
#######################################################
#                                                     #
#                        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:    50      61_B - 110_B       4.97    24.57
  LCS_AVERAGE:     16.40

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    26     177_B - 202_B       2.00    33.93
  LCS_AVERAGE:      6.88

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    23     177_B - 199_B       0.98    33.83
  LONGEST_CONTINUOUS_SEGMENT:    23     178_B - 200_B       0.88    33.94
  LCS_AVERAGE:      5.18

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    6   16      3    3    4    5    6    6   10   14   15   17   18   22   23   26   38   42   50   57   61   63 
LCS_GDT     D     5_B     D     5_B      4    6   16      3    3    4    5    9   11   13   15   18   23   27   29   34   38   46   51   56   58   61   64 
LCS_GDT     F     6_B     F     6_B      4    6   17      3    3    4    5    6    9   14   17   21   24   33   38   43   49   55   59   62   67   71   73 
LCS_GDT     T     7_B     T     7_B      4    6   24      3    3    4    5   10   13   14   17   21   28   34   41   48   52   56   62   65   67   71   73 
LCS_GDT     G     8_B     G     8_B      3   11   24      3    3    5    7   10   11   15   18   30   32   34   41   48   52   57   62   65   67   71   73 
LCS_GDT     A     9_B     A     9_B      4   11   24      3    3    6    7   10   12   15   21   30   32   34   38   43   49   55   59   65   67   71   73 
LCS_GDT     R    10_B     R    10_B      5   11   24      5    5    6    7   10   14   18   22   30   32   35   42   49   52   57   62   65   67   71   73 
LCS_GDT     E    11_B     E    11_B      5   11   24      5    5    6    8   13   17   21   28   34   36   40   43   48   52   57   62   65   67   71   73 
LCS_GDT     R    12_B     R    12_B      5   11   24      5    5    6    7   11   15   17   22   30   32   34   36   39   44   47   54   61   64   69   73 
LCS_GDT     F    13_B     F    13_B      5   11   24      5    5    5    7   12   13   18   22   30   32   34   36   39   44   48   59   62   65   70   73 
LCS_GDT     L    14_B     L    14_B      5   11   24      5    5    9   11   15   17   21   24   26   31   38   42   49   55   57   62   65   67   71   73 
LCS_GDT     A    15_B     A    15_B      4   11   24      3    4    5    7   10   11   12   14   17   22   36   40   44   46   50   50   55   64   70   73 
LCS_GDT     G    16_B     G    16_B      4   11   24      3    4    6    7   10   11   12   15   21   25   28   29   33   35   42   44   48   56   56   62 
LCS_GDT     D    17_B     D    17_B      4   11   24      3    3    6    8   10   15   17   20   30   32   34   36   39   44   47   49   52   57   60   63 
LCS_GDT     V    18_B     V    18_B      4   11   24      3    3    5    7   12   14   18   22   30   32   34   36   39   44   47   49   52   57   60   66 
LCS_GDT     T    19_B     T    19_B      4    9   24      3    4    4    5    8   12   15   22   30   32   34   36   39   44   47   49   52   57   60   66 
LCS_GDT     I    20_B     I    20_B      4    9   24      3    4    4    6   10   12   15   20   30   32   34   36   39   44   47   53   59   66   68   72 
LCS_GDT     V    21_B     V    21_B      8    9   24      4    6    8   10   11   15   18   22   30   32   34   36   39   44   47   49   52   57   59   62 
LCS_GDT     L    22_B     L    22_B      8    9   24      4    6    8   10   12   15   18   22   30   32   34   36   39   44   47   49   52   57   58   62 
LCS_GDT     L    23_B     L    23_B      8    9   24      4    6    8   10   12   15   18   22   30   32   34   36   39   44   47   49   52   56   58   62 
LCS_GDT     I    24_B     I    24_B      8    9   24      4    6    8   10   12   15   18   22   30   32   34   36   39   44   47   49   52   57   58   62 
LCS_GDT     A    25_B     A    25_B      8    9   24      3    6    8   10   12   15   18   22   30   32   34   36   39   44   47   49   52   57   58   62 
LCS_GDT     E    26_B     E    26_B      8    9   24      3    6    8   10   12   15   18   21   26   32   34   36   39   41   46   49   52   56   58   60 
LCS_GDT     S    27_B     S    27_B      8    9   24      3    5    8   10   12   15   17   20   26   32   33   36   39   41   46   47   50   56   58   60 
LCS_GDT     H    28_B     H    28_B      8    9   24      3    5    8   10   12   15   18   22   30   32   34   36   39   44   47   49   52   56   58   62 
LCS_GDT     D    29_B     D    29_B      4    6   24      3    4    5    6    7    9   15   22   30   32   34   36   39   44   47   49   52   57   58   62 
LCS_GDT     A    30_B     A    30_B      4    6   24      3    4    5    6    7   12   15   18   20   24   30   31   34   41   47   49   52   57   58   62 
LCS_GDT     P    31_B     P    31_B      4    6   24      3    4    5    6    7   12   15   18   20   24   25   29   32   33   36   40   42   46   53   59 
LCS_GDT     Y    32_B     Y    32_B      4    6   20      3    4    5    6    7   10   13   16   20   22   24   29   32   33   36   40   42   44   47   49 
LCS_GDT     R    33_B     R    33_B      4    6   20      3    3    5    5    8   10   13   16   20   20   23   29   32   33   36   40   42   44   47   49 
LCS_GDT     L    34_B     L    34_B      4    6   20      3    3    4    4    6    8   12   15   20   20   24   29   32   33   36   40   42   44   47   49 
LCS_GDT     A    35_B     A    35_B      6    7   21      4    5    6    7    7    9   11   11   16   20   22   25   27   31   36   40   42   44   46   49 
LCS_GDT     N    36_B     N    36_B      6    7   23      4    5    6    7    7    9   11   12   13   20   22   25   27   29   36   40   42   44   46   49 
LCS_GDT     P    37_B     P    37_B      6    7   25      4    5    6    7    7    9   11   12   16   20   22   25   27   30   36   40   42   44   46   49 
LCS_GDT     E    38_B     E    38_B      6    7   25      4    5    6    7    7    9   11   12   14   17   19   23   25   29   30   35   38   44   45   49 
LCS_GDT     D    39_B     D    39_B      6    7   26      4    5    6    7    8   10   13   17   19   20   23   23   26   29   30   32   38   42   43   49 
LCS_GDT     P    40_B     P    40_B      6   14   26      4    4    6    8   11   13   15   17   19   20   23   23   26   28   30   32   35   37   40   44 
LCS_GDT     E    41_B     E    41_B      4   14   26      4    4    6    7   10   13   14   15   19   19   21   23   26   27   30   32   35   37   40   44 
LCS_GDT     A    42_B     A    42_B      4   14   26      4    4    5    8   12   13   14   15   17   19   21   22   26   27   29   31   35   37   40   44 
LCS_GDT     D    43_B     D    43_B     11   14   26      4    5   10   11   12   13   15   17   19   20   23   23   26   27   29   31   33   37   40   44 
