
#######################################################
#                                                     #
#                        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      19_D - 69_D        4.94    34.92
  LONGEST_CONTINUOUS_SEGMENT:    51      20_D - 70_D        4.76    34.95
  LONGEST_CONTINUOUS_SEGMENT:    51      21_D - 71_D        4.93    34.99
  LCS_AVERAGE:     14.55

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    23      28_D - 50_D        1.90    33.49
  LCS_AVERAGE:      5.41

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    19      51_D - 69_D        0.76    38.45
  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   14      0    3    3    3    4    4    4    6    6   11   12   13   15   17   18   19   20   20   22   24 
LCS_GDT     N     2_D     N     2_D      3    5   14      3    3    3    4    5    6    6    8    9   11   12   13   15   17   18   19   20   20   22   24 
LCS_GDT     S     3_D     S     3_D      3    5   14      3    3    3    4    5    6    6    8    9   11   12   13   15   17   18   19   20   20   21   21 
LCS_GDT     I     4_D     I     4_D      3    5   14      3    3    3    4    5    6    6    8    9   11   12   13   15   17   18   19   20   20   21   21 
LCS_GDT     T     5_D     T     5_D      3    5   14      3    3    3    4    5    5    6    8    9   11   12   13   15   17   18   19   20   20   21   21 
LCS_GDT     H     6_D     H     6_D      3    5   14      3    3    3    4    5    6    6    8    9   11   12   13   15   15   17   19   20   20   21   21 
LCS_GDT     A     7_D     A     7_D      3    5   14      3    3    3    4    5    6    6    8    9   11   12   13   15   15   17   19   20   20   21   21 
LCS_GDT     E     8_D     E     8_D      3    5   14      3    3    3    4    5    5    6    8    8    8    9   11   12   14   15   17   18   20   21   36 
LCS_GDT     F     9_D     F     9_D      3    5   14      3    3    3    4    5    6    6    8    9   11   12   13   15   19   23   25   32   35   38   42 
LCS_GDT     E    10_D     E    10_D      3    3   14      3    3    3    3    4    4    5    7    9   11   12   13   15   17   18   19   20   31   38   42 
LCS_GDT     F    11_D     F    11_D      3    3   14      3    3    3    3    3    4    6    8    9   11   12   13   15   17   26   28   32   35   42   47 
LCS_GDT     S    12_D     S    12_D      3    3   14      0    3    3    3    3    4    5    6   13   15   17   24   27   30   32   38   39   41   46   47 
LCS_GDT     L    13_D     L    13_D      3    3   14      1    3    3    3    4    5    8    8   12   16   18   24   27   30   32   38   39   41   46   47 
LCS_GDT     L    14_D     L    14_D      3    3   14      3    3    3    3    4    6    8    8   12   16   18   24   27   30   32   38   39   41   46   47 
LCS_GDT     E    15_D     E    15_D      3    7   13      3    3    5    6    6    8    9   10   11   16   18   22   24   26   31   38   39   41   46   47 
LCS_GDT     N    16_D     N    16_D      4    7   13      3    3    4    6    6    8    9   10   11   13   15   17   22   25   29   32   35   39   41   47 
LCS_GDT     V    17_D     V    17_D      4    7   13      3    4    4    6    6    8    8    9    9   13   15   17   20   24   27   32   35   39   41   47 
LCS_GDT     K    18_D     K    18_D      4    7   29      3    4    4    6    6    8    8    9    9   10   13   17   20   24   27   30   31   38   42   47 
LCS_GDT     Y    19_D     Y    19_D      4    7   51      3    4    4    5    6    8    8    9    9   12   23   24   30   38   42   46   47   50   51   52 
LCS_GDT     E    20_D     E    20_D      4    7   51      4    4    4    6    6   11   15   20   23   33   39   42   46   48   49   50   50   51   51   52 
LCS_GDT     T    21_D     T    21_D      4    7   51      4    4    5   16   21   25   27   30   35   39   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     E    22_D     E    22_D      4    7   51      4    4    7   13   19   24   27   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     D    23_D     D    23_D      4    6   51      4    4    5    5   11   17   24   29   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     E    24_D     E    24_D      4    6   51      3    3    5    5    9   19   25   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     V    25_D     V    25_D      4    8   51      3    3    8   13   19   23   29   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     P    26_D     P    26_D      7    9   51      3    4    7    7    7    7   11   13   29   35   