
#######################################################
#                                                     #
#                        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  194 ( 1593),  selected  192 , name one
# Molecule2: number of CA atoms  192 ( 1575),  selected  192 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:D  -ch2:D  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    51      20_D - 70_D        4.92    34.72
  LCS_AVERAGE:     15.24

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    23      28_D - 50_D        1.90    32.89
  LCS_AVERAGE:      5.43

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    19      51_D - 69_D        0.80    38.61
  LCS_AVERAGE:      3.67

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  192
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     M     1_D     M     1_D      3    3   13      0    3    3    6    6    8   11   11   12   13   14   17   18   19   21   24   25   26   31   33 
LCS_GDT     N     2_D     N     2_D      3    5   13      1    3    4    4    5    6    7    8   11   13   14   17   18   19   21   24   25   26   27   37 
LCS_GDT     S     3_D     S     3_D      3    5   13      3    3    3    4    5    6    6    8    8   11   11   11   16   17   18   20   25   25   27   29 
LCS_GDT     I     4_D     I     4_D      3    5   13      3    3    4    5    6    7    7    8    9   11   11   13   14   16   18   21   23   26   31   32 
LCS_GDT     T     5_D     T     5_D      3    5   13      3    3    4    4    5    6    6    8    9   11   12   13   14   16   18   21   23   26   31   32 
LCS_GDT     H     6_D     H     6_D      3    5   13      3    3    4    4    5    6    6    8    8   11   11   11   13   16   18   18   18   20   21   22 
LCS_GDT     A     7_D     A     7_D      3    5   13      3    3    3    4    5    6    6    8    8   11   11   11   12   16   18   18   18   20   21   22 
LCS_GDT     E     8_D     E     8_D      3    5   14      3    3    3    4    5    6    6    8    8    9    9    9   12   15   18   18   18   19   20   21 
LCS_GDT     F     9_D     F     9_D      3    5   14      3    4    4    4    4    5    6    8    8   11   11   11   13   17   20   22   26   28   31   37 
LCS_GDT     E    10_D     E    10_D      3    3   14      3    4    4    4    4    5    6    6    9   11   12   13   14   16   18   21   26   28   31   32 
LCS_GDT     F    11_D     F    11_D      3    3   14      3    4    4    4    4    5    5    6    8   11   12   13   14   16   20   23   26   28   31   37 
LCS_GDT     S    12_D     S    12_D      3    3   14      3    3    3    3    4    4    5    7    9   13   15   17   19   21   23   29   33   41   44   46 
LCS_GDT     L    13_D     L    13_D      3    3   14      3    3    3    3    4    5    8   11   11   13   14   16   19   26   29   32   38   41   44   46 
LCS_GDT     L    14_D     L    14_D      3    3   14      3    3    3    3    6    7    8   10   10   12   14   16   19   26   29   32   38   41   44   49 
LCS_GDT     E    15_D     E    15_D      3    8   14      3    3    4    7    8    8    9   10   10   12   14   15   19   26   29   32   38   41   44   49 
LCS_GDT     N    16_D     N    16_D      5    8   14      3    4    6    7    8    8    9   10   12   14   15   17   19   26   29   32   38   41   44   49 
LCS_GDT     V    17_D     V    17_D      5    8   14      4    4    6    7    8    8    9   10   12   14   15   17   19   26   29   32   38   41   44   49 
LCS_GDT     K    18_D     K    18_D      5    8   25      4    4    6    7    8    8    9   10   12   14   15   17   19   20   26   32   38   41   45   51 
LCS_GDT     Y    19_D     Y    19_D      5    8   50      4    4    5    7    8    8    9   10   11   12   15   18   25   32   40   44   48   49   50   51 
LCS_GDT     E    20_D     E    20_D      5    8   51      4    4    6    7    8    8    9   12   20   27   33   40   45   46   47   49   49   51   51   51 
LCS_GDT     T    21_D     T    21_D      3    8   51      3    4    6    7    8   12   17   27   32   38   41   43   45   47   48   50   50   51   51   51 
LCS_GDT     E    22_D     E    22_D      3    8   51      3    3   12   20   23   24   26   31   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     D    23_D     D    23_D      3    8   51      3    3    5    6    7   12   19   29   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     E    24_D     E    24_D      3    5   51      3    3    3    4    7   16   22   31   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     V    25_D     V    25_D      3    8   51      3    4    9   13   19   22   26   31   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     P    26_D     P    26_D      7    9   51      4    4    7    7    7    9   11   15   27   30   37   44   46   48   49   50   50   51   51   51 
LCS_GDT     I    27_D     I    27_D      7   20   51      4    4    7   12   16   19   24   31   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     V    28_D     V    28_D      7   23   51      5    5    7   12   19   21   25   31   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     L    29_D     L    29_D      7   23   51      5    6   13   16   20   24   26   31   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     E    30_D     E    30_D      7   23   51      5    5   12   20   23   24   26   31   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     Y    31_D     Y    31_D     16   23   51     15   15   16   19   23   24   26   31   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     K    32_D     K    32_D     16   23   51     15   15   16   19   23   24   26   30   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     E    33_D     E    33_D     16   23   51     15   15   16   19   20   24   26   30   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     E    34_D     E    34_D     16   23   51     15   15   16   19   20   22   26   31   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     I    35_D     I    35_D     16   23   51     15   15   16   19   20   22   26   31   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     I    36_D     I    36_D     16   23   51     15   15   16   19   20   22   26   31   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     N    37_D     N    37_D     16   23   51     15   15   16   19   20   22   26   31   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     L    38_D     L    38_D     16   23   