LCS_GDT     L    44_B     L    44_B     11   14   26      3   10   10   11   12   13   15   17   19   20   23   23   26   27   29   31   34   38   41   44 
LCS_GDT     S    45_B     S    45_B     11   14   26      9   10   10   11   12   13   15   17   19   20   23   23   26   27   30   36   39   40   41   44 
LCS_GDT     D    46_B     D    46_B     11   14   26      9   10   10   11   12   13   15   17   19   20   23   23   26   28   30   36   39   41   44   45 
LCS_GDT     E    47_B     E    47_B     11   14   26      9   10   10   11   12   13   15   17   19   20   23   23   26   28   30   36   39   41   44   45 
LCS_GDT     Q    48_B     Q    48_B     11   14   26      9   10   10   11   12   13   15   17   19   20   23   23   26   28   30   36   39   41   44   45 
LCS_GDT     L    49_B     L    49_B     11   14   26      9   10   10   11   12   13   15   17   19   20   23   23   26   28   30   36   39   41   44   45 
LCS_GDT     E    50_B     E    50_B     11   14   26      9   10   10   11   12   13   15   17   19   20   23   23   26   28   31   36   39   41   45   47 
LCS_GDT     R    51_B     R    51_B     11   14   26      9   10   10   11   12   13   15   17   19   20   23   23   26   28   33   36   39   42   45   47 
LCS_GDT     A    52_B     A    52_B     11   14   26      9   10   10   11   12   13   14   15   19   20   23   23   26   28   30   36   39   41   45   47 
LCS_GDT     L    53_B     L    53_B     11   14   26      9   10   10   11   12   13   15   17   19   20   23   23   26   28   33   36   39   42   47   47 
LCS_GDT     A    54_B     A    54_B      9   14   26      3    4    7   10   11   13   15   17   20   20   23   29   32   33   36   39   41   42   47   48 
LCS_GDT     A    55_B     A    55_B      8    9   26      4    8    8    8   10   11   13   16   20   24   25   29   32   33   36   39   41   43   47   48 
LCS_GDT     Y    56_B     Y    56_B      8    9   26      7    8    8    8   10   11   15   16   20   24   25   29   32   33   36   39   41   44   47   49 
LCS_GDT     L    57_B     L    57_B      8    9   26      7    8    8    8   11   13   15   17   20   24   28   29   32   33   36   39   42   46   51   56 
LCS_GDT     T    58_B     T    58_B      8    9   26      7    8    8    8   11   13   15   18   21   25   30   35   39   44   47   49   53   59   67   71 
LCS_GDT     L    59_B     L    59_B      8    9   26      7    8    8    8   10   12   15   18   21   25   30   35   39   44   47   56   62   67   69   73 
LCS_GDT     V    60_B     V    60_B      8    9   49      7    8    8    8   11   13   15   18   21   25   28   32   39   41   44   49   62   67   69   73 
LCS_GDT     E    61_B     E    61_B      8    9   50      7    8    8   10   12   15   18   22   30   32   34   40   42   46   55   60   63   67   69   73 
LCS_GDT     T    62_B     T    62_B      8    9   50      7    8    8    9   11   16   24   30   32   37   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     L    63_B     L    63_B      4   16   50      3    4    4    6    9   13   18   27   31   37   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     F    64_B     F    64_B     15   18   50      4    8   12   16   17   24   31   33   38   42   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     P    65_B     P    65_B     15   18   50      4   12   15   16   22   25   31   33   38   42   45   47   50   55   57   60   65   67   71   73 
LCS_GDT     E    66_B     E    66_B     15   18   50      8   13   15   17   25   26   31   33   38   42   45   47   50   55   57   60   65   67   71   73 
LCS_GDT     L    67_B     L    67_B     15   18   50      8   13   15   17   22   25   31   33   38   42   45   47   50   55   57   61   65   67   71   73 
LCS_GDT     Y    68_B     Y    68_B     15   18   50      5   13   23   24   25   26   31   33   38   42   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     A    69_B     A    69_B     15   18   50      8   13   15   17   22   25   31   33   38   42   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     E    70_B     E    70_B     15   18   50      8   13   15   17   22   25   31   33   38   42   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     M    71_B     M    71_B     15   18   50      8   13   15   17   22   25   31   33   38   42   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     K    72_B     K    72_B     15   18   50      8   13   15   17   22   25   31   33   38   42   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     A    73_B     A    73_B     15   18   50      8   13   15   17   22   25   31   33   38   42   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     A    74_B     A    74_B     15   18   50      8   13   15   17   22   25   31   33   38   42   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     L    75_B     L    75_B     15   18   50      8   13   15   17   22   25   31   33   38   42   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     A    76_B     A    76_B     15   18   50      8   13   15   17   22   25   31   33   38   42   42   46   50   55   57   62   65   67   71   73 
LCS_GDT     A    77_B     A    77_B     15   18   50      8   13   15   17   22   25   31   33   38   42   42   46   50   53   57   62   65   67   71   73 
LCS_GDT     A    78_B     A    78_B     15   18   50      8   13   15   17   22   25   31   33   38   42   42   46   50   53   57   62   65   67   71   73 
LCS_GDT     K    79_B     K    79_B     15   18   50      6   10   14   17   20   25   28   30   36   37   40   45   50   52   57   62   65   67   71   73 
LCS_GDT     T    80_B     T    80_B      3   18   50      3    4    4   15   22   25   31   33   38   42   42   46   50   52   57   62   65   67   71   73 
LCS_GDT     P    81_B     P    81_B      3   18   50      3    3    3    6   10   17   24   28   29   31   38   41   47   52   56   59   64   67   71   73 
LCS_GDT     E    82_B     E    82_B      3   18   50      3    6   12   17   22   25   31   33   38   42   42   46   50   52   57   62   65   67   71   73 
LCS_GDT     E    83_B     E    83_B     15   16   50     10   12   15   17   17   22   27   33   38   42   42   46   50   55   57   62   65   67   71   73 
LCS_GDT     K    84_B     K    84_B     15   16   50     10   12   15   17   17   22   29   33   38   42   42   46   50   55   57   62   65   67   71   73 
LCS_GDT     I    85_B     I    85_B     15   16   50     10   12   15   17   17   23   31   33   38   42   42   46   50   55   57   62   65   67   71   73 