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     I    27_D     I    27_D      7   20   51      3    6    7   10   16   20   24   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     V    28_D     V    28_D      7   23   51      5    6    7   11   19   23   29   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     L    29_D     L    29_D      7   23   51      5    6   13   17   22   25   29   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     E    30_D     E    30_D      7   23   51      5   10   15   22   22   25   29   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     Y    31_D     Y    31_D     16   23   51     15   15   18   22   22   25   29   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     K    32_D     K    32_D     16   23   51     15   15   18   22   22   25   29   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     E    33_D     E    33_D     16   23   51     15   15   18   19   21   25   29   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     E    34_D     E    34_D     16   23   51     15   15   18   19   21   23   29   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     I    35_D     I    35_D     16   23   51     15   15   18   19   21   23   29   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     I    36_D     I    36_D     16   23   51     15   15   18   19   21   23   29   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     N    37_D     N    37_D     16   23   51     15   15   18   19   21   23   29   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     L    38_D     L    38_D     16   23   51     15   15   18   19   21   23   29   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     I    39_D     I    39_D     16   23   51     15   15   18   19   21   23   29   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     K    40_D     K    40_D     16   23   51     15   15   18   19   21   23   29   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     K    41_D     K    41_D     16   23   51     15   15   18   19   21   23   29   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     F    42_D     F    42_D     16   23   51     15   15   18   19   21   23   29   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     S    43_D     S    43_D     16   23   51     15   15   18   19   21   23   29   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     N    44_D     N    44_D     16   23   51     15   15   18   19   21   23   29   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     S    45_D     S    45_D     16   23   51     15   15   18   19   21   23   29   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     G    46_D     G    46_D     16   23   51      3    5   18   19   21   23   29   31   36   40   42   45   47   48   49   50   50   51   51   52 
LCS_GDT     Q    47_D     Q    47_D      3   23   51      3    3    5    7   18   22   29   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     S    48_D     S    48_D      3   23   51      3   11   18   19   21   23   29   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     G    49_D     G    49_D      3   23   51      3    3    5   17   19   21   23   25   29   32   37   42   45   48   49   50   50   51   51   52 
LCS_GDT     M    50_D     M    50_D      3   23   51      1   10   18   19   21   23   29   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     S    51_D     S    51_D     19   20   51      4    9   18   22   22   25   27   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     A    52_D     A    52_D     19   20   51      7   18   18   22   22   25   27   30   34   38   41   46   47   48   49   50   50   51   51   52 
LCS_GDT     P    53_D     P    53_D     19   20   51      7   18   18   22   22   25   27   30   34   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     I    54_D     I    54_D     19   20   51     15   18   18   22   22   25   29   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     T    55_D     T    55_D     19   20   51     13   18   18   22   22   25   27   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     A    56_D     A    56_D     19   20   51     15   18   18   22   22   25   29   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     S    57_D     S    57_D     19   20   51     15   18   18   22   22   25   29   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     I    58_D     I    58_D     19   20   51     15   18   18   22   22   25   29   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     I    59_D     I    59_D     19   20   51     15   18   18   22   22   25   29   