51     15   15   16   19   20   22   26   31   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     I    39_D     I    39_D     16   23   51     15   15   16   19   20   22   26   31   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     K    40_D     K    40_D     16   23   51     15   15   16   19   20   22   26   31   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     K    41_D     K    41_D     16   23   51     15   15   16   19   20   22   26   31   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     F    42_D     F    42_D     16   23   51     15   15   16   19   20   22   26   31   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     S    43_D     S    43_D     16   23   51     15   15   16   19   20   22   26   31   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     N    44_D     N    44_D     16   23   51     15   15   16   19   20   22   26   31   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     S    45_D     S    45_D     16   23   51     15   15   16   19   20   22   26   31   36   39   40   44   46   48   49   50   50   51   51   51 
LCS_GDT     G    46_D     G    46_D     16   23   51      3   12   16   19   20   22   26   31   36   39   40   42   46   48   49   50   50   51   51   51 
LCS_GDT     Q    47_D     Q    47_D      4   23   51      3    3    4   10   17   22   26   31   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     S    48_D     S    48_D      4   23   51      3   14   16   19   20   22   26   30   34   39   40   44   46   48   49   50   50   51   51   51 
LCS_GDT     G    49_D     G    49_D      3   23   51      3    3    3   18   19   21   24   25   28   33   37   41   45   48   49   50   50   51   51   51 
LCS_GDT     M    50_D     M    50_D      3   23   51      3    9   16   19   20   22   26   31   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     S    51_D     S    51_D     19   20   51      6   10   18   19   23   24   26   31   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     A    52_D     A    52_D     19   20   51      6   18   18   20   23   24   26   29   33   36   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     P    53_D     P    53_D     19   20   51      6   18   18   20   23   24   26   29   33   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     I    54_D     I    54_D     19   20   51     15   18   18   20   23   24   26   31   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     T    55_D     T    55_D     19   20   51     10   18   18   20   23   24   26   31   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     A    56_D     A    56_D     19   20   51     15   18   18   20   23   24   26   31   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     S    57_D     S    57_D     19   20   51     15   18   18   20   23   24   26   31   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     I    58_D     I    58_D     19   20   51     15   18   18   20   23   24   26   31   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     I    59_D     I    59_D     19   20   51     15   18   18   20   23   24   26   31   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     T    60_D     T    60_D     19   20   51     15   18   18   20   23   24   26   31   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     N    61_D     N    61_D     19   20   51     15   18   18   20   23   24   26   30   36   39   41   44   46   48   49   50   50   51   52   55 
LCS_GDT     C    62_D     C    62_D     19   20   51     15   18   18   20   23   24   26   29   34   39   41   44   46   48   49   50   50   51   52   55 
LCS_GDT     I    63_D     I    63_D     19   20   51     15   18   18   20   23   24   26   30   36   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     K    64_D     K    64_D     19   20   51     15   18   18   20   23   24   26   30   35   39   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     N    65_D     N    65_D     19   20   51     15   18   18   20   23   24   26   29   33   37   41   44   46   48   49   50   50   51   52   55 
LCS_GDT     L    66_D     L    66_D     19   20   51     15   18   18   20   23   24   26   29   33   36   38   44   46   48   49   50   50   51   52   55 
LCS_GDT     M    67_D     M    67_D     19   20   51     15   18   18   20   23   24   26   29   33   38   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     A    68_D     A    68_D     19   20   51     15   18   18   20   23   24   26   29   33   36   41   44   46   48   49   50   50   51   51   51 
LCS_GDT     F    69_D     F    69_D     19   20   51     15   18   18   20   23   24   26   28   33   35   38   41   45   48   49   50   50   51   51   51 
LCS_GDT     K    70_D     K    70_D      3   20   51      3    3    4    5    8   12   14   20   21   21   22   37   40   44   49   50   50   51   52   55 
LCS_GDT     P    71_D     P    71_D      3    7   50      3    3    3    4    8   12   14   20   21   21   27   32   35   38   43   46   49   51   52   55 
LCS_GDT     I    72_D     I    72_D      3    7   25      3    3    3    4    7    9   13   14   18   21   24   30   33   35   40   43   45   46   50   54 
LCS_GDT     G    73_D     G    73_D      3    7   25      3    3    5    5    7    9   10   15   17   23   23   26   30   35   39   43   44   46   50   52 
LCS_GDT     P    74_D     P    74_D      3    7   19      3    3    4    5    7    9   13   15   19   23   23   27   30   35   39   43   44   46   50   52 
LCS_GDT     L    75_D     L    75_D      3    7   18      3    3    4    7    8    9   13   17   20   23   28   32   35   38   43   46   49   51   52   55 
LCS_GDT     V    76_D     V    76_D      4    7   18      3    4    5    6    8   10   13   17   20   24   28   32   35   38   43   46   49   51   52   55 
LCS_GDT     G    77_D     G    77_D      4    7   18      3    4    5    7   10   12   15   19   21   24   27   32   35   38   43   46   49   51   52   55 
LCS_GDT     N    78_D     N    78_D      4    7   18      3    4    5    5    7    9   10   11   12   16   19   22   24   29   33   36   42   46   50   54 
LCS_GDT     E    79_D     E    79_D      4    7   18      3    4    5    5    7    9   10   11   12   16   19   22   24   27   29   32   35   40   42   47 
LCS_GDT     E    80_D     E    80_D      3    7   18      3    3    3    4    7    9   10   11   12   16   19   22   24   27   30   36   39   41   46   47 
