    9   13   21   23   25   28   29   31   33   34   36   39   41   42   44   46 
LCS_GDT     E   176_B     E   176_B      4    6   38      3    3    5    5    8   10   12   16   23   28   29   31   36   38   38   40   41   42   44   46 
LCS_GDT     I   177_B     I   177_B      4   29   38      3    3    5    5   10   17   20   27   32   33   34   38   38   40   40   40   41   42   44   46 
LCS_GDT     S   178_B     S   178_B     28   29   36      6   26   26   27   28   29   30   31   32   35   35   38   38   40   40   40   41   42   43   45 
LCS_GDT     A   179_B     A   179_B     28   29   36      8   26   26   27   28   29   30   31   32   35   35   38   38   40   40   40   41   42   43   45 
LCS_GDT     E   180_B     E   180_B     28   29   36     17   26   26   27   28   29   30   31   32   35   35   38   38   40   40   40   41   42   44   46 
LCS_GDT     T   181_B     T   181_B     28   29   36     17   26   26   27   28   29   30   31   32   35   35   38   38   40   40   40   41   42   44   46 
LCS_GDT     L   182_B     L   182_B     28   29   36     17   26   26   27   28   29   30   31   32   35   35   38   38   40   40   40   41   42   44   46 
LCS_GDT     R   183_B     R   183_B     28   29   36     17   26   26   27   28   29   30   31   32   35   35   38   38   40   40   40   41   42   44   46 
LCS_GDT     A   184_B     A   184_B     28   29   36     17   26   26   27   28   29   30   31   32   35   35   38   38   40   40   40   41   42   44   46 
LCS_GDT     A   185_B     A   185_B     28   29   36     17   26   26   27   28   29   30   31   32   35   35   38   38   40   40   40   43   56   61   70 
LCS_GDT     V   186_B     V   186_B     28   29   36     17   26   26   27   28   29   30   31   32   35   35   38   38   40   47   53   60   64   68   70 
LCS_GDT     A   187_B     A   187_B     28   29   36     17   26   26   27   28   29   30   31   32   35   35   38   38   40   40   53   59   64   68   70 
LCS_GDT     A   188_B     A   188_B     28   29   36     17   26   26   27   28   29   30   31   32   35   38   47   51   55   56   59   61   66   71   71 
LCS_GDT     L   189_B     L   189_B     28   29   36     17   26   26   27   28   29   30   31   34   38   44   49   53   56   57   60   65   68   71   73 
LCS_GDT     A   190_B     A   190_B     28   29   36     17   26   26   27   28   29   31   36   40   44   47   51   54   59   62   64   67   69   71   73 
LCS_GDT     R   191_B     R   191_B     28   29   36     17   26   26   27   28   29   31   36   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     A   192_B     A   192_B     28   29   36     17   26   26   27   28   29   31   35   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     A   193_B     A   193_B     28   29   36     17   26   26   27   28   29   30   31   40   44   47   51   55   59   62   64   67   69   71   73 
LCS_GDT     E   194_B     E   194_B     28   29   36     17   26   26   27   28   29   30   31   32   39   42   44   55   59   62   64   67   69   71   72 
LCS_GDT     A   195_B     A   195_B     28   29   36     17   26   26   27   28   29   30   31   32   39   42   44   49   59   62   64   67   69   70   72 
LCS_GDT     A   196_B     A   196_B     28   29   36     17   26   26   27   28   29   30   31   32   35   38   44   49   54   54   56   60   62   67   69 
LCS_GDT     L   197_B     L   197_B     28   29   36     17   26   26   27   28   29   30   31   32   35   35   38   38   40   50   54   57   62   63   66 
LCS_GDT     R   198_B     R   198_B     28   29   36     16   26   26   27   28   29   30   31   32   35   35   38   38   40   41   51   53   58   63   66 
LCS_GDT     R   199_B     R   199_B     28   29   36     12   26   26   27   28   29   30   31   32   35   35   38   38   40   42   51   52   61   63   65 
LCS_GDT     K   200_B     K   200_B     28   29   36     12   26   26   27   28   29   30   31   32   35   35   38   38   40   40   40   41   48   51   55 