LCS_GDT     A    86_B     A    86_B     15   16   50     10   12   15   17   22   25   31   33   38   42   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     V    87_B     V    87_B     15   16   50     10   12   15   17   19   25   31   33   38   42   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     F    88_B     F    88_B     15   16   50     10   12   15   17   22   25   31   33   38   42   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     R    89_B     R    89_B     15   16   50     10   12   15   17   22   25   31   33   38   42   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     E    90_B     E    90_B     15   16   50     10   12   15   17   22   25   31   33   38   42   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     Y    91_B     Y    91_B     15   16   50     10   12   15   17   22   25   31   33   38   42   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     N    92_B     N    92_B     15   16   50     10   12   15   17   22   25   31   33   38   42   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     A    93_B     A    93_B     15   16   50      4   12   15   17   22   24   31   33   38   42   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     R    94_B     R    94_B     15   16   50      4   12   15   17   17   23   31   33   38   42   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     F    95_B     F    95_B     15   16   50      4   10   15   17   17   22   31   33   38   42   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     L    96_B     L    96_B     15   16   50      4   12   15   17   17   22   31   33   38   42   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     A    97_B     A    97_B     15   16   50      4   10   15   17   17   22   31   33   38   42   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     E    98_B     E    98_B      3   16   50      2    4    8   12   17   22   29   33   38   42   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     F    99_B     F    99_B     11   14   50      5    8   12   14   15   19   27   32   34   36   40   47   50   55   57   62   65   67   71   73 
LCS_GDT     D   100_B     D   100_B     12   14   50      5    8   12   14   17   19   27   32   35   42   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     A   101_B     A   101_B     12   14   50      5    8   12   14   17   19   27   32   35   42   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     L   102_B     L   102_B     12   14   50      5    9   12   14   17   19   27   32   35   42   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     I   103_B     I   103_B     12   14   50      6    9   12   14   17   19   27   32   35   42   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     D   104_B     D   104_B     12   14   50      6    9   12   14   17   22   29   33   38   42   42   46   50   55   57   62   65   67   71   73 
LCS_GDT     Q   105_B     Q   105_B     12   14   50      6    9   12   14   17   22   29   33   38   42   42   46   50   53   57   62   65   67   71   73 
LCS_GDT     A   106_B     A   106_B     12   14   50      6    9   12   14   17   18   27   32   34   36   40   45   50   53   57   62   65   67   71   73 
LCS_GDT     F   107_B     F   107_B     12   14   50      5    9   12   14   17   18   27   32   34   36   40   45   50   52   55   62   65   67   71   73 
LCS_GDT     A   108_B     A   108_B     12   14   50      6    9   12   14   17   19   27   32   34   37   40   45   50   52   55   60   65   67   71   73 
LCS_GDT     R   109_B     R   109_B     12   14   50      6    9   12   14   17   19   27   32   34   36   40   43   47   52   54   60   63   66   71   73 
LCS_GDT     L   110_B     L   110_B     12   14   50      4    9   12   14   17   19   27   32   34   36   40   43   46   47   50   51   57   62   64   69 
LCS_GDT     K   111_B     K   111_B     12   14   49      3    9   12   14   17   19   27   32   34   36   40   43   46   47   50   51   56   58   63   69 
LCS_GDT     A   112_B     A   112_B      3   14   49      3    4    5   10   15   18   24   32   34   36   40   43   46   47   50   51   58   62   66   70 
LCS_GDT     D   113_B     D   113_B      3    6   21      3    4    4    5    7   14   18   26   36   37   39   43   47   52   56   62   65   67   71   73 
LCS_GDT     S   114_B     S   114_B      4    6   21      3    4   14   17   17   20   24   29   33   39   42   46   50   53   57   62   65   67   71   73 
LCS_GDT     L   115_B     L   115_B      4    6   21      3    4    8   12   17   21   27   32   38   42   42   46   50   55   57   62   65   67   71   73 
LCS_GDT     T   116_B     T   116_B      4    6   21      3    4    6   10   13   19   24   30   33   37   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     L   117_B     L   117_B      4    6   21      3    4    4    5    6    8   10   25   32   37   45   47   50   55   57   60   63   67   69   73 
LCS_GDT     K   118_B     K   118_B      4    6   21      3    4    4    5    6   12   18   27   32   37   45   47   50   55   57   60   63   67   69   73 
LCS_GDT     I   119_B     I   119_B      3    6   21      3    3    4    5    6    8   10   11   14   18   45   47   50   55   57   60   63   67   69   73 
LCS_GDT     H   120_B     H   120_B      3    6   21      3    3    4    5    7   14   19   24   30   37   45   47   50   55   57   60   63   67   69   73 
LCS_GDT     L   121_B     L   121_B      3    8   21      3    3    6    8   11   13   15   19   24   28   45   47   50   55   57   60   63   67   69   73 
LCS_GDT     S   122_B     S   122_B      3    8   21      0    3    4    5   11   13   15   20   29   37   45   47   50   55   57   60   63   67   69   73 
LCS_GDT     Q   123_B     Q   123_B      5    8   21      4    5    5    8   11   13   15   20   24   37   45   47   50   55   57   60   62   67   69   72 
LCS_GDT     G   124_B     G   124_B      5    8   21      4    5    6   11   12   16   22   27   32   37   45   47   50   55   57   60   63   67   69   73 
LCS_GDT     K   125_B     K   125_B      5    8   21      4    5    6    8   11   15   21   30   32   37   45   47   50   55   57   60   63   67   69   73 
LCS_GDT     G   126_B     G   126_B      5    8   21      4    5    6    8   11   13   18   25   31   36   39   47   50   55   57   60   63   67   69   73 
LCS_GDT     S   127_B     S   127_B      5    8   21      3    5    5    9   11   13   17   26   28   33   40   45   49   52   57   62   65   67   71   73 
LCS_GDT     Y   128_B     Y   128_B      4    8   18      3    3    4    6    7   10   10   12   30   33   38   42   49   52   57   62   65   67   71   73 
LCS_GDT     E   129_B     E   129_B      4    8   18      3    3    5    6    8   17   21   24   28   33   37   42   48   52   57   62   65   67   71   73 
LCS_GDT     I   130_B     I   130_B      4    7   18      3    3    5    6    6    8   18   24   30   33   37   42   49   52   57   62   65   67   71   73 
LCS_GDT     I   131_B     I   131_B      4    7   18      4    7   12   15   16   16   21   24   26   30   35   42   47   52   57   62   65   67   71   73 