LCS_GDT     E    81_D     E    81_D      4    4   18      3    4    4    5    5    6    7   10   12   16   18   22   24   27   31   36   39   43   46   49 
LCS_GDT     W    82_D     W    82_D      4    4   18      3    4    4    5    5    6    9   12   15   16   19   22   24   30   34   36   39   43   46   49 
LCS_GDT     N    83_D     N    83_D      4    5   18      4    5    5    5    5    7   12   14   18   20   24   28   30   32   34   36   39   43   46   49 
LCS_GDT     Y    84_D     Y    84_D      4    5   18      4    5    5    5    6    7    9   13   17   20   24   28   30   32   34   36   39   43   46   49 
LCS_GDT     N    85_D     N    85_D      4    5   18      4    5    5    5    7    9   12   14   18   20   24   28   30   32   34   36   39   43   46   49 
LCS_GDT     S    86_D     S    86_D      4    5   18      4    5    5    7    9   10   10   14   18   20   24   28   30   32   34   36   39   43   46   49 
LCS_GDT     D    87_D     D    87_D      3    5   18      3    3    4    4    5    7    9   12   18   20   23   28   30   32   33   36   39   43   46   49 
LCS_GDT     D    88_D     D    88_D      3    4   18      3    3    4    4    5    7   10   12   18   20   24   28   30   32   34   36   39   43   46   49 
LCS_GDT     S    89_D     S    89_D      3    5   18      3    3    4    4    7    9   12   14   18   20   24   28   30   32   34   36   39   43   46   49 
LCS_GDT     F    90_D     F    90_D      3    5   18      3    3    4    4    5    8   11   14   18   20   24   28   30   32   34   36   39   43   46   49 
LCS_GDT     Q    91_D     Q    91_D      3    5   18      3    3    4    5    7    9   12   14   18   20   24   28   30   32   34   36   39   43   46   49 
LCS_GDT     N    92_D     N    92_D      4    5   17      4    4    5    5    5    7   10   14   18   20   24   28   30   32   34   36   39   43   46   49 
LCS_GDT     N    93_D     N    93_D      4    5   19      4    4    5    5    7    7   10   14   17   19   24   28   30   32   34   35   39   43   44   49 
LCS_GDT     R    94_D     R    94_D      4    5   27      4    4    5    5    5    7    8   13   17   19   24   28   30   32   34   36   39   43   46   49 
LCS_GDT     L    95_D     L    95_D      4    5   27      4    4    5    5    5    7   11   15   21   25   27   28   30   32   35   36   39   43   47   51 
LCS_GDT     S    96_D     S    96_D      3    6   27      2    3    4    7    8   10   17   19   24   26   27   28   30   32   35   36   41   45   47   51 
LCS_GDT     A    97_D     A    97_D      5    8   27      1    4    5    6   10   15   17   23   24   26   27   28   31   35   39   41   49   51   52   55 
LCS_GDT     V    98_D     V    98_D      5   11   27      3    4    6    8   13   15   17   23   24   26   27   32   35   38   43   46   49   51   52   55 
LCS_GDT     F    99_D     F    99_D      5   11   27      3    4    6    8   13   15   17   23   24   26   28   32   35   38   43   46   49   51   52   55 
LCS_GDT     K   100_D     K   100_D      5   11   27      3    4    6    8   13   15   17   23   24   26   28   32   35   38   43   46   49   51   52   55 
LCS_GDT     T   101_D     T   101_D      5   11   27      3    4    6    8   12   15   17   23   24   26   27   28   29   38   43   46   49   51   52   55 
LCS_GDT     G   102_D     G   102_D      5   11   27      3    4    6    8   13   15   17   23   24   26   27   29   35   38   43   46   49   51   52   55 
LCS_GDT     L   103_D     L   103_D      5   11   27      3    4    6    7   10   14   17   23   24   26   28   32   35   38   43   46   49   51   52   55 
LCS_GDT     N   104_D     N   104_D      5   11   27      3    3    6    8   13   15   17   23   24   26   28   32   35   38   43   46   49   51   52   55 
LCS_GDT     G   105_D     G   105_D      7   11   27      3    7    8    9   13   15   17   23   24   26   28   32   35   38   43   46   49   51   52   55 
LCS_GDT     K   106_D     K   106_D      7   11   27      3    7    8    9   13   15   17   23   24   26   28   32   35   38   43   46   49   51   52   55 
LCS_GDT     P   107_D     P   107_D      7   11   27      3    7    8    9   13   15   17   23   24   26   28   32   35   38   43   46   49   51   52   55 
LCS_GDT     Y   108_D     Y   108_D      7   11   27      3    7    8    9   13   15   17   23   24   26   28   32   35   38   43   46   49   51   52   55 
LCS_GDT     Y   109_D     Y   109_D      7    9   27      3    7    8    9   13   15   17   23   24   26   28   32   35   38   43   46   49   51   52   55 
LCS_GDT     L   110_D     L   110_D      7    9   27      3    7    8    9   13   15   17   23   24   26   28   32   35   38   43   46   49   51   52   55 
LCS_GDT     D   111_D     D   111_D      7    9   27      3    7    8    9   13   15   17   23   24   26   28   32   35   38   43   46   49   51   52   55 
LCS_GDT     A   112_D     A   112_D      5    7   27      4    5    5    7    8   10   16   23   24   26   28   32   35   38   43   46   49   51   52   55 
LCS_GDT     I   113_D     I   113_D      6    7   27      4    5    6    7    8   12   17   23   24   26   28   32   35   38   43   46   49   51   52   55 
LCS_GDT     T   114_D     T   114_D      6    7   27      4    5    6    7    8   12   17   23   24   26   28   32   35   38   43   46   49   51   52   55 
LCS_GDT     F   115_D     F   115_D      6    7   27      4    5    6    7    8   12   17   23   24   26   27   28   32   37   42   43   46   49   52   55 
LCS_GDT     V   116_D     V   116_D      6    7   27      3    5    6    7    8   12   16   23   24   26   27   28   32   37   42   43   46   49   52   55 
LCS_GDT     G   117_D     G   117_D      6    7   27      4    5    6    7    8   12   17   23   24   26   27   28   29   30   31   36   39   41   48   51 
LCS_GDT     E   118_D     E   118_D      6    7   27      4    5    6    7    8   12   17   23   24   26   27   28   29   30   32   37   39   46   48   52 
LCS_GDT     E   119_D     E   119_D      5    6   27      4    5    5    9   11   15   17   20   24   26   28   32   35   38   42   46   49   51   52   55 
LCS_GDT     E   120_D     E   120_D      5    8   27      4    5    8    8   10   12   14   17   20   23   28   32   35   38   43   46   49   51   52   55 
LCS_GDT     Y   121_D     Y   121_D      5    8   27      3    5    5    7    8   10   17   20   21   23   28   32   35   38   43   46   49   51   52   55 
LCS_GDT     D   122_D     D   122_D      5    8   26      3    4    5    7    8   15   17   20   21   23   28   32   35   38   43   46   49   51   52   55 