LCS_GDT     V   201_B     V   201_B     28   29   36     16   26   26   27   28   29   30   31   32   35   35   38   38   40   40   40   41   42   44   46 
LCS_GDT     G   202_B     G   202_B     28   29   36     16   26   26   27   28   29   30   31   32   35   35   38   38   40   40   40   41   42   44   46 
LCS_GDT     S   203_B     S   203_B     28   29   36      8   26   26   27   28   29   30   31   32   35   35   38   38   40   40   40   41   42   44   46 
LCS_GDT     L   204_B     L   204_B     28   29   36      4    4    5    6   21   29   30   31   31   35   35   38   38   40   40   40   41   42   44   46 
LCS_GDT     E   205_B     E   205_B     28   29   36      4   15   24   27   28   29   30   31   32   35   35   38   38   40   40   40   41   42   44   46 
LCS_GDT     S   206_B     S   206_B      5   29   36      4    4    5    6   10   17   24   29   32   35   35   38   38   40   40   40   41   42   44   46 
LCS_GDT     S   207_B     S   207_B      5    6   36      3    4    5    6    8   12   14   22   30   35   35   38   38   40   40   40   41   42   44   46 
LCS_GDT     G   208_B     G   208_B      3    5   36      3    3    3    6    8   12   14   21   28   35   35   38   38   40   40   40   41   42   44   46 
LCS_GDT     L   209_B     L   209_B      3    5   36      3    3    4    6   10   12   17   22   30   35   35   38   38   40   40   40   41   42   44   46 
LCS_GDT     E   210_B     E   210_B      3    5   36      3    3    3    5   10   17   26   29   30   35   35   38   38   40   40   40   41   42   44   46 
LCS_AVERAGE  LCS_A:  10.34  (   5.79    7.85   17.40 )

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     17     26     26     27     30     35     39     41     43     46     48     51     55     59     62     64     67     69     71     73 
GDT PERCENT_AT   8.21  12.56  12.56  13.04  14.49  16.91  18.84  19.81  20.77  22.22  23.19  24.64  26.57  28.50  29.95  30.92  32.37  33.33  34.30  35.27
GDT RMS_LOCAL    0.30   0.50   0.50   0.63   1.84   2.08   2.23   2.34   2.51   2.99   3.07   3.93   4.24   6.05   4.62   4.79   5.03   5.17   5.44   5.80
GDT RMS_ALL_AT  30.90  30.93  30.93  30.76  25.75  25.73  25.71  25.68  25.63  25.46  25.65  23.24  23.36  23.52  23.45  23.30  23.34  23.29  23.09  22.87

# Checking swapping
#   possible swapping detected:  F     6_B      F     6_B
#   possible swapping detected:  E    11_B      E    11_B
#   possible swapping detected:  F    13_B      F    13_B
#   possible swapping detected:  D    17_B      D    17_B
#   possible swapping detected:  Y    32_B      Y    32_B
#   possible swapping detected:  D    39_B      D    39_B
#   possible swapping detected:  E    47_B      E    47_B
#   possible swapping detected:  F    64_B      F    64_B
#   possible swapping detected:  Y    68_B      Y    68_B
#   possible swapping detected:  E    70_B      E    70_B
#   possible swapping detected:  F    88_B      F    88_B
#   possible swapping detected:  E    90_B      E    90_B
#   possible swapping detected:  E    98_B      E    98_B
#   possible swapping detected:  D   100_B      D   100_B
#   possible swapping detected:  D   104_B      D   104_B
#   possible swapping detected:  F   107_B      F   107_B
#   possible swapping detected:  E   129_B      E   129_B
#   possible swapping detected:  D   139_B      D   139_B
#   possible swapping detected:  E   141_B      E   141_B
#   possible swapping detected:  E   147_B      E   147_B
#   possible swapping detected:  D   155_B      D   155_B

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    P     4_B      P     4_B    19.149     0    0.116   0.138    19.494    0.000    0.000
LGA    D     5_B      D     5_B    17.639     3    0.113   0.136    19.258    0.000    0.000
LGA    F     6_B      F     6_B    14.042     0    0.592   1.433    14.737    0.000    0.000
LGA    T     7_B      T     7_B    11.018     0    0.258   0.302    12.900    0.476    0.272