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     T    60_D     T    60_D     19   20   51     15   18   18   22   22   25   29   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     N    61_D     N    61_D     19   20   51     15   18   18   22   22   25   27   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     C    62_D     C    62_D     19   20   51     15   18   18   22   22   25   27   30   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     I    63_D     I    63_D     19   20   51     15   18   18   22   22   25   27   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     K    64_D     K    64_D     19   20   51     15   18   18   22   22   25   27   31   36   40   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     N    65_D     N    65_D     19   20   51     15   18   18   22   22   25   27   30   34   38   41   46   47   48   49   50   50   51   51   52 
LCS_GDT     L    66_D     L    66_D     19   20   51     15   18   18   22   22   25   27   30   33   38   40   46   47   48   49   50   50   51   51   52 
LCS_GDT     M    67_D     M    67_D     19   20   51     15   18   18   22   22   25   27   30   34   39   42   46   47   48   49   50   50   51   51   52 
LCS_GDT     A    68_D     A    68_D     19   20   51     15   18   18   22   22   25   27   30   34   38   41   46   47   48   49   50   50   51   51   52 
LCS_GDT     F    69_D     F    69_D     19   20   51     15   18   18   22   22   25   27   30   33   38   39   43   46   48   49   50   50   51   51   52 
LCS_GDT     K    70_D     K    70_D      3   20   51      3    3    4    4    8   12   14   20   21   21   32   38   44   47   49   50   50   51   51   52 
LCS_GDT     P    71_D     P    71_D      3    7   51      3    3    3    4    8   12   14   18   21   21   26   29   32   34   38   43   46   49   51   51 
LCS_GDT     I    72_D     I    72_D      3    7   25      3    3    3    6    7   10   12   13   17   21   24   26   31   32   36   39   43   47   48   51 
LCS_GDT     G    73_D     G    73_D      3    7   25      3    3    3    6    7   10   12   14   17   21   24   26   27   32   36   39   41   42   46   51 
LCS_GDT     P    74_D     P    74_D      3    7   19      3    3    4    6    8   10   12   15   17   21   23   26   26   32   36   39   41   42   46   48 
LCS_GDT     L    75_D     L    75_D      3    7   19      3    4    5    8    8   11   14   16   20   22   26   29   32   34   38   39   44   46   48   51 
LCS_GDT     V    76_D     V    76_D      4    7   19      3    4    4    8    8   11   14   18   21   25   28   29   32   34   38   40   44   46   48   51 
LCS_GDT     G    77_D     G    77_D      4    7   19      3    4    4    8    9   12   15   19   21   25   28   29   32   34   38   40   44   46   48   51 
LCS_GDT     N    78_D     N    78_D      4    7   19      3    4    4    4    7    8   10   11   13   15   19   22   26   29   32   34   41   46   48   51 
LCS_GDT     E    79_D     E    79_D      4    7   19      3    4    4    4    7    8   10   11   13   15   19   22   26   28   31   34   37   39   46   48 
LCS_GDT     E    80_D     E    80_D      3    7   19      3    3    3    4    7    8   10   11   13   16   19   24   27   30   32   38   40   44   46   48 
LCS_GDT     E    81_D     E    81_D      4    4   19      3    4    4    4    5    6    6    8   12   14   20   23   27   30   32   38   40   44   46   48 
LCS_GDT     W    82_D     W    82_D      4    4   19      3    4    4    5    6    7    9   11   16   17   20   25   28   31   32   38   40   44   46   48 
LCS_GDT     N    83_D     N    83_D      4    5   19      3    4    4    5   11   12   15   18   21   23   25   27   29   31   33   38   40   44   46   48 
LCS_GDT     Y    84_D     Y    84_D      4    5   19      3    4    5    5    6    7   11   13   18   23   25   27   29   31   33   38   40   44   46   48 
LCS_GDT     N    85_D     N    85_D      4    5   19      3    4    5    6   11   12   15   18   21   23   25   27   29   31   33   38   40   44   46   48 
LCS_GDT     S    86_D     S    86_D      4    5   19      3    4    5    5    6    8   11   18   21   23   25   27   29   31   33   38   39   42   46   48 
LCS_GDT     D    87_D     D    87_D      3    5   19      3    3    3    5    7   12   15   18   21   23   25   27   29   31   33   38   39   42   46   48 
LCS_GDT     D    88_D     D    88_D      3    5   19      3    3    3    6    7    7    9   17   21   23   25   27   29   31   33   38   40   44   46   48 
LCS_GDT     S    89_D     S    89_D      3    5   19      3    3    3    5   11   12   15   18   21   23   25   27   29   31   33   38   40   44   46   48 