LCS_GDT     T   123_D     T   123_D      5    8   25      3    4    5    7   10   15   17   20   21   23   28   32   35   38   43   46   49   51   52   55 
LCS_GDT     F   124_D     F   124_D      5    8   25      3    4    5    7    8   12   15   19   21   24   26   29   33   36   43   46   49   51   52   55 
LCS_GDT     H   125_D     H   125_D      4    8   25      4    4    5    7    8   12   15   19   21   24   28   32   35   38   43   46   49   51   52   55 
LCS_GDT     G   126_D     G   126_D      4    8   25      4    4    5    7    8    9   13   17   19   24   28   30   34   38   43   46   49   51   52   55 
LCS_GDT     H   127_D     H   127_D      4    8   25      4    4    5    7    8    9   11   17   20   24   28   31   35   38   43   46   49   51   52   55 
LCS_GDT     V   128_D     V   128_D      4    8   18      4    4    4    7    8   11   14   19   20   24   27   32   35   38   43   46   49   51   52   55 
LCS_GDT     E   129_D     E   129_D      4    8   18      3    4    5    7    8   10   13   16   19   24   27   32   35   38   43   46   49   51   52   55 
LCS_GDT     G   130_D     G   130_D      4    8   18      3    4    5    7    8   10   11   14   18   24   28   32   35   38   43   46   49   51   52   55 
LCS_GDT     I   131_D     I   131_D      4    8   18      3    4    5    7   10   12   15   20   21   24   27   32   35   38   43   46   49   51   52   55 
LCS_GDT     S   132_D     S   132_D      4    8   18      3    4    5    7    8   11   14   19   21   24   26   28   33   36   43   46   49   51   52   55 
LCS_GDT     S   133_D     S   133_D      6    8   18      4    5    6    7    8   10   11   13   17   22   23   26   31   35   37   38   49   51   52   55 
LCS_GDT     R   134_D     R   134_D      6    8   18      4    4    8    8    8   11   15   20   21   24   27   32   35   38   43   46   49   51   52   55 
LCS_GDT     Q   135_D     Q   135_D      6    8   18      4    5    7    9   13   15   17   23   24   26   28   32   35   38   43   46   49   51   52   55 
LCS_GDT     Y   136_D     Y   136_D      6    8   18      4    5    6    7    8   11   15   21   24   26   27   28   30   32   36   40   45   46   50   55 
LCS_GDT     L   137_D     L   137_D      6    8   15      4    5    6    7    7    9   12   14   18   20   24   28   30   32   34   36   39   43   46   49 
LCS_GDT     K   138_D     K   138_D      6    8   15      4    5    6    7    8   10   11   13   15   17   19   24   28   30   33   36   39   42   46   49 
LCS_GDT     G   139_D     G   139_D      5    8   15      3    4    6    7    7    9   12   14   18   20   23   27   30   32   34   36   39   43   46   49 
LCS_GDT     F   140_D     F   140_D      4    8   15      3    3    4    5    7    8   12   14   18   20   24   28   30   32   34   36   39   43   46   49 
LCS_GDT     P   141_D     P   141_D      4    7   15      3    3    4    4    7    8   10   13   18   20   24   28   30   32   34   36   39   43   44   49 
LCS_GDT     F   142_D     F   142_D      4    5   15      3    4    4    5    5    6    7    8    9   12   16   20   22   25   28   32   34   42   44   45 
LCS_GDT     F   143_D     F   143_D      4    5   22      3    4    4    5    5    6    7    8   10   12   16   16   20   22   25   26   28   31   35   38 
LCS_GDT     P   144_D     P   144_D      4    5   22      3    4    4    5    5    6    7    8   10   12   16   16   19   22   25   26   28   31   34   38 
LCS_GDT     K   145_D     K   145_D      4    5   22      3    4    4    5    5    8   10   11   11   15   17   19   22   23   25   26   28   31   34   38 
LCS_GDT     T   146_D     T   146_D      4    8   22      4    4    4    5    8    9    9   11   11   15   18   19   22   23   24   26   28   31   34   39 
LCS_GDT     F   147_D     F   147_D      4    8   22      4    4    4    5    8    9   11   14   15   16   18   19   22   23   25   28   31   36   42   49 
LCS_GDT     Y   148_D     Y   148_D      5    8   22      4    5    6    7    8    9   11   14   15   17   18   22   24   25   28   30   34   39   42   45 
LCS_GDT     I   149_D     I   149_D      6    8   22      4    5    6    7    8   10   11   14   15   17   19   19   23   25   25   28   31   39   42   47 
LCS_GDT     N   150_D     N   150_D      6    8   22      4    5    6    7    8   10   11   14   15   17   18   19   22   23   25   28   29   36   43   45 
LCS_GDT     V   151_D     V   151_D      6    8   22      4    5    6    7    8   10   11   14   15   17   18   19   22   23   25   27   29   31   37   44 
LCS_GDT     Y   152_D     Y   152_D      6    8   22      4    5    6    7    8   10   11   14   15   17   18   19   22   23   25   27   29   30   35   38 
LCS_GDT     K   153_D     K   153_D      6    8   22      3    4    6    7    8   10   11   14   15   17   18   19   22   23   25   26   28   30   33   34 
LCS_GDT     D   154_D     D   154_D      6    8   22      3    4    6    7    8    9   11   14   15   17   18   19   22   23   25   26   28   30   31   34 
LCS_GDT     F   155_D     F   155_D      4    7   22      3    3    4    4    7   10   11   14   15   17   18   19   22   23   25   26   28   30   30   34 
LCS_GDT     E   156_D     E   156_D      4    7   22      3    4    4    5    7    9   10   10   12   16   18   19   21   23   24   24   28   30   30   32 
LCS_GDT     N   157_D     N   157_D      5    7   22      3    4    5    5    7   10   11   14   15   17   18   19   22   23   25   26   28   30   35   38 
LCS_GDT     K   158_D     K   158_D      5    7   22      3    4    5    6    7   10   11   14   15   17   18   19   22   24   30   33   37   41   46   51 
LCS_GDT     D   159_D     D   159_D      5    7   22      3    4    5    6    7   10   11   14   15   19   23   26   27   32   34   40   46   48   51   55 
LCS_GDT     E   160_D     E   160_D      5    7   22      3    4    5    6    7   10   11   14   15   17   25   30   35   38   43   46   49   51   52   55 
LCS_GDT     N   161_D     N   161_D      5    7   22      1    4    5    5    7    9   11   14   15   17   20   26   34   37   42   46   49   51   52   55 
LCS_GDT     N   162_D     N   162_D      3    7   22      3    3    4    4    7    7   11   17   20   21   28   32   35   38   43   46   49   51   52   55 
LCS_GDT     L   163_D     L   163_D      5    6   22      3    4    5    6    7    8    9   10   16   18   28   30   33   38   43   46   49   51   52   55 