LGA    G     8_B      G     8_B     7.476     0    0.319   0.319    10.687    4.405    4.405
LGA    A     9_B      A     9_B    13.396     0    0.080   0.096    15.688    0.000    0.000
LGA    R    10_B      R    10_B     9.738     6    0.021   0.022    10.457    3.095    1.255
LGA    E    11_B      E    11_B     5.353     0    0.068   0.946     7.960   14.405   36.190
LGA    R    12_B      R    12_B    12.716     0    0.063   1.052    22.988    0.000    0.000
LGA    F    13_B      F    13_B    13.458     0    0.057   1.442    19.062    0.000    0.000
LGA    L    14_B      L    14_B     7.032     3    0.169   0.175     9.073   10.476    8.512
LGA    A    15_B      A    15_B     8.575     0    0.481   0.498    11.744    2.500    2.095
LGA    G    16_B      G    16_B    14.377     0    0.178   0.178    18.024    0.000    0.000
LGA    D    17_B      D    17_B    18.827     0    0.524   1.111    21.089    0.000    0.000
LGA    V    18_B      V    18_B    18.733     0    0.684   1.046    22.237    0.000    0.000
LGA    T    19_B      T    19_B    20.456     0    0.678   0.548    23.591    0.000    0.000
LGA    I    20_B      I    20_B    20.230     0    0.258   0.912    22.796    0.000    0.000
LGA    V    21_B      V    21_B    20.730     0    0.579   0.729    25.031    0.000    0.000
LGA    L    22_B      L    22_B    23.573     0    0.572   1.137    26.044    0.000    0.000
LGA    L    23_B      L    23_B    25.865     0    0.580   1.286    28.261    0.000    0.000
LGA    I    24_B      I    24_B    30.301     0    0.496   1.221    33.012    0.000    0.000
LGA    A    25_B      A    25_B    34.187     0    0.542   0.566    37.112    0.000    0.000
LGA    E    26_B      E    26_B    38.604     0    0.124   1.215    42.190    0.000    0.000
LGA    S    27_B      S    27_B    40.617     0    0.527   0.626    41.279    0.000    0.000
LGA    H    28_B      H    28_B    41.909     0    0.635   1.138    43.172    0.000    0.000
LGA    D    29_B      D    29_B    42.659     0    0.167   1.074    46.908    0.000    0.000
LGA    A    30_B      A    30_B    39.286     0    0.091   0.121    39.713    0.000    0.000
LGA    P    31_B      P    31_B    38.610     0    0.367   0.536    40.001    0.000    0.000
LGA    Y    32_B      Y    32_B    33.247     0    0.173   1.105    35.058    0.000    0.000
LGA    R    33_B      R    33_B    36.279     0    0.146   0.856    39.265    0.000    0.000
LGA    L    34_B      L    34_B    38.343     0    0.660   1.199    39.997    0.000    0.000
LGA    A    35_B      A    35_B    44.181     0    0.098   0.097    46.673    0.000    0.000
LGA    N    36_B      N    36_B    45.608     3    0.075   0.072    48.190    0.000    0.000
LGA    P    37_B      P    37_B    40.009     0    0.232   0.654    41.394    0.000    0.000
LGA    E    38_B      E    38_B    45.029     4    0.115   0.120    46.791    0.000    0.000
LGA    D    39_B      D    39_B    46.239     0    0.067   0.713    46.974    0.000    0.000
LGA    P    40_B      P    40_B    46.644     0    0.118   0.562    47.311    0.000    0.000
LGA    E    41_B      E    41_B    46.085     0    0.016   0.773    46.612    0.000    0.000
LGA    A    42_B      A    42_B    46.870     0    0.030   0.029    48.036    0.000    0.000
LGA    D    43_B      D    43_B    49.033     0    0.228   1.135    49.954    0.000    0.000
LGA    L    44_B      L    44_B    47.534     0    0.068   0.090    49.904    0.000    0.000
LGA    S    45_B      S    45_B    51.838     0    0.032   0.121    53.061    0.000    0.000
LGA    D    46_B      D    46_B    50.627     0    0.019   1.136    55.226    0.000    0.000
LGA    E    47_B      E    47_B    48.380     0    0.032   0.758    51.096    0.000    0.000
LGA    Q    48_B      Q    48_B    43.484     0    0.019   1.321    46.553    0.000    0.000
LGA    L    49_B      L    49_B    41.272     0    0.030   1.390    43.005    0.000    0.000
LGA    E    50_B      E    50_B    41.218     4    0.033   0.034    43.489    0.000    0.000