LCS_GDT     F   132_B     F   132_B      4    7   33      3    4    5    6    7    8   10   18   22   30   33   39   47   49   56   62   65   67   71   73 
LCS_GDT     P   133_B     P   133_B      4    7   35      3    4    5    6    7    8   10   12   14   26   33   38   43   45   52   59   64   67   71   73 
LCS_GDT     P   134_B     P   134_B      4    7   35      3    4    5    9   12   17   19   20   22   25   29   31   31   32   40   47   48   52   55   57 
LCS_GDT     E   135_B     E   135_B      3    7   35      3    4    4    8   15   17   21   24   27   28   29   34   39   46   46   49   52   55   59   63 
LCS_GDT     V   136_B     V   136_B      4    8   35      4    9   12   13   16   17   21   29   34   36   39   42   46   47   50   51   56   58   61   63 
LCS_GDT     Q   137_B     Q   137_B      4    8   35      4    4    5    8   12   17   21   24   27   28   34   40   44   47   50   51   56   58   61   63 
LCS_GDT     A   138_B     A   138_B      4    9   35      4    4    5    8    9   14   20   24   27   36   39   43   46   47   50   51   56   58   61   63 
LCS_GDT     D   139_B     D   139_B      4   14   35      4    4    5    6   17   18   27   32   34   36   40   43   46   47   50   51   56   58   61   63 
LCS_GDT     P   140_B     P   140_B     12   15   35      4    9   12   13   16   17   21   29   34   36   39   42   46   47   50   51   56   58   61   63 
LCS_GDT     E   141_B     E   141_B     12   15   35      4    9   12   13   17   18   24   32   34   36   39   43   46   47   50   51   56   58   61   63 
LCS_GDT     R   142_B     R   142_B     12   15   35      3    9   12   13   17   18   24   32   34   36   39   43   46   47   50   51   56   58   61   63 
LCS_GDT     A   143_B     A   143_B     12   15   35      5    9   12   13   17   18   27   32   34   36   40   43   46   47   50   51   56   58   61   63 
LCS_GDT     A   144_B     A   144_B     12   15   35      5    9   12   14   17   19   27   32   34   36   40   43   46   47   50   51   56   58   61   63 
LCS_GDT     A   145_B     A   145_B     12   15   35      5    9   12   13   16   19   27   32   34   36   40   43   46   47   50   51   56   58   61   63 
LCS_GDT     I   146_B     I   146_B     12   15   35      5    9   12   13   16   19   27   32   34   36   40   43   46   47   50   51   56   58   61   63 
LCS_GDT     E   147_B     E   147_B     12   21   35      5    9   12   13   16   19   27   32   34   36   40   43   46   47   50   51   56   58   61   63 
LCS_GDT     A   148_B     A   148_B     12   21   35      4    9   14   18   19   19   24   32   33   36   40   43   46   47   50   51   56   58   61   63 
LCS_GDT     L   149_B     L   149_B     12   21   35      3    9   12   13   16   19   23   32   33   36   40   43   46   47   50   51   56   58   61   63 
LCS_GDT     W   150_B     W   150_B     18   21   35      4   13   16   18   19   19   24   32   33   36   40   43   46   47   50   51   56   58   61   63 
LCS_GDT     K   151_B     K   151_B     18   21   35     11   14   16   18   19   19   24   32   33   36   40   43   46   47   50   50   56   58   61   63 
LCS_GDT     P   152_B     P   152_B     18   21   35      4   14   16   17   19   19   24   32   33   36   40   43   46   47   50   50   56   58   61   63 
LCS_GDT     T   153_B     T   153_B     18   21   35     11   14   16   18   19   19   24   32   33   36   40   43   46   47   50   51   56   58   61   63 
LCS_GDT     L   154_B     L   154_B     18   21   35     11   14   16   18   19   19   24   32   33   36   40   43   46   47   50   51   56   58   61   63 
LCS_GDT     D   155_B     D   155_B     18   21   35     11   14   16   18   19   19   24   32   34   36   40   43   46   47   50   51   56   58   61   63 
LCS_GDT     Q   156_B     Q   156_B     18   21   35     11   14   16   18   19   19   27   32   34   36   40   43   46   47   50   51   56   58   61   63 
LCS_GDT     L   157_B     L   157_B     18   21   35     11   14   16   18   19   19   27   32   34   36   40   43   46   47   50   51   56   58   61   63 
LCS_GDT     L   158_B     L   158_B     18   21   35     11   14   16   18   19   19   27   32   34   36   40   43   46   47   50   51   56   58   61   63 
LCS_GDT     A   159_B     A   159_B     18   21   35     11   14   16   18   19   19   27   32   34   36   40   43   46   47   50   51   56   58   61   63 
LCS_GDT     V   160_B     V   160_B     18   21   35     11   14   16   18   19   19   27   32   34   36   40   43   46   47   50   51   56   58   61   63 
LCS_GDT     L   161_B     L   161_B     18   21   35     11   14   16   18   19   19   27   32   34   36   40   43   46   47   50   51   56   58   61   63 
LCS_GDT     Q   162_B     Q   162_B     18   21   35     11   14   16   18   19   19   27   32   34   36   40   43   46   47   50   51   56   58   61   63 
LCS_GDT     E   163_B     E   163_B     18   21   35     10   14   16   18   19   19   27   32   34   36   40   43   46   47   50   51   56   58   61   63 
LCS_GDT     K   164_B     K   164_B     18   21   35     10   14   16   18   19   19   27   32   34   36   40   43   46   47   50   51   56   58   61   63 
LCS_GDT     H   165_B     H   165_B     18   21   35      9   14   16   18   19   19   21   32   33   36   40   43   46   47   50   51   56   58   61   63 
LCS_GDT     K   166_B     K   166_B     18   21   35      3    3   16   18   19   19   20   23   30   36   40   43   46   47   50   51   56   58   61   63 
LCS_GDT     G   167_B     G   167_B     18   21   35      3    5    5   18   19   19   20   22   32   35   39   41   46   47   50   51   56   58   61   63 
LCS_GDT     K   168_B     K   168_B      5   19   35      4    5    5    5    8   15   16   21   23   24   31   39   41   43   46   51   56   58   61   63 
LCS_GDT     P   169_B     P   169_B      5    6   33      4    5    5    5    6    7    9    9   12   17   19   29   29   35   38   42   50   57   60   63 
LCS_GDT     A   170_B     A   170_B      5    6   33      4    5    5    5    6    9    9   11   20   23   27   29   30   37   45   50   56   58   61   63 
LCS_GDT     T   171_B     T   171_B      5    6   33      4    5    5    5    8   13   16   21   23   24   25   28   35   39   42   49   51   58   61   63 
LCS_GDT     T   172_B     T   172_B      5    6   33      4    4    5    8   12   18   19   21   23   24   25   27   27   30   33   38   46   50   56   60 
LCS_GDT     V   173_B     V   173_B      5    6   33      4    4    5    5    7    9   12   15   18   20   21   23   26   27   29   33   35   36   39   41 
LCS_GDT     T   174_B     T   174_B      5    6   33      4    4    5    5    5    6    8    9   11   15   20   22   25   27   31   33   36   38   39   41 
LCS_GDT     Y   175_B     Y   175_B      5    6   33      0    4    5    5    5    7    9   10   13   14   18   28   31   32   35   36   36   38   39   41 