LCS_GDT     C   164_D     C   164_D      5    6   22      4    4    5    6    7    8   11   14   15   17   18   19   22   37   43   46   49   51   52   55 
LCS_GDT     S   165_D     S   165_D      5    6   22      4    4    5    6    7    7    9   10   12   16   18   19   22   23   24   25   28   51   52   55 
LCS_GDT     G   166_D     G   166_D      5    6   14      4    4    5    6    7    7    8   10   11   12   14   17   19   20   21   24   28   51   52   55 
LCS_GDT     D   167_D     D   167_D      5    6   14      4    4    5    6    7    7    8    9   11   12   14   17   19   20   21   24   28   30   34   36 
LCS_GDT     D   168_D     D   168_D      5    6   14      3    4    6    7    8    8    8   10   11   12   14   17   19   20   21   24   25   25   28   36 
LCS_GDT     G   169_D     G   169_D      4    6   14      3    4    4    6    6    7    8    9    9   10   14   17   19   20   21   24   25   27   33   38 
LCS_GDT     E   170_D     E   170_D      4    6   23      3    4    4    6    6    7    8    9    9    9   11   14   16   27   29   34   37   41   46   51 
LCS_GDT     Y   171_D     Y   171_D      4    6   23      3    4    4    6   10   14   17   20   22   25   26   28   29   30   35   36   39   41   46   51 
LCS_GDT     T   172_D     T   172_D      3    6   23      3    3    3    6    7   15   17   18   22   25   26   28   29   30   35   36   39   40   45   47 
LCS_GDT     Y   173_D     Y   173_D      3    7   23      3    3    3    4    6    7   11   15   17   20   22   22   28   30   35   36   39   40   44   47 
LCS_GDT     R   174_D     R   174_D      4    7   23      3    4    6    6    6    6    7   11   13   18   22   25   28   30   35   36   39   40   44   47 
LCS_GDT     I   175_D     I   175_D      4    7   23      3    4    6    6    6    6    8   10   13   18   22   24   28   30   35   36   39   40   44   47 
LCS_GDT     K   176_D     K   176_D      4    7   23      3    4    6    6    6    9   11   14   15   17   22   24   27   30   35   36   39   40   44   49 
LCS_GDT     Y   177_D     Y   177_D      4    7   23      3    4    6    6    6    9   11   13   15   17   22   24   27   30   35   36   39   41   44   49 
LCS_GDT     P   178_D     P   178_D      4    7   23      3    3    6    6    6    9   11   13   15   18   22   25   28   30   35   36   39   42   44   47 
LCS_GDT     E   179_D     E   179_D      4    7   23      1    3    6    6    7    9   11   13   16   19   21   24   27   31   34   35   39   42   44   49 
LCS_GDT     Q   180_D     Q   180_D      9   10   23      4    7    9    9    9   10   11   13   17   19   24   28   30   32   34   36   39   43   46   49 
LCS_GDT     L   181_D     L   181_D      9   10   23      4    8    9    9    9   10   11   14   17   19   23   28   30   32   34   36   39   43   46   49 
LCS_GDT     E   182_D     E   182_D      9   10   23      5    8    9    9    9   10   11   14   16   17   21   25   28   30   35   36   39   43   46   49 
LCS_GDT     E   183_D     E   183_D      9   10   23      5    8    9    9    9   10   11   14   16   17   18   25   28   30   35   36   37   43   46   49 
LCS_GDT     V   184_D     V   184_D      9   10   23      5    8    9    9    9   10   11   14   16   18   22   25   28   30   35   36   39   43   46   49 
LCS_GDT     F   185_D     F   185_D      9   10   23      5    8    9    9    9   10   11   14   16   18   22   25   28   30   35   36   39   43   46   49 
LCS_GDT     N   186_D     N   186_D      9   10   23      5    8    9    9    9   10   11   14   16   17   18   25   28   30   35   36   39   40   44   47 
LCS_GDT     Y   187_D     Y   187_D      9   10   23      4    8    9    9    9   10   11   14   16   17   18   21   22   22   29   31   34   40   44   47 
LCS_GDT     Y   188_D     Y   188_D      9   10   23      4    8    9    9    9   10   11   13   15   17   18   21   22   25   28   33   37   43   44   48 
LCS_GDT     D   189_D     D   189_D      4   10   23      1    3    6    8    9   10   11   14   16   17   18   21   22   22   24   27   29   43   44   48 
LCS_GDT     K   190_D     K   190_D      3    3   23      3    3    3    3    5    5   11   14   16   17   18   21   22   22   24   27   29   35   44   49 
LCS_GDT     F   191_D     F   191_D      3    3   23      3    3    3    5    7    8   11   14   16   17   18   21   22   26   31   33   34   38   44   49 
LCS_GDT     T   192_D     T   192_D      3    3   23      3    3    3    3    5    5   11   13   16   17   19   27   30   32   34   35   39   43   46   49 
LCS_AVERAGE  LCS_A:   8.11  (   3.67    5.43   15.24 )

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     15     18     18     20     23     24     26     31     36     39     41     44     46     48     49     50     50     51     52     55 
GDT PERCENT_AT   7.81   9.38   9.38  10.42  11.98  12.50  13.54  16.15  18.75  20.31  21.35  22.92  23.96  25.00  25.52  26.04  26.04  26.56  27.08  28.65
GDT RMS_LOCAL    0.26   0.64   0.64   1.13   1.41   1.62   1.91   2.87   3.21   3.41   3.79   4.05   4.18   4.43   4.66   4.73   4.73   4.92   5.98   6.32
GDT RMS_ALL_AT  36.38  38.60  38.60  37.31  37.38  37.10  37.13  31.11  31.68  32.04  33.72  33.75  33.46  33.89  34.26  34.45  34.45  34.72  31.98  31.96

# Checking swapping
#   possible swapping detected:  E    10_D      E    10_D
#   possible swapping detected:  E    15_D      E    15_D
#   possible swapping detected:  Y    19_D      Y    19_D
#   possible swapping detected:  D    23_D      D    23_D
#   possible swapping detected:  Y    31_D      Y    31_D
#   possible swapping detected:  E    34_D      E    34_D
#   possible swapping detected:  E    79_D      E    79_D
#   possible swapping detected:  E    81_D      E    81_D
#   possible swapping detected:  D    88_D      D    88_D
#   possible swapping detected:  F    90_D      F    90_D
#   possible swapping detected:  Y   108_D      Y   108_D
#   possible swapping detected:  D   111_D      D   111_D
#   possible swapping detected:  F   124_D      F   124_D
#   possible swapping detected:  E   129_D      E   129_D
#   possible swapping detected:  Y   136_D      Y   136_D
#   possible swapping detected:  F   142_D      F   142_D
#   possible swapping detected:  Y   148_D      Y   148_D
#   possible swapping detected:  D   154_D      D   154_D
#   possible swapping detected:  F   155_D      F   155_D
#   possible swapping detected:  E   156_D      E   156_D
#   possible swapping detected:  E   160_D      E   160_D
#   possible swapping detected:  Y   173_D      Y   173_D
#   possible swapping detected:  Y   177_D      Y   177_D
#   possible swapping detected:  E   179_D      E   179_D
#   possible swapping detected:  E   182_D      E   182_D
#   possible swapping detected:  E   183_D      E   183_D
#   possible swapping detected:  Y   187_D      Y   187_D
#   possible swapping detected:  Y   188_D      Y   188_D
#   possible swapping detected:  F   191_D      F   191_D

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    M     1_D      M     1_D    55.352     0    0.498   1.075    57.155    0.000    0.000