LGA    R    51_B      R    51_B    37.085     0    0.033   0.795    45.894    0.000    0.000
LGA    A    52_B      A    52_B    32.636     0    0.075   0.074    34.792    0.000    0.000
LGA    L    53_B      L    53_B    33.079     0    0.637   0.870    36.646    0.000    0.000
LGA    A    54_B      A    54_B    33.681     0    0.110   0.113    33.681    0.000    0.000
LGA    A    55_B      A    55_B    31.244     0    0.542   0.559    32.125    0.000    0.000
LGA    Y    56_B      Y    56_B    30.642     0    0.088   1.055    34.968    0.000    0.000
LGA    L    57_B      L    57_B    29.131     0    0.017   1.336    32.402    0.000    0.000
LGA    T    58_B      T    58_B    23.830     0    0.090   0.181    26.244    0.000    0.000
LGA    L    59_B      L    59_B    21.292     0    0.044   1.002    24.593    0.000    0.000
LGA    V    60_B      V    60_B    20.706     0    0.053   1.201    25.367    0.000    0.000
LGA    E    61_B      E    61_B    18.816     0    0.526   1.197    22.306    0.000    0.000
LGA    T    62_B      T    62_B    12.943     0    0.651   0.759    15.009    0.357    0.204
LGA    L    63_B      L    63_B    10.143     0    0.308   1.188    11.253    0.000    5.119
LGA    F    64_B      F    64_B    14.723     0    0.480   1.044    19.725    0.000    0.000
LGA    P    65_B      P    65_B    15.759     0    0.048   0.094    16.706    0.000    0.000
LGA    E    66_B      E    66_B    15.361     0    0.023   1.147    16.789    0.000    0.000
LGA    L    67_B      L    67_B    16.739     0    0.045   0.177    18.477    0.000    0.000
LGA    Y    68_B      Y    68_B    18.634     0    0.040   1.262    23.846    0.000    0.000
LGA    A    69_B      A    69_B    18.873     0    0.028   0.036    20.235    0.000    0.000
LGA    E    70_B      E    70_B    19.412     0    0.026   0.305    21.169    0.000    0.000
LGA    M    71_B      M    71_B    21.373     0    0.027   1.020    22.939    0.000    0.000
LGA    K    72_B      K    72_B    22.506     0    0.033   0.566    23.968    0.000    0.000
LGA    A    73_B      A    73_B    22.912     0    0.060   0.071    24.281    0.000    0.000
LGA    A    74_B      A    74_B    24.036     0    0.032   0.031    25.610    0.000    0.000
LGA    L    75_B      L    75_B    25.573     0    0.033   0.338    26.826    0.000    0.000
LGA    A    76_B      A    76_B    26.609     0    0.022   0.027    27.856    0.000    0.000
LGA    A    77_B      A    77_B    26.916     0    0.052   0.054    27.955    0.000    0.000
LGA    A    78_B      A    78_B    27.559     0    0.102   0.115    28.728    0.000    0.000
LGA    K    79_B      K    79_B    29.064     0    0.644   1.613    29.960    0.000    0.000
LGA    T    80_B      T    80_B    32.077     0    0.634   0.759    35.001    0.000    0.000
LGA    P    81_B      P    81_B    28.251     0    0.052   0.092    29.242    0.000    0.000
LGA    E    82_B      E    82_B    29.355     4    0.611   0.600    31.328    0.000    0.000
LGA    E    83_B      E    83_B    33.871     4    0.614   0.594    35.440    0.000    0.000
LGA    K    84_B      K    84_B    31.918     0    0.057   0.853    38.271    0.000    0.000
LGA    I    85_B      I    85_B    29.718     0    0.039   1.067    31.032    0.000    0.000
LGA    A    86_B      A    86_B    28.258     0    0.013   0.014    29.176    0.000    0.000
LGA    V    87_B      V    87_B    27.550     0    0.023   0.114    29.654    0.000    0.000
LGA    F    88_B      F    88_B    25.540     0    0.043   1.211    26.584    0.000    0.000
LGA    R    89_B      R    89_B    23.563     0    0.034   1.089    27.003    0.000    0.000
LGA    E    90_B      E    90_B    22.752     0    0.039   0.134    25.371    0.000    0.000
LGA    Y    91_B      Y    91_B    21.243     0    0.140   1.270    31.785    0.000    0.000
LGA    N    92_B      N    92_B    19.571     0    0.042   0.335    21.004    0.000    0.000