LCS_GDT     F    90_D     F    90_D      3    5   19      3    3    4    6    7    8   11   16   21   23   25   27   29   31   33   38   40   44   46   48 
LCS_GDT     Q    91_D     Q    91_D      3    5   19      3    3    4    5   11   12   15   18   21   23   25   27   29   31   33   38   40   44   46   48 
LCS_GDT     N    92_D     N    92_D      4    5   17      3    4    4    4    7    7    9   13   20   22   25   27   29   31   33   37   40   44   46   48 
LCS_GDT     N    93_D     N    93_D      4    5   17      3    4    4    4    7    8   11   13   16   19   22   25   28   31   33   37   39   41   46   47 
LCS_GDT     R    94_D     R    94_D      4    5   27      3    4    4    5    7    8   11   13   17   22   25   27   29   31   33   37   40   44   46   47 
LCS_GDT     L    95_D     L    95_D      4    5   27      3    4    4    5    5    8    9   14   19   25   26   27   29   33   34   38   40   44   47   50 
LCS_GDT     S    96_D     S    96_D      3    7   27      3    3    5    6   11   12   18   19   25   26   26   27   29   33   34   38   41   46   48   51 
LCS_GDT     A    97_D     A    97_D      5    8   27      0    4    5    8   11   15   18   22   25   26   26   28   31   34   38   40   44   46   48   51 
LCS_GDT     V    98_D     V    98_D      5    9   27      3    4    5    8   12   15   18   22   25   26   28   29   32   34   38   40   44   46   48   51 
LCS_GDT     F    99_D     F    99_D      5    9   27      3    4    5    8   12   15   18   22   25   26   28   29   32   34   38   40   44   46   48   51 
LCS_GDT     K   100_D     K   100_D      5    9   27      3    4    6    8   12   15   18   22   25   26   28   29   32   34   38   40   44   46   48   51 
LCS_GDT     T   101_D     T   101_D      5    9   27      3    4    6    8   11   15   18   22   25   26   26   28   31   34   37   40   44   46   48   51 
LCS_GDT     G   102_D     G   102_D      5    9   27      3    4    6    8   12   15   18   21   25   26   28   29   32   34   37   40   44   46   48   51 
LCS_GDT     L   103_D     L   103_D      5    9   27      3    4    6    7    9   13   15   19   24   26   28   29   32   34   38   40   44   46   48   51 
LCS_GDT     N   104_D     N   104_D      5    9   27      3    3    6    8   12   15   18   22   25   26   28   29   32   34   38   40   44   46   48   51 
LCS_GDT     G   105_D     G   105_D      7    9   27      3    6    8    9   12   15   18   22   25   26   28   29   32   34   38   40   44   46   48   51 
LCS_GDT     K   106_D     K   106_D      7    9   27      4    6    8    9   12   15   18   22   25   26   28   29   32   34   38   40   44   46   48   51 
LCS_GDT     P   107_D     P   107_D      7    8   27      4    6    8    9   12   15   18   22   25   26   28   29   32   34   38   40   44   46   48   51 
LCS_GDT     Y   108_D     Y   108_D      7    8   27      4    6    8    9   12   15   18   22   25   26   28   29   32   34   38   40   44   46   48   51 
LCS_GDT     Y   109_D     Y   109_D      7    8   27      4    6    8    9   12   15   18   22   25   26   28   29   32   34   38   40   44   46   48   51 
LCS_GDT     L   110_D     L   110_D      7    8   27      3    6    8    9   12   15   18   22   25   26   28   29   32   34   38   40   44   46   48   51 
LCS_GDT     D   111_D     D   111_D      7    8   27      3    6    8    9   11   15   18   22   25   26   28   29   32   34   38   40   44   46   48   51 
LCS_GDT     A   112_D     A   112_D      5    8   27      4    5    6    8    8   11   16   22   25   26   26   29   32   34   38   40   44   46   48   51 
LCS_GDT     I   113_D     I   113_D      6    8   27      4    5    6    8    8   13   16   22   25   26   26   29   32   34   37   40   44   46   48   51 
LCS_GDT     T   114_D     T   114_D      6    8   27      4    5    6    8    8   13   16   22   25   26   26   29   32   34   37   40   44   46   48   51 
LCS_GDT     F   115_D     F   115_D      6    8   27      4    5    6    8    8   13   16   22   25   26   26   27   29   34   36   39   44   46   48   51 
LCS_GDT     V   116_D     V   116_D      6    8   27      3    5    6    8    8   13   16   22   25   26   26   27   29   33   36   39   43   46   48   51 
LCS_GDT     G   117_D     G   117_D      6    8   27      3    5    6    8    8   13   16   22   25   26   26   27   29   30   34   37   39   41   44   48 
LCS_GDT     E   118_D     E   118_D      6    8   27      3    5    6    8    8   13   16   22   25   26   26   27   29   30   34   37   39   41   44   47 