LGA    N     2_D      N     2_D    57.526     0    0.678   1.282    59.219    0.000    0.000
LGA    S     3_D      S     3_D    58.193     0    0.703   0.856    62.046    0.000    0.000
LGA    I     4_D      I     4_D    55.105     0    0.585   1.401    56.121    0.000    0.000
LGA    T     5_D      T     5_D    58.406     0    0.586   0.933    61.810    0.000    0.000
LGA    H     6_D      H     6_D    60.911     0    0.554   0.624    64.754    0.000    0.000
LGA    A     7_D      A     7_D    57.246     0    0.644   0.628    58.392    0.000    0.000
LGA    E     8_D      E     8_D    51.719     0    0.636   1.142    54.243    0.000    0.000
LGA    F     9_D      F     9_D    49.656     0    0.639   0.622    51.210    0.000    0.000
LGA    E    10_D      E    10_D    46.220     0    0.623   1.275    47.613    0.000    0.000
LGA    F    11_D      F    11_D    41.222     0    0.643   1.432    43.117    0.000    0.000
LGA    S    12_D      S    12_D    36.318     0    0.661   0.780    38.492    0.000    0.000
LGA    L    13_D      L    13_D    35.203     0    0.631   0.658    37.831    0.000    0.000
LGA    L    14_D      L    14_D    30.148     0    0.646   0.549    32.446    0.000    0.000
LGA    E    15_D      E    15_D    25.227     0    0.665   1.153    27.393    0.000    0.000
LGA    N    16_D      N    16_D    26.608     0    0.607   1.167    31.904    0.000    0.000
LGA    V    17_D      V    17_D    22.157     0    0.097   0.968    23.730    0.000    0.000
LGA    K    18_D      K    18_D    19.331     0    0.135   1.012    22.282    0.000    0.000
LGA    Y    19_D      Y    19_D    16.554     0    0.050   1.285    20.634    0.000    0.000
LGA    E    20_D      E    20_D    13.528     0    0.654   1.503    16.539    0.119    0.053
LGA    T    21_D      T    21_D     9.453     0    0.090   1.134    12.130    2.857    1.633
LGA    E    22_D      E    22_D     3.801     0    0.658   1.273     9.000   40.714   29.735
LGA    D    23_D      D    23_D     5.058     0    0.396   1.147     8.733   28.214   16.310
LGA    E    24_D      E    24_D     4.425     0    0.181   0.737     7.832   40.357   27.989
LGA    V    25_D      V    25_D     1.394     0    0.602   0.574     4.349   60.357   59.048
LGA    P    26_D      P    26_D     6.438     0    0.627   0.613     8.541   27.976   20.136
LGA    I    27_D      I    27_D     4.251     0    0.057   1.397     6.155   44.524   39.167
LGA    V    28_D      V    28_D     3.208     0    0.106   0.244     6.018   55.476   43.129
LGA    L    29_D      L    29_D     2.030     0    0.087   0.263     2.757   62.857   62.857
LGA    E    30_D      E    30_D     2.837     0    0.085   0.835     8.052   59.167   39.471
LGA    Y    31_D      Y    31_D     2.551     0    0.325   1.498     8.068   61.071   41.270
LGA    K    32_D      K    32_D     3.998     0    0.044   0.735     9.536   43.333   27.196
LGA    E    33_D      E    33_D     4.488     0    0.027   0.816     9.087   40.238   24.974
LGA    E    34_D      E    34_D     2.927     0    0.035   1.087     4.489   61.190   52.169
LGA    I    35_D      I    35_D     1.270     0    0.029   1.202     3.272   79.286   71.190
LGA    I    36_D      I    36_D     2.512     0    0.038   1.008     3.335   62.857   58.214
LGA    N    37_D      N    37_D     2.348     0    0.038   1.045     4.094   68.810   60.476
LGA    L    38_D      L    38_D     1.160     0    0.030   1.148     4.211   83.690   76.071
LGA    I    39_D      I    39_D     1.629     0    0.037   0.118     3.080   79.405   69.286
LGA    K    40_D      K    40_D     1.607     0    0.060   0.825     3.624   81.548   67.460
LGA    K    41_D      K    41_D     1.744     0    0.033   0.815     7.996   72.976   51.587
LGA    F    42_D      F    42_D     2.252     0    0.026   0.281     5.567   64.881   47.229
LGA    S    43_D      S    43_D     1.898     0    0.163   0.660     2.554   68.929   68.889
LGA    N    44_D      N    44_D     1.141     0    0.277   0.547     2.827   83.690   77.381
LGA    S    45_D      S    45_D     2.921     0    0.343   0.763     5.538   55.595   48.968
LGA    G    46_D      G    46_D     3.212     0    0.488   0.488     4.076   50.357   50.357
LGA    Q    47_D      Q    47_D     3.217     0    0.584   0.949    10.338   59.286   30.952
LGA    S    48_D      S    48_D     4.513     0    0.209   0.579     6.445   26.786   27.460
LGA    G    49_D      G    49_D     6.806     0    0.483   0.483     7.331   15.476   15.476
LGA    M    50_D      M    50_D     4.067     0    0.575   1.379     9.517   57.857   34.762
LGA    S    51_D      S    51_D     4.081     0    0.656   0.896     8.154   43.690   32.143
LGA    A    52_D      A    52_D     5.970     0    0.040   0.043     7.400   25.000   22.000
LGA    P    53_D      P    53_D     5.042     0    0.106   0.179     6.477   36.429   29.388
LGA    I    54_D      I    54_D     2.294     0    0.085   1.079     3.332   63.095   67.143
LGA    T    55_D      T    55_D     3.413     0    0.061   0.978     7.188   51.786   40.816
LGA    A    56_D      A    56_D     3.754     0    0.062   0.066     4.981   52.143   48.000
LGA    S    57_D      S    57_D     2.552     0    0.032   0.075     4.250   59.167   53.968
LGA    I    58_D      I    58_D     3.430     0    0.032   1.496     5.959   48.810   39.048
LGA    I    59_D      I    59_D     3.544     0    0.049   0.692     4.946   48.452   44.405
LGA    T    60_D      T    60_D     2.558     0    0.059   1.225     5.719   50.595   46.259
LGA    N    61_D      N    61_D     5.756     0    0.049   0.791     7.235   21.429   17.381
LGA    C    62_D      C    62_D     6.969     0    0.057   0.181     8.373   12.143   10.556
LGA    I    63_D      I    63_D     5.570     0    0.031   1.132     7.097   17.500   34.286
LGA    K    64_D      K    64_D     7.203     0    0.022   0.898    12.377    7.619    4.550