LGA    A    93_B      A    93_B    17.201     0    0.082   0.083    18.408    0.000    0.000
LGA    R    94_B      R    94_B    15.856     0    0.073   1.155    19.640    0.000    0.000
LGA    F    95_B      F    95_B    13.978     0    0.057   1.209    19.465    0.000    0.000
LGA    L    96_B      L    96_B    12.338     0    0.046   0.399    15.396    0.119    0.060
LGA    A    97_B      A    97_B    10.851     0    0.592   0.595    12.190    0.238    0.190
LGA    E    98_B      E    98_B     6.911     0    0.578   1.160    11.910   18.452    9.365
LGA    F    99_B      F    99_B     0.978     0    0.666   1.334     7.053   79.524   50.649
LGA    D   100_B      D   100_B     1.301     0    0.091   0.413     2.349   75.119   78.512
LGA    A   101_B      A   101_B     2.283     0    0.057   0.059     2.918   64.881   64.857
LGA    L   102_B      L   102_B     2.108     0    0.182   1.232     3.166   66.786   64.940
LGA    I   103_B      I   103_B     3.213     0    0.056   0.751     6.481   53.571   44.405
LGA    D   104_B      D   104_B     3.016     0    0.026   0.741     5.727   57.381   43.571
LGA    Q   105_B      Q   105_B     1.483     0    0.059   0.738     2.396   77.143   76.720
LGA    A   106_B      A   106_B     2.041     0    0.044   0.047     2.617   68.810   66.476
LGA    F   107_B      F   107_B     2.537     0    0.089   0.351     6.201   62.857   42.511
LGA    A   108_B      A   108_B     2.175     0    0.076   0.087     2.591   70.833   68.095
LGA    R   109_B      R   109_B     2.024     0    0.101   0.940     7.624   68.810   47.143
LGA    L   110_B      L   110_B     1.914     3    0.123   0.128     2.684   66.905   42.560
LGA    K   111_B      K   111_B     2.445     2    0.361   0.781     4.608   59.167   38.730
LGA    A   112_B      A   112_B     6.953     0    0.634   0.610     8.726   13.690   11.524
LGA    D   113_B      D   113_B    10.236     0    0.613   0.653    15.746    1.190    0.595
LGA    S   114_B      S   114_B     9.891     0    0.492   0.704    10.457    2.500    1.667
LGA    L   115_B      L   115_B     7.723     0    0.156   0.449    10.667    3.571   17.143
LGA    T   116_B      T   116_B    14.462     0    0.184   0.201    19.143    0.000    0.000
LGA    L   117_B      L   117_B    16.424     0    0.189   0.979    19.488    0.000    0.000
LGA    K   118_B      K   118_B    23.518     0    0.143   0.404    26.109    0.000    0.000
LGA    I   119_B      I   119_B    28.102     0    0.080   1.385    31.400    0.000    0.000
LGA    H   120_B      H   120_B    35.117     0    0.290   1.128    36.821    0.000    0.000
LGA    L   121_B      L   121_B    40.963     0    0.493   0.657    43.580    0.000    0.000
LGA    S   122_B      S   122_B    47.977     0    0.532   0.928    50.145    0.000    0.000
LGA    Q   123_B      Q   123_B    52.044     4    0.269   0.269    54.004    0.000    0.000
LGA    G   124_B      G   124_B    47.684     0    0.642   0.642    48.761    0.000    0.000
LGA    K   125_B      K   125_B    47.166     4    0.467   0.507    47.527    0.000    0.000
LGA    G   126_B      G   126_B    42.495     0    0.190   0.190    43.713    0.000    0.000
LGA    S   127_B      S   127_B    36.440     0    0.366   0.731    38.767    0.000    0.000
LGA    Y   128_B      Y   128_B    29.207     0    0.083   1.316    32.051    0.000    0.000
LGA    E   129_B      E   129_B    24.521     0    0.193   0.958    26.167    0.000    0.000
LGA    I   130_B      I   130_B    17.900     0    0.217   0.980    21.893    0.000    0.000
LGA    I   131_B      I   131_B    12.031     0    0.190   0.905    14.298    0.000    0.000
LGA    F   132_B      F   132_B     7.256     0    0.113   1.249    13.599   19.524    8.398
LGA    P   133_B      P   133_B     3.417     0    0.149   0.558     7.431   52.738   36.531
LGA    P   134_B      P   134_B     5.179     0    0.043   0.521     7.553   26.190   25.646
LGA    E   135_B      E   135_B     5.936     4    0.652   0.627     7.678   32.024   15.026