LCS_GDT     E   176_B     E   176_B      4   25   33      3    4    4    4    9   14   19   23   26   29   31   32   33   34   35   36   36   38   39   41 
LCS_GDT     I   177_B     I   177_B     23   26   33      3   12   17   22   24   26   27   27   28   29   31   32   33   34   35   36   36   38   40   43 
LCS_GDT     S   178_B     S   178_B     23   26   33      7   12   23   24   25   26   27   27   28   29   31   32   33   34   35   36   36   38   40   43 
LCS_GDT     A   179_B     A   179_B     23   26   33      7   19   23   24   25   26   27   27   28   29   31   32   33   34   35   36   36   38   40   43 
LCS_GDT     E   180_B     E   180_B     23   26   33     14   19   23   24   25   26   27   27   28   29   31   32   33   34   35   36   36   38   40   43 
LCS_GDT     T   181_B     T   181_B     23   26   33     12   19   23   24   25   26   27   27   28   29   31   32   33   34   35   36   36   38   40   43 
LCS_GDT     L   182_B     L   182_B     23   26   33     14   19   23   24   25   26   27   27   28   29   31   32   33   34   35   36   36   38   40   43 
LCS_GDT     R   183_B     R   183_B     23   26   33     14   19   23   24   25   26   27   27   28   29   31   32   33   34   35   36   36   38   40   43 
LCS_GDT     A   184_B     A   184_B     23   26   33     14   19   23   24   25   26   27   27   28   29   31   32   33   34   35   36   36   38   40   43 
LCS_GDT     A   185_B     A   185_B     23   26   33     14   19   23   24   25   26   27   27   28   29   31   32   33   34   35   36   36   38   45   53 
LCS_GDT     V   186_B     V   186_B     23   26   33     14   19   23   24   25   26   27   27   28   29   31   32   33   35   38   40   44   54   58   61 
LCS_GDT     A   187_B     A   187_B     23   26   33     14   19   23   24   25   26   27   27   28   29   33   34   36   37   38   43   47   62   64   69 
LCS_GDT     A   188_B     A   188_B     23   26   33     14   19   23   24   25   26   27   28   29   30   33   39   42   47   50   56   63   67   71   73 
LCS_GDT     L   189_B     L   189_B     23   26   33     14   19   23   24   25   26   27   27   35   37   39   45   50   52   56   62   65   67   71   73 
LCS_GDT     A   190_B     A   190_B     23   26   33     14   19   23   24   25   26   29   33   36   38   41   45   50   53   57   62   65   67   71   73 
LCS_GDT     R   191_B     R   191_B     23   26   33     14   19   23   24   25   26   27   29   36   37   41   45   49   55   57   62   65   67   71   73 
LCS_GDT     A   192_B     A   192_B     23   26   33     14   19   23   24   25   26   31   33   38   42   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     A   193_B     A   193_B     23   26   33     14   19   23   24   25   26   27   30   38   42   45   47   50   55   57   62   65   67   71   73 
LCS_GDT     E   194_B     E   194_B     23   26   33     14   19   23   24   25   26   27   27   28   29   45   47   50   55   57   60   63   67   70   73 
LCS_GDT     A   195_B     A   195_B     23   26   33      8   19   23   24   25   26   27   27   28   37   45   47   50   55   57   60   63   67   69   73 
LCS_GDT     A   196_B     A   196_B     23   26   33      8   19   23   24   25   26   27   27   28   29   31   34   39   49   55   59   62   65   69   73 
LCS_GDT     L   197_B     L   197_B     23   26   33      8   19   23   24   25   26   27   27   30   32   34   36   39   44   47   49   52   59   65   69 
LCS_GDT     R   198_B     R   198_B     23   26   33      7   18   23   24   25   26   27   27   30   32   34   36   39   44   47   49   52   57   58   62 
LCS_GDT     R   199_B     R   199_B     23   26   33      7   16   23   24   25   26   27   27   30   32   34   36   39   44   47   49   52   57   58   62 
LCS_GDT     K   200_B     K   200_B     23   26   33      3   13   19   24   25   26   27   27   28   29   32   36   39   41   46   47   51   56   58   62 
LCS_GDT     V   201_B     V   201_B      3   26   33      3    3    4    4   17   23   26   27   28   29   31   32   33   34   38   43   46   49   51   56 
LCS_GDT     G   202_B     G   202_B      3   26   33      3    3    4    6   16   18   20   26   28   29   31   32   33   34   35   36   36   38   46   53 
LCS_GDT     S   203_B     S   203_B      4    5   33      3    3    4    4    6   13   16   21   26   29   31   32   33   34   35   40   42   44   48   52 
LCS_GDT     L   204_B     L   204_B      4    5   33      3    3    4    4    5    6    7    9   10   11   12   17   25   31   34   38   42   44   46   49 
LCS_GDT     E   205_B     E   205_B      4    5   33      3    3    4    4    6   10   11   15   16   20   27   31   33   34   36   40   42   44   50   52 
LCS_GDT     S   206_B     S   206_B      4    5   33      3    3    6    6   11   12   14   15   19   20   22   25   26   31   36   41   43   44   50   52 
LCS_GDT     S   207_B     S   207_B      4    5   33      3    3    4    5    9   13   15   15   19   20   22   25   26   31   36   41   43   44   50   55 
LCS_GDT     G   208_B     G   208_B      4    5   21      3    3    4    5    5    6   15   15   19   20   21   22   25   32   38   43   47   49   53   56 
LCS_GDT     L   209_B     L   209_B      3    5   21      3    3    3    5    5    7    8   10   12   14   16   20   23   26   31   34   43   44   50   52 
LCS_GDT     E   210_B     E   210_B      3    4   21      3    3    3    3    4    7    8   13   16   23   27   29   29   31   33   34   36   37   40   45 
LCS_AVERAGE  LCS_A:   9.48  (   5.18    6.88   16.40 )

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     14     19     23     24     25     26     31     33     38     42     45     47     50     55     57     62     65     67     71     73 
GDT PERCENT_AT   6.76   9.18  11.11  11.59  12.08  12.56  14.98  15.94  18.36  20.29  21.74  22.71  24.15  26.57  27.54  29.95  31.40  32.37  34.30  35.27
GDT RMS_LOCAL    0.28   0.58   0.83   0.92   1.12   1.26   2.57   2.81   3.17   3.51   3.98   4.08   4.28   4.58   4.73   5.40   5.56   5.69   6.01   6.16
GDT RMS_ALL_AT  33.77  33.85  34.02  34.02  33.96  33.92  25.17  25.04  24.70  24.72  24.88  24.84  24.73  24.60  24.56  23.07  23.09  23.17  23.02  23.03

# Checking swapping
#   possible swapping detected:  E    11_B      E    11_B
#   possible swapping detected:  F    13_B      F    13_B
#   possible swapping detected:  E    26_B      E    26_B
#   possible swapping detected:  D    29_B      D    29_B
#   possible swapping detected:  E    41_B      E    41_B
#   possible swapping detected:  D    43_B      D    43_B
#   possible swapping detected:  Y    56_B      Y    56_B
#   possible swapping detected:  E    61_B      E    61_B
#   possible swapping detected:  E    66_B      E    66_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:  F    99_B      F    99_B
#   possible swapping detected:  F   107_B      F   107_B
#   possible swapping detected:  D   113_B      D   113_B
#   possible swapping detected:  E   129_B      E   129_B
#   possible swapping detected:  F   132_B      F   132_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:  Y   175_B      Y   175_B
#   possible swapping detected:  E   176_B      E   176_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    31.261     0    0.607   0.623    33.668    0.000    0.000
LGA    D     5_B      D     5_B    26.204     3    0.065   0.067    28.008    0.000    0.000