LGA    N    65_D      N    65_D    10.664     0    0.028   0.295    12.255    0.357    0.179
LGA    L    66_D      L    66_D    11.068     0    0.040   0.117    12.695    0.000    0.000
LGA    M    67_D      M    67_D     9.511     0    0.098   1.443    11.659    0.238    6.607
LGA    A    68_D      A    68_D    12.740     0    0.259   0.255    15.065    0.000    0.000
LGA    F    69_D      F    69_D    15.203     0    0.292   0.595    18.547    0.000    0.000
LGA    K    70_D      K    70_D    17.064     0    0.531   0.741    22.150    0.000    0.000
LGA    P    71_D      P    71_D    19.819     0    0.658   0.652    21.360    0.000    0.000
LGA    I    72_D      I    72_D    18.628     0    0.608   0.679    20.113    0.000    0.000
LGA    G    73_D      G    73_D    24.142     0    0.507   0.507    24.385    0.000    0.000
LGA    P    74_D      P    74_D    26.463     0    0.680   0.831    30.101    0.000    0.000
LGA    L    75_D      L    75_D    24.137     0    0.040   0.080    25.210    0.000    0.000
LGA    V    76_D      V    76_D    23.986     0    0.635   1.425    26.651    0.000    0.000
LGA    G    77_D      G    77_D    21.909     0    0.176   0.176    23.542    0.000    0.000
LGA    N    78_D      N    78_D    23.895     0    0.123   1.278    24.391    0.000    0.000
LGA    E    79_D      E    79_D    23.552     0    0.627   0.711    27.393    0.000    0.000
LGA    E    80_D      E    80_D    22.567     0    0.705   1.373    22.741    0.000    0.000
LGA    E    81_D      E    81_D    20.495     0    0.673   1.259    21.630    0.000    0.000
LGA    W    82_D      W    82_D    20.506     0    0.045   0.247    24.636    0.000    0.000
LGA    N    83_D      N    83_D    25.307     0    0.598   0.952    29.290    0.000    0.000
LGA    Y    84_D      Y    84_D    28.369     0    0.257   1.252    32.396    0.000    0.000
LGA    N    85_D      N    85_D    31.873     0    0.281   1.109    33.252    0.000    0.000
LGA    S    86_D      S    86_D    35.318     0    0.554   0.550    37.372    0.000    0.000
LGA    D    87_D      D    87_D    38.429     0    0.519   0.608    44.063    0.000    0.000
LGA    D    88_D      D    88_D    33.482     0    0.527   1.031    34.876    0.000    0.000
LGA    S    89_D      S    89_D    31.362     0    0.588   0.766    32.427    0.000    0.000
LGA    F    90_D      F    90_D    29.268     0    0.627   0.707    32.201    0.000    0.000
LGA    Q    91_D      Q    91_D    26.798     0    0.078   1.129    29.124    0.000    0.000
LGA    N    92_D      N    92_D    26.999     0    0.232   1.299    26.999    0.000    0.000
LGA    N    93_D      N    93_D    27.043     0    0.136   1.112    31.745    0.000    0.000
LGA    R    94_D      R    94_D    21.387     0    0.610   1.160    25.638    0.000    0.000
LGA    L    95_D      L    95_D    17.291     0    0.513   1.425    19.028    0.000    0.000
LGA    S    96_D      S    96_D    18.681     0    0.669   0.921    20.861    0.000    0.000
LGA    A    97_D      A    97_D    17.956     0    0.650   0.601    18.984    0.000    0.000
LGA    V    98_D      V    98_D    21.422     0    0.169   1.183    24.098    0.000    0.000
LGA    F    99_D      F    99_D    27.454     0    0.116   1.272    28.990    0.000    0.000
LGA    K   100_D      K   100_D    32.271     0    0.073   1.214    35.955    0.000    0.000
LGA    T   101_D      T   101_D    38.412     0    0.214   1.042    40.602    0.000    0.000
LGA    G   102_D      G   102_D    42.118     0    0.200   0.200    42.118    0.000    0.000
LGA    L   103_D      L   103_D    40.324     0    0.035   1.426    43.518    0.000    0.000
LGA    N   104_D      N   104_D    40.925     0    0.549   0.894    44.198    0.000    0.000
LGA    G   105_D      G   105_D    35.999     0    0.130   0.130    37.323    0.000    0.000
LGA    K   106_D      K   106_D    33.662     0    0.111   0.840    36.640    0.000    0.000
LGA    P   107_D      P   107_D    27.179     0    0.062   0.119    29.455    0.000    0.000
LGA    Y   108_D      Y   108_D    26.482     0    0.065   1.384    32.524    0.000    0.000
LGA    Y   109_D      Y   109_D    22.194     0    0.038   0.521    24.317    0.000    0.000
LGA    L   110_D      L   110_D    24.064     0    0.700   1.047    27.455    0.000    0.000
LGA    D   111_D      D   111_D    21.997     0    0.475   1.296    23.140    0.000    0.000
LGA    A   112_D      A   112_D    24.874     0    0.632   0.605    26.326    0.000    0.000
LGA    I   113_D      I   113_D    27.273     0    0.075   0.179    30.416    0.000    0.000
LGA    T   114_D      T   114_D    30.024     0    0.035   1.024    31.039    0.000    0.000
LGA    F   115_D      F   115_D    34.314     0    0.074   0.084    36.040    0.000    0.000
LGA    V   116_D      V   116_D    36.160     0    0.153   0.163    37.815    0.000    0.000
LGA    G   117_D      G   117_D    41.503     0    0.553   0.553    41.503    0.000    0.000
LGA    E   118_D      E   118_D    42.470     0    0.125   1.159    48.800    0.000    0.000
LGA    E   119_D      E   119_D    39.990     0    0.033   0.625    41.615    0.000    0.000
LGA    E   120_D      E   120_D    35.847     0    0.125   0.970    37.373    0.000    0.000
LGA    Y   121_D      Y   121_D    33.257     0    0.626   1.125    34.486    0.000    0.000
LGA    D   122_D      D   122_D    32.959     0    0.085   0.193    34.960    0.000    0.000
LGA    T   123_D      T   123_D    29.446     0    0.108   1.181    30.810    0.000    0.000
LGA    F   124_D      F   124_D    28.645     0    0.110   0.264    29.813    0.000    0.000
LGA    H   125_D      H   125_D    28.089     0    0.628   1.117    29.008    0.000    0.000
LGA    G   126_D      G   126_D    27.955     0    0.150   0.150    28.297    0.000    0.000
LGA    H   127_D      H   127_D    27.320     0    0.113   1.078    30.492    0.000    0.000
LGA    V   128_D      V   128_D    25.724     0    0.600   0.586    26.076    0.000    0.000
LGA    E   129_D      E   129_D    24.769     0    0.461   1.213    26.006    0.000    0.000
LGA    G   130_D      G   130_D    26.436     0    0.115   0.115    27.631    0.000    0.000
LGA    I   131_D      I   131_D    26.771     0    0.612   0.654    28.799    0.000    0.000
LGA    S   132_D      S   132_D    25.642     0    0.634   0.783    26.889    0.000    0.000
LGA    S   133_D      S   133_D    21.272     0    0.619   0.633    23.264    0.000    0.000