LGA    V   136_B      V   136_B     0.959     0    0.617   0.473     2.768   73.333   72.109
LGA    Q   137_B      Q   137_B     4.792     4    0.587   0.586     6.104   33.571   16.825
LGA    A   138_B      A   138_B     5.465     0    0.281   0.285     5.838   31.548   29.524
LGA    D   139_B      D   139_B     2.400     0    0.046   0.931     3.392   74.048   66.607
LGA    P   140_B      P   140_B     1.654     0    0.050   0.224     2.466   77.143   71.837
LGA    E   141_B      E   141_B     0.927     0    0.053   0.687     2.203   88.214   77.937
LGA    R   142_B      R   142_B     0.840     0    0.090   1.893    10.866   88.214   52.121
LGA    A   143_B      A   143_B     1.451     0    0.041   0.047     2.356   75.119   76.381
LGA    A   144_B      A   144_B     2.194     0    0.033   0.030     2.653   64.881   64.857
LGA    A   145_B      A   145_B     2.087     0    0.090   0.095     2.552   64.881   66.476
LGA    I   146_B      I   146_B     2.418     0    0.215   1.637     4.355   64.762   56.905
LGA    E   147_B      E   147_B     2.512     0    0.042   0.835     5.976   62.857   46.614
LGA    A   148_B      A   148_B     1.983     0    0.035   0.034     2.456   66.786   66.381
LGA    L   149_B      L   149_B     2.454     0    0.055   1.366     3.687   59.167   55.655
LGA    W   150_B      W   150_B     3.673     0    0.066   1.167     9.884   48.452   21.837
LGA    K   151_B      K   151_B     2.419     4    0.034   0.034     2.948   64.881   36.032
LGA    P   152_B      P   152_B     2.361     0    0.052   0.627     3.105   60.952   60.544
LGA    T   153_B      T   153_B     3.989     0    0.031   1.152     7.404   48.333   38.980
LGA    L   154_B      L   154_B     2.860     0    0.042   1.307     6.686   63.214   46.071
LGA    D   155_B      D   155_B     0.657     0    0.043   1.300     5.543   85.952   67.500
LGA    Q   156_B      Q   156_B     2.435     0    0.059   0.907     8.025   70.833   43.545
LGA    L   157_B      L   157_B     2.258     0    0.029   0.838     3.086   68.810   69.167
LGA    L   158_B      L   158_B     1.765     0    0.026   0.940     2.653   75.119   70.119
LGA    A   159_B      A   159_B     1.655     0    0.020   0.019     2.167   77.143   74.667
LGA    V   160_B      V   160_B     0.664     0    0.013   0.226     2.188   88.214   82.925
LGA    L   161_B      L   161_B     2.250     0    0.041   0.260     3.895   63.333   55.893
LGA    Q   162_B      Q   162_B     3.607     0    0.030   0.752     6.633   43.810   34.709
LGA    E   163_B      E   163_B     3.331     3    0.074   0.536     4.288   50.119   31.958
LGA    K   164_B      K   164_B     3.043     4    0.086   0.099     5.062   42.619   25.291
LGA    H   165_B      H   165_B     5.796     0    0.385   0.479     7.774   18.333   14.762
LGA    K   166_B      K   166_B     7.189     2    0.130   0.787     9.627    7.262   11.111
LGA    G   167_B      G   167_B    13.325     0    0.337   0.337    17.011    0.000    0.000
LGA    K   168_B      K   168_B    17.400     0    0.163   0.967    25.080    0.000    0.000
LGA    P   169_B      P   169_B    19.448     0    0.071   0.562    22.190    0.000    0.000
LGA    A   170_B      A   170_B    18.463     0    0.205   0.229    19.882    0.000    0.000
LGA    T   171_B      T   171_B    19.293     0    0.560   0.514    21.950    0.000    0.000
LGA    T   172_B      T   172_B    19.211     0    0.152   0.228    22.596    0.000    0.000
LGA    V   173_B      V   173_B    16.828     0    0.370   0.567    17.391    0.000    0.000
LGA    T   174_B      T   174_B    20.366     0    0.171   0.973    23.382    0.000    0.000
LGA    Y   175_B      Y   175_B    21.277     0    0.089   0.230    23.702    0.000    0.000
LGA    E   176_B      E   176_B    25.835     0    0.162   0.766    32.480    0.000    0.000
LGA    I   177_B      I   177_B    26.082     0    0.636   0.632    26.869    0.000    0.000