LGA    F     6_B      F     6_B    21.010     0    0.654   1.172    22.272    0.000    0.000
LGA    T     7_B      T     7_B    20.590     0    0.322   0.946    23.826    0.000    0.000
LGA    G     8_B      G     8_B    18.251     0    0.732   0.732    19.193    0.000    0.000
LGA    A     9_B      A     9_B    18.156     0    0.620   0.596    18.610    0.000    0.000
LGA    R    10_B      R    10_B    13.545     6    0.437   0.442    15.115    0.000    0.000
LGA    E    11_B      E    11_B    14.602     0    0.054   1.445    17.034    0.000    0.000
LGA    R    12_B      R    12_B    20.912     0    0.023   0.543    30.501    0.000    0.000
LGA    F    13_B      F    13_B    18.797     0    0.089   1.469    24.251    0.000    0.000
LGA    L    14_B      L    14_B    12.910     3    0.032   0.045    14.733    0.000    0.000
LGA    A    15_B      A    15_B    17.204     0    0.625   0.561    21.286    0.000    0.000
LGA    G    16_B      G    16_B    21.342     0    0.163   0.163    24.646    0.000    0.000
LGA    D    17_B      D    17_B    23.252     0    0.466   0.694    26.775    0.000    0.000
LGA    V    18_B      V    18_B    23.084     0    0.569   1.044    26.678    0.000    0.000
LGA    T    19_B      T    19_B    23.382     0    0.416   0.426    25.100    0.000    0.000
LGA    I    20_B      I    20_B    19.571     0    0.039   1.495    21.922    0.000    0.000
LGA    V    21_B      V    21_B    21.604     0    0.574   1.512    25.575    0.000    0.000
LGA    L    22_B      L    22_B    27.564     0    0.203   1.079    30.886    0.000    0.000
LGA    L    23_B      L    23_B    29.218     0    0.020   1.153    31.984    0.000    0.000
LGA    I    24_B      I    24_B    25.579     0    0.083   0.552    27.150    0.000    0.000
LGA    A    25_B      A    25_B    26.594     0    0.076   0.095    29.171    0.000    0.000
LGA    E    26_B      E    26_B    31.928     0    0.065   0.934    35.279    0.000    0.000
LGA    S    27_B      S    27_B    31.293     0    0.611   0.648    31.434    0.000    0.000
LGA    H    28_B      H    28_B    28.989     0    0.294   0.314    29.678    0.000    0.000
LGA    D    29_B      D    29_B    30.418     0    0.301   1.017    35.480    0.000    0.000
LGA    A    30_B      A    30_B    30.737     0    0.175   0.230    31.717    0.000    0.000
LGA    P    31_B      P    31_B    34.353     0    0.100   0.187    36.815    0.000    0.000
LGA    Y    32_B      Y    32_B    33.098     0    0.251   1.121    34.385    0.000    0.000
LGA    R    33_B      R    33_B    37.052     0    0.565   1.569    40.154    0.000    0.000
LGA    L    34_B      L    34_B    39.029     0    0.583   0.947    39.289    0.000    0.000
LGA    A    35_B      A    35_B    39.702     0    0.055   0.090    40.646    0.000    0.000
LGA    N    36_B      N    36_B    42.768     3    0.034   0.031    45.167    0.000    0.000
LGA    P    37_B      P    37_B    38.839     0    0.255   0.370    40.093    0.000    0.000
LGA    E    38_B      E    38_B    43.902     4    0.070   0.067    45.935    0.000    0.000
LGA    D    39_B      D    39_B    46.705     0    0.114   0.568    50.919    0.000    0.000
LGA    P    40_B      P    40_B    44.023     0    0.634   0.912    46.798    0.000    0.000
LGA    E    41_B      E    41_B    44.974     0    0.068   1.182    48.033    0.000    0.000
LGA    A    42_B      A    42_B    47.860     0    0.078   0.077    51.447    0.000    0.000
LGA    D    43_B      D    43_B    51.603     0    0.165   1.118    53.164    0.000    0.000
LGA    L    44_B      L    44_B    50.160     0    0.150   1.103    51.379    0.000    0.000
LGA    S    45_B      S    45_B    53.626     0    0.041   0.140    55.158    0.000    0.000
LGA    D    46_B      D    46_B    50.962     0    0.031   0.579    54.261    0.000    0.000
LGA    E    47_B      E    47_B    49.552     0    0.039   0.835    53.796    0.000    0.000
LGA    Q    48_B      Q    48_B    46.017     0    0.040   0.659    51.037    0.000    0.000
LGA    L    49_B      L    49_B    41.916     0    0.030   0.880    44.015    0.000    0.000
LGA    E    50_B      E    50_B    40.881     4    0.034   0.044    43.071    0.000    0.000
LGA    R    51_B      R    51_B    38.262     0    0.039   1.285    48.449    0.000    0.000
LGA    A    52_B      A    52_B    33.797     0    0.029   0.036    35.982    0.000    0.000
LGA    L    53_B      L    53_B    31.360     0    0.598   1.136    32.861    0.000    0.000
LGA    A    54_B      A    54_B    30.506     0    0.040   0.055    30.749    0.000    0.000
LGA    A    55_B      A    55_B    27.868     0    0.541   0.546    28.744    0.000    0.000
LGA    Y    56_B      Y    56_B    25.500     0    0.057   0.964    27.066    0.000    0.000
LGA    L    57_B      L    57_B    22.623     0    0.024   0.363    27.290    0.000    0.000
LGA    T    58_B      T    58_B    19.016     0    0.056   1.237    22.408    0.000    0.000
LGA    L    59_B      L    59_B    17.604     0    0.049   0.756    20.580    0.000    0.000
LGA    V    60_B      V    60_B    14.343     0    0.019   1.170    18.413    0.000    0.000
LGA    E    61_B      E    61_B    11.343     0    0.030   1.008    14.260    2.143    0.952
LGA    T    62_B      T    62_B     9.876     0    0.540   1.401    11.656    6.190    3.537
LGA    L    63_B      L    63_B     7.981     0    0.492   0.815    14.800   13.214    6.607
LGA    F    64_B      F    64_B     3.835     0    0.479   1.152     5.725   42.381   33.810
LGA    P    65_B      P    65_B     3.024     0    0.044   0.370     3.871   53.571   50.136
LGA    E    66_B      E    66_B     2.869     0    0.054   1.359     6.486   57.143   44.180
LGA    L    67_B      L    67_B     3.067     0    0.063   1.357     6.526   53.571   41.905
LGA    Y    68_B      Y    68_B     2.784     0    0.084   0.152     3.553   62.976   56.151
LGA    A    69_B      A    69_B     1.516     0    0.040   0.065     2.010   77.381   76.476
LGA    E    70_B      E    70_B     1.755     0    0.043   0.974     4.599   72.857   56.825
LGA    M    71_B      M    71_B     1.913     0    0.047   0.822     2.708   77.143   71.012
LGA    K    72_B      K    72_B     0.287     0    0.036   1.005     7.611   90.595   65.344
LGA    A    73_B      A    73_B     1.210     0    0.072   0.095     2.353   77.381   78.190