LGA    R   134_D      R   134_D    25.919     0    0.095   1.202    28.526    0.000    0.000
LGA    Q   135_D      Q   135_D    28.347     0    0.090   1.319    30.571    0.000    0.000
LGA    Y   136_D      Y   136_D    32.797     0    0.068   0.419    39.958    0.000    0.000
LGA    L   137_D      L   137_D    32.422     0    0.033   0.273    36.278    0.000    0.000
LGA    K   138_D      K   138_D    34.201     0    0.651   1.043    34.833    0.000    0.000
LGA    G   139_D      G   139_D    35.947     0    0.216   0.216    35.947    0.000    0.000
LGA    F   140_D      F   140_D    34.116     0    0.098   1.290    36.820    0.000    0.000
LGA    P   141_D      P   141_D    33.201     0    0.095   0.256    34.810    0.000    0.000
LGA    F   142_D      F   142_D    32.204     0    0.106   1.244    35.127    0.000    0.000
LGA    F   143_D      F   143_D    32.437     0    0.368   0.401    34.942    0.000    0.000
LGA    P   144_D      P   144_D    33.949     0    0.065   0.196    34.582    0.000    0.000
LGA    K   145_D      K   145_D    36.960     0    0.587   1.308    40.145    0.000    0.000
LGA    T   146_D      T   146_D    37.900     0    0.306   1.022    38.444    0.000    0.000
LGA    F   147_D      F   147_D    37.148     0    0.042   1.011    38.758    0.000    0.000
LGA    Y   148_D      Y   148_D    34.973     0    0.601   1.213    35.518    0.000    0.000
LGA    I   149_D      I   149_D    35.264     0    0.171   1.075    37.721    0.000    0.000
LGA    N   150_D      N   150_D    34.576     0    0.096   1.240    34.792    0.000    0.000
LGA    V   151_D      V   151_D    35.401     0    0.148   1.105    35.856    0.000    0.000
LGA    Y   152_D      Y   152_D    35.431     0    0.022   0.281    39.497    0.000    0.000
LGA    K   153_D      K   153_D    34.534     0    0.300   0.718    35.808    0.000    0.000
LGA    D   154_D      D   154_D    35.852     0    0.255   1.184    37.449    0.000    0.000
LGA    F   155_D      F   155_D    40.483     0    0.581   0.734    44.674    0.000    0.000
LGA    E   156_D      E   156_D    43.835     0    0.554   1.621    45.451    0.000    0.000
LGA    N   157_D      N   157_D    46.240     0    0.467   0.966    47.624    0.000    0.000
LGA    K   158_D      K   158_D    43.608     0    0.152   1.159    46.968    0.000    0.000
LGA    D   159_D      D   159_D    45.721     0    0.088   1.060    49.999    0.000    0.000
LGA    E   160_D      E   160_D    45.381     0    0.670   1.210    47.945    0.000    0.000
LGA    N   161_D      N   161_D    44.090     0    0.724   0.645    47.552    0.000    0.000
LGA    N   162_D      N   162_D    37.497     0    0.553   1.271    39.896    0.000    0.000
LGA    L   163_D      L   163_D    36.792     0    0.063   0.337    41.141    0.000    0.000
LGA    C   164_D      C   164_D    35.439     0    0.095   0.150    37.624    0.000    0.000
LGA    S   165_D      S   165_D    39.680     0    0.079   0.154    42.023    0.000    0.000
LGA    G   166_D      G   166_D    40.256     0    0.098   0.098    43.379    0.000    0.000
LGA    D   167_D      D   167_D    43.834     0    0.691   1.290    43.905    0.000    0.000
LGA    D   168_D      D   168_D    44.538     0    0.409   1.218    48.010    0.000    0.000
LGA    G   169_D      G   169_D    48.573     0    0.224   0.224    49.160    0.000    0.000
LGA    E   170_D      E   170_D    51.309     0    0.066   0.752    55.840    0.000    0.000
LGA    Y   171_D      Y   171_D    52.654     0    0.568   1.008    54.703    0.000    0.000
LGA    T   172_D      T   172_D    54.022     0    0.134   0.830    56.329    0.000    0.000
LGA    Y   173_D      Y   173_D    50.942     0    0.038   1.245    52.393    0.000    0.000
LGA    R   174_D      R   174_D    51.377     0    0.606   1.629    61.869    0.000    0.000
LGA    I   175_D      I   175_D    46.755     0    0.066   1.043    48.815    0.000    0.000
LGA    K   176_D      K   176_D    41.131     0    0.587   1.444    42.791    0.000    0.000
LGA    Y   177_D      Y   177_D    38.219     0    0.234   0.496    39.188    0.000    0.000
LGA    P   178_D      P   178_D    42.209     0    0.663   0.632    44.961    0.000    0.000
LGA    E   179_D      E   179_D    39.603     0    0.659   1.642    45.088    0.000    0.000
LGA    Q   180_D      Q   180_D    36.626     0    0.671   1.117    37.472    0.000    0.000
LGA    L   181_D      L   181_D    36.847     0    0.138   1.232    39.506    0.000    0.000
LGA    E   182_D      E   182_D    39.753     0    0.030   1.047    43.636    0.000    0.000
LGA    E   183_D      E   183_D    37.248     0    0.035   1.321    38.002    0.000    0.000
LGA    V   184_D      V   184_D    33.734     0    0.034   0.077    34.906    0.000    0.000
LGA    F   185_D      F   185_D    36.107     0    0.290   1.258    37.718    0.000    0.000
LGA    N   186_D      N   186_D    39.103     0    0.142   0.888    41.823    0.000    0.000
LGA    Y   187_D      Y   187_D    37.540     0    0.045   0.322    37.781    0.000    0.000
LGA    Y   188_D      Y   188_D    35.453     0    0.581   1.402    36.281    0.000    0.000
LGA    D   189_D      D   189_D    38.172     0    0.610   1.276    43.447    0.000    0.000
LGA    K   190_D      K   190_D    40.534     0    0.593   0.521    45.520    0.000    0.000
LGA    F   191_D      F   191_D    40.620     0    0.578   0.944    41.539    0.000    0.000
LGA    T   192_D      T   192_D    39.533     0    0.578   1.274    41.922    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      192     768    768  100.00    1575   1575  100.00               192
SUMMARY(RMSD_GDC):    19.464         19.340                 19.542           11.345    9.571

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  194  192    4.0     31    2.87    15.495    13.252     1.044

LGA_LOCAL      RMSD:   2.870  Number of atoms:   31  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  31.105  Number of assigned atoms:  192 
Std_ASGN_ATOMS RMSD:  19.464  Standard rmsd on all 192 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.093959 * X  +   0.342452 * Y  +  -0.934825 * Z  +  -3.847662
  Y_new =   0.718028 * X  +  -0.627129 * Y  +  -0.301903 * Z  +   6.291320
  Z_new =  -0.689643 * X  +  -0.699597 * Y  +  -0.186966 * Z  + -27.349401 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  1.700914  0.760996 -1.831941   [DEG:   97.4552   43.6019 -104.9625 ]
ZXZ: -1.258418  1.758869 -2.363359   [DEG:  -72.1021  100.7757 -135.4105 ]
 
# END of job