LGA    S   178_B      S   178_B    27.879     0    0.693   0.598    29.527    0.000    0.000
LGA    A   179_B      A   179_B    28.801     0    0.124   0.128    30.613    0.000    0.000
LGA    E   180_B      E   180_B    29.112     0    0.063   0.723    34.445    0.000    0.000
LGA    T   181_B      T   181_B    24.067     0    0.041   1.166    26.079    0.000    0.000
LGA    L   182_B      L   182_B    21.894     0    0.024   1.306    23.005    0.000    0.000
LGA    R   183_B      R   183_B    25.104     0    0.039   1.279    31.533    0.000    0.000
LGA    A   184_B      A   184_B    23.776     0    0.041   0.039    24.349    0.000    0.000
LGA    A   185_B      A   185_B    18.255     0    0.018   0.017    20.239    0.000    0.000
LGA    V   186_B      V   186_B    19.550     0    0.061   0.069    20.802    0.000    0.000
LGA    A   187_B      A   187_B    23.833     0    0.030   0.028    25.571    0.000    0.000
LGA    A   188_B      A   188_B    20.565     0    0.040   0.045    21.504    0.000    0.000
LGA    L   189_B      L   189_B    17.536     0    0.067   0.627    19.239    0.000    0.000
LGA    A   190_B      A   190_B    22.173     0    0.047   0.045    24.261    0.000    0.000
LGA    R   191_B      R   191_B    25.191     0    0.041   1.423    28.054    0.000    0.000
LGA    A   192_B      A   192_B    21.778     0    0.045   0.046    23.139    0.000    0.000
LGA    A   193_B      A   193_B    22.126     0    0.047   0.051    25.262    0.000    0.000
LGA    E   194_B      E   194_B    28.078     0    0.043   0.816    33.510    0.000    0.000
LGA    A   195_B      A   195_B    29.084     0    0.017   0.017    30.529    0.000    0.000
LGA    A   196_B      A   196_B    26.915     0    0.025   0.025    29.658    0.000    0.000
LGA    L   197_B      L   197_B    29.665     0    0.028   1.322    33.259    0.000    0.000
LGA    R   198_B      R   198_B    34.906     0    0.017   1.054    37.533    0.000    0.000
LGA    R   199_B      R   199_B    34.742     0    0.028   0.906    36.750    0.000    0.000
LGA    K   200_B      K   200_B    34.280     0    0.063   0.801    37.372    0.000    0.000
LGA    V   201_B      V   201_B    38.320     0    0.091   1.245    41.532    0.000    0.000
LGA    G   202_B      G   202_B    41.985     0    0.204   0.204    44.347    0.000    0.000
LGA    S   203_B      S   203_B    41.758     1    0.226   0.334    41.758    0.000    0.000
LGA    L   204_B      L   204_B    42.281     3    0.206   0.210    43.706    0.000    0.000
LGA    E   205_B      E   205_B    38.232     4    0.380   0.382    39.611    0.000    0.000
LGA    S   206_B      S   206_B    37.109     1    0.714   0.645    39.218    0.000    0.000
LGA    S   207_B      S   207_B    34.665     0    0.092   0.634    35.888    0.000    0.000
LGA    G   208_B      G   208_B    32.057     0    0.605   0.605    32.939    0.000    0.000
LGA    L   209_B      L   209_B    28.143     3    0.232   0.248    29.452    0.000    0.000
LGA    E   210_B      E   210_B    27.146     4    0.537   0.501    28.466    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):    21.644         21.587                 21.402           14.394   12.168

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  214  207    4.0     41    2.34    19.082    16.306     1.681

LGA_LOCAL      RMSD:   2.339  Number of atoms:   41  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  25.685  Number of assigned atoms:  207 
Std_ASGN_ATOMS RMSD:  21.644  Standard rmsd on all 207 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.173018 * X  +   0.665519 * Y  +  -0.726050 * Z  +  -6.832287
  Y_new =   0.982311 * X  +   0.170207 * Y  +  -0.078068 * Z  + -16.760233
  Z_new =   0.071623 * X  +  -0.726714 * Y  +  -0.683196 * Z  +  52.938152 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  1.745142 -0.071684 -2.325338   [DEG:   99.9893   -4.1072 -133.2321 ]
ZXZ: -1.463684  2.322927  3.043352   [DEG:  -83.8629  133.0939  174.3712 ]
 
# END of job