LGA    A    74_B      A    74_B     2.699     0    0.057   0.054     3.122   57.262   55.810
LGA    L    75_B      L    75_B     2.188     0    0.031   0.945     3.275   59.167   63.036
LGA    A    76_B      A    76_B     2.985     0    0.026   0.050     4.001   48.690   50.381
LGA    A    77_B      A    77_B     4.152     0    0.030   0.049     5.202   34.524   35.048
LGA    A    78_B      A    78_B     4.622     0    0.054   0.080     5.184   30.238   32.857
LGA    K    79_B      K    79_B     6.832     0    0.617   1.517    15.392   15.476    7.566
LGA    T    80_B      T    80_B     3.930     0    0.612   0.718     4.801   38.810   39.864
LGA    P    81_B      P    81_B     8.257     0    0.588   0.501    10.807    6.905    4.354
LGA    E    82_B      E    82_B     3.958     4    0.638   0.621     5.080   49.762   25.608
LGA    E    83_B      E    83_B     4.790     4    0.623   0.603     7.513   38.929   18.095
LGA    K    84_B      K    84_B     4.244     0    0.041   0.996     8.943   40.476   24.921
LGA    I    85_B      I    85_B     3.383     0    0.053   1.057     4.321   51.905   49.405
LGA    A    86_B      A    86_B     2.677     0    0.028   0.044     3.045   57.262   57.238
LGA    V    87_B      V    87_B     2.960     0    0.032   0.766     5.103   57.143   51.701
LGA    F    88_B      F    88_B     2.591     0    0.025   1.441     6.653   60.952   44.589
LGA    R    89_B      R    89_B     1.644     0    0.054   0.836     4.640   72.857   66.494
LGA    E    90_B      E    90_B     1.724     0    0.026   0.667     3.921   72.857   59.735
LGA    Y    91_B      Y    91_B     2.263     0    0.096   0.247     4.815   68.810   53.135
LGA    N    92_B      N    92_B     1.587     0    0.025   1.332     3.426   75.000   70.179
LGA    A    93_B      A    93_B     1.623     0    0.066   0.064     1.824   72.857   72.857
LGA    R    94_B      R    94_B     2.172     0    0.021   0.973     8.026   64.881   43.680
LGA    F    95_B      F    95_B     3.047     0    0.030   0.479     4.699   52.024   44.372
LGA    L    96_B      L    96_B     3.322     0    0.091   0.291     4.465   50.119   45.238
LGA    A    97_B      A    97_B     2.141     0    0.560   0.568     4.359   55.952   57.714
LGA    E    98_B      E    98_B     3.644     0    0.598   1.352     6.862   35.714   35.503
LGA    F    99_B      F    99_B     9.718     0    0.630   1.334    17.823    3.810    1.385
LGA    D   100_B      D   100_B     7.470     0    0.043   0.496     8.445    9.524    9.762
LGA    A   101_B      A   101_B     7.406     0    0.056   0.060     7.984   10.119    9.524
LGA    L   102_B      L   102_B     7.697     0    0.072   1.274    10.734    9.405    6.012
LGA    I   103_B      I   103_B     7.388     0    0.037   0.879     9.983   12.857    8.869
LGA    D   104_B      D   104_B     3.706     0    0.065   0.358     4.952   40.357   46.250
LGA    Q   105_B      Q   105_B     3.589     0    0.070   1.322     9.365   37.381   25.291
LGA    A   106_B      A   106_B     7.307     0    0.080   0.086     8.510   10.833    9.238
LGA    F   107_B      F   107_B     7.357     0    0.161   0.869     8.201    9.524   16.970
LGA    A   108_B      A   108_B     5.978     0    0.047   0.048     8.358   14.405   17.810
LGA    R   109_B      R   109_B     8.232     0    0.167   1.311    13.231    3.810    2.208
LGA    L   110_B      L   110_B    11.607     3    0.041   0.074    13.267    0.000    0.000
LGA    K   111_B      K   111_B    12.284     2    0.508   0.647    13.097    0.000    0.000
LGA    A   112_B      A   112_B    11.285     0    0.597   0.574    11.552    1.548    1.238
LGA    D   113_B      D   113_B     7.864     0    0.650   0.898     9.761   11.786    6.667
LGA    S   114_B      S   114_B     6.946     0    0.085   0.077    11.097   16.310   10.952
LGA    L   115_B      L   115_B     7.483     0    0.111   1.037    11.410    5.119    5.893
LGA    T   116_B      T   116_B    12.287     0    0.086   1.117    14.417    0.119    0.068
LGA    L   117_B      L   117_B    15.574     0    0.144   0.167    20.303    0.000    0.000
LGA    K   118_B      K   118_B    16.351     0    0.207   0.844    17.750    0.000    0.000
LGA    I   119_B      I   119_B    20.886     0    0.167   1.417    24.598    0.000    0.000
LGA    H   120_B      H   120_B    22.503     0    0.282   0.998    23.119    0.000    0.000
LGA    L   121_B      L   121_B    24.659     0    0.139   0.318    26.324    0.000    0.000
LGA    S   122_B      S   122_B    25.230     0    0.579   0.873    25.545    0.000    0.000
LGA    Q   123_B      Q   123_B    26.829     4    0.556   0.561    28.373    0.000    0.000
LGA    G   124_B      G   124_B    21.069     0    0.070   0.070    23.101    0.000    0.000
LGA    K   125_B      K   125_B    18.173     4    0.034   0.064    20.389    0.000    0.000
LGA    G   126_B      G   126_B    20.627     0    0.078   0.078    20.627    0.000    0.000
LGA    S   127_B      S   127_B    20.270     0    0.097   0.175    22.037    0.000    0.000
LGA    Y   128_B      Y   128_B    18.516     0    0.587   1.058    18.862    0.000    0.000
LGA    E   129_B      E   129_B    20.929     0    0.603   1.181    29.334    0.000    0.000
LGA    I   130_B      I   130_B    17.050     0    0.119   0.218    18.131    0.000    0.000
LGA    I   131_B      I   131_B    17.593     0    0.245   1.194    23.363    0.000    0.000
LGA    F   132_B      F   132_B    14.174     0    0.107   1.264    18.141    0.000    0.519
LGA    P   133_B      P   133_B    16.612     0    0.655   0.791    17.080    0.000    0.000
LGA    P   134_B      P   134_B    18.524     0    0.646   0.575    20.351    0.000    0.000
LGA    E   135_B      E   135_B    19.999     4    0.186   0.189    20.316    0.000    0.000
LGA    V   136_B      V   136_B    17.603     0    0.595   0.460    20.637    0.000    0.000
LGA    Q   137_B      Q   137_B    22.677     4    0.090   0.109    25.179    0.000    0.000
LGA    A   138_B      A   138_B    24.177     0    0.329   0.329    26.671    0.000    0.000
LGA    D   139_B      D   139_B    23.614     0    0.100   1.115    25.993    0.000    0.000
LGA    P   140_B      P   140_B    20.886     0    0.675   0.618    22.278    0.000    0.000
LGA    E   141_B      E   141_B    21.736     0    0.102   0.723    22.491    0.000    0.000
LGA    R   142_B      R   142_B    19.240     0    0.082   1.669    22.737    0.000    0.000
LGA    A   143_B      A   143_B    20.568     0    0.074   0.118    21.103    0.000    0.000
LGA    A   144_B      A   144_B    21.848     0    0.024   0.042    22.424    0.000    0.000
LGA    A   145_B      A   145_B    21.902     0    0.053   0.058    22.069    0.000    0.000
LGA    I   146_B      I   146_B    20.285     0    0.054   0.381    20.821    0.000    0.000
LGA    E   147_B      E   147_B    20.525     0    0.032   0.554    21.049    0.000    0.000
LGA    A   148_B      A   148_B    22.166     0    0.080   0.077    22.957    0.000    0.000
LGA    L   149_B      L   149_B    20.813     0    0.080   0.935    21.340    0.000    0.000
LGA    W   150_B      W   150_B    19.700     0    0.098   1.156    20.929    0.000    0.000
LGA    K   151_B      K   151_B    23.232     4    0.048   0.051    24.265    0.000    0.000
LGA    P   152_B      P   152_B    22.337     0    0.137   0.349    22.778    0.000    0.000
LGA    T   153_B      T   153_B    20.182     0    0.074   0.156    22.279    0.000    0.000
LGA    L   154_B      L   154_B    23.725     0    0.087   0.440    26.139    0.000    0.000
LGA    D   155_B      D   155_B    26.831     0    0.036   0.988    31.431    0.000    0.000
LGA    Q   156_B      Q   156_B    25.239     0    0.031   1.225    26.630    0.000    0.000
LGA    L   157_B      L   157_B    25.482     0    0.028   1.418    27.891    0.000    0.000
LGA    L   158_B      L   158_B    29.444     0    0.026   1.426    31.458    0.000    0.000
LGA    A   159_B      A   159_B    30.845     0    0.038   0.049    32.119    0.000    0.000
LGA    V   160_B      V   160_B    29.508     0    0.032   0.279    31.405    0.000    0.000
LGA    L   161_B      L   161_B    31.108     0    0.042   0.944    33.902    0.000    0.000
LGA    Q   162_B      Q   162_B    34.989     0    0.034   0.620    38.774    0.000    0.000
LGA    E   163_B      E   163_B    35.495     3    0.109   0.491    36.637    0.000    0.000
LGA    K   164_B      K   164_B    34.984     4    0.092   0.087    37.169    0.000    0.000
LGA    H   165_B      H   165_B    38.211     0    0.449   1.251    41.237    0.000    0.000
LGA    K   166_B      K   166_B    42.933     2    0.607   1.070    44.926    0.000    0.000
LGA    G   167_B      G   167_B    44.399     0    0.375   0.375    44.870    0.000    0.000
LGA    K   168_B      K   168_B    42.616     0    0.028   0.685    42.856    0.000    0.000
LGA    P   169_B      P   169_B    43.715     0    0.033   0.211    45.702    0.000    0.000
LGA    A   170_B      A   170_B    40.787     0    0.030   0.047    42.172    0.000    0.000
LGA    T   171_B      T   171_B    37.922     0    0.292   1.261    38.874    0.000    0.000
LGA    T   172_B      T   172_B    40.550     0    0.178   1.165    43.669    0.000    0.000
LGA    V   173_B      V   173_B    41.553     0    0.090   0.977    43.580    0.000    0.000
LGA    T   174_B      T   174_B    46.543     0    0.589   1.357    50.692    0.000    0.000
LGA    Y   175_B      Y   175_B    45.119     0    0.590   0.696    46.477    0.000    0.000
LGA    E   176_B      E   176_B    43.497     0    0.033   0.993    44.904    0.000    0.000
LGA    I   177_B      I   177_B    39.586     0    0.162   1.334    41.302    0.000    0.000
LGA    S   178_B      S   178_B    38.282     0    0.274   0.631    38.282    0.000    0.000
LGA    A   179_B      A   179_B    35.925     0    0.076   0.090    37.773    0.000    0.000
LGA    E   180_B      E   180_B    33.394     0    0.053   1.043    34.963    0.000    0.000
LGA    T   181_B      T   181_B    29.412     0    0.025   1.182    31.825    0.000    0.000
LGA    L   182_B      L   182_B    26.764     0    0.038   0.964    30.577    0.000    0.000
LGA    R   183_B      R   183_B    24.707     0    0.051   1.427    34.788    0.000    0.000
LGA    A   184_B      A   184_B    22.009     0    0.046   0.054    23.621    0.000    0.000
LGA    A   185_B      A   185_B    18.234     0    0.033   0.041    20.036    0.000    0.000
LGA    V   186_B      V   186_B    15.015     0    0.034   0.121    18.006    0.000    0.000
LGA    A   187_B      A   187_B    14.533     0    0.034   0.048    16.979    0.000    0.000
LGA    A   188_B      A   188_B    10.254     0    0.047   0.064    12.267    7.143    5.714
LGA    L   189_B      L   189_B     6.587     0    0.068   1.153    10.732   26.667   14.107
LGA    A   190_B      A   190_B     6.058     0    0.045   0.065     8.700   17.143   14.286
LGA    R   191_B      R   191_B     7.689     0    0.052   1.141    19.140   12.143    4.675
LGA    A   192_B      A   192_B     3.315     0    0.074   0.073     7.207   32.381   35.905
LGA    A   193_B      A   193_B     6.051     0    0.070   0.066    10.494   14.762   18.095
LGA    E   194_B      E   194_B    11.676     0    0.118   1.445    15.384    0.714    0.317
LGA    A   195_B      A   195_B    12.897     0    0.063   0.063    16.374    0.000    0.000
LGA    A   196_B      A   196_B    14.665     0    0.022   0.043    19.189    0.000    0.000
LGA    L   197_B      L   197_B    18.354     0    0.050   0.919    22.859    0.000    0.000
LGA    R   198_B      R   198_B    22.071     0    0.038   1.623    25.858    0.000    0.000
LGA    R   199_B      R   199_B    23.408     0    0.084   0.586    27.808    0.000    0.000
LGA    K   200_B      K   200_B    26.848     0    0.376   1.015    30.925    0.000    0.000
LGA    V   201_B      V   201_B    28.778     0    0.078   0.207    32.387    0.000    0.000
LGA    G   202_B      G   202_B    30.508     0    0.174   0.174    31.708    0.000    0.000
LGA    S   203_B      S   203_B    30.442     1    0.446   0.549    30.442    0.000    0.000
LGA    L   204_B      L   204_B    30.946     3    0.225   0.223    32.540    0.000    0.000
LGA    E   205_B      E   205_B    27.468     4    0.617   0.641    28.666    0.000    0.000
LGA    S   206_B      S   206_B    24.227     1    0.612   0.550    25.744    0.000    0.000
LGA    S   207_B      S   207_B    25.116     0    0.087   0.673    28.210    0.000    0.000
LGA    G   208_B      G   208_B    20.621     0    0.588   0.588    22.264    0.000    0.000
LGA    L   209_B      L   209_B    18.843     3    0.257   0.260    20.307    0.000    0.000
LGA    E   210_B      E   210_B    19.548     4    0.511   0.475    21.047    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):    21.881         21.815                 22.054           10.932    9.499

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  214  207    4.0     33    2.81    16.667    14.192     1.136

LGA_LOCAL      RMSD:   2.805  Number of atoms:   33  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  25.038  Number of assigned atoms:  207 
Std_ASGN_ATOMS RMSD:  21.881  Standard rmsd on all 207 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.423679 * X  +   0.145363 * Y  +  -0.894073 * Z  +  22.713234
  Y_new =   0.886767 * X  +  -0.267905 * Y  +   0.376659 * Z  + -25.974871
  Z_new =  -0.184774 * X  +  -0.952416 * Y  +  -0.242409 * Z  +  33.590160 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  1.125083  0.185842 -1.820024   [DEG:   64.4625   10.6480 -104.2797 ]
ZXZ: -1.969516  1.815644 -2.949967   [DEG: -112.8449  104.0287 -169.0207 ]
 
# END of job