LCS_GDT     E   119_D     E   119_D      5    8   27      3    4    8    9   11   13   15   20   25   26   26   28   32   34   37   40   44   46   48   51 
LCS_GDT     E   120_D     E   120_D      5    9   27      3    4    5    6    8   11   14   15   19   22   26   29   32   34   38   40   44   46   48   51 
LCS_GDT     Y   121_D     Y   121_D      5    9   27      3    4    6    8   11   12   18   19   21   25   28   29   32   34   38   40   44   46   48   51 
LCS_GDT     D   122_D     D   122_D      4    9   23      3    4    6    8   11   14   18   19   21   25   28   29   32   34   38   40   44   46   48   51 
LCS_GDT     T   123_D     T   123_D      4    9   23      3    4    6    8   11   15   18   19   22   25   28   29   32   34   38   40   44   46   48   51 
LCS_GDT     F   124_D     F   124_D      4    9   23      3    3    4    8    9   11   14   18   21   25   28   29   31   34   38   40   44   46   48   51 
LCS_GDT     H   125_D     H   125_D      4    9   23      4    4    6    8    8   11   14   17   20   25   28   29   31   34   38   40   44   46   48   51 
LCS_GDT     G   126_D     G   126_D      4    9   23      4    4    6    8    8   11   14   15   17   21   27   29   31   34   38   39   44   46   48   51 
LCS_GDT     H   127_D     H   127_D      4    9   23      4    4    6    8    8   10   12   14   17   25   28   29   32   34   38   40   44   46   48   51 
LCS_GDT     V   128_D     V   128_D      4    9   17      4    4    6    8    9   12   15   19   21   25   28   29   32   34   38   40   44   46   48   51 
LCS_GDT     E   129_D     E   129_D      4    9   17      4    4    5    7    9   11   15   18   21   25   28   29   32   34   38   40   44   46   48   51 
LCS_GDT     G   130_D     G   130_D      4    8   17      3    4    5    6    8   11   15   18   21   25   28   29   32   34   38   40   44   46   48   51 
LCS_GDT     I   131_D     I   131_D      4    8   17      3    4    5    7    9   12   15   19   21   25   28   29   32   34   38   40   44   46   48   51 
LCS_GDT     S   132_D     S   132_D      4    8   17      3    4    4    8    8   11   12   15   19   25   28   29   31   34   38   40   44   46   48   51 
LCS_GDT     S   133_D     S   133_D      6    8   17      4    5    6    8    8   11   11   13   18   22   24   26   31   34   38   38   40   45   48   51 
LCS_GDT     R   134_D     R   134_D      6    8   17      4    5    6    8   11   12   15   19   22   25   28   29   32   34   38   40   44   46   48   51 
LCS_GDT     Q   135_D     Q   135_D      6    8   17      4    5    7    9   12   15   17   22   25   26   28   29   32   34   38   40   44   46   48   51 
LCS_GDT     Y   136_D     Y   136_D      6    8   17      4    5    6    7    8   13   15   22   25   26   26   27   29   31   35   39   43   46   48   51 
LCS_GDT     L   137_D     L   137_D      6    8   15      4    5    6    7   11   12   15   18   21   23   25   27   29   31   33   38   40   44   46   48 
LCS_GDT     K   138_D     K   138_D      6    8   15      4    5    6    7    8   11   11   13   16   23   25   27   29   31   33   38   40   44   46   48 
LCS_GDT     G   139_D     G   139_D      5    8   15      3    3    6    7   11   12   15   18   21   23   25   27   29   31   33   38   40   44   46   48 
LCS_GDT     F   140_D     F   140_D      3    8   15      3    3    4    5   11   12   15   18   21   23   25   27   29   31   33   38   40   44   46   47 
LCS_GDT     P   141_D     P   141_D      3    5   15      2    3    4    4    6    8   14   18   21   23   25   27   29   31   33   37   40   44   46   47 
LCS_GDT     F   142_D     F   142_D      5    6   15      5    5    5    5    5    6    7    9    9    9   12   18   21   27   31   37   39   41   45   46 
LCS_GDT     F   143_D     F   143_D      5    6   13      5    5    5    5    5    6    7    9    9   10   13   17   19   20   21   28   30   35   38   43 
LCS_GDT     P   144_D     P   144_D      5    6   14      5    5    5    5    5    6    7    9    9   11   13   17   18   19   20   22   25   27   32   36 
LCS_GDT     K   145_D     K   145_D      5    6   14      5    5    5    5    5    6    7   10   11   11   13   15   16   18   20   22   25   29   33   37 
LCS_GDT     T   146_D     T   146_D      5    8   14      5    5    5    5    7    9    9   10   11   12   13   15   16   18   20   24   27   28   30   33 
LCS_GDT     F   147_D     F   147_D      4    8   14      4    4    5    6    7    9    9   10   11   12   14   17   19   25   27   30   32   34   39   42 
LCS_GDT     Y   148_D     Y   148_D      6    8   14      4    5    7    7    7    9    9   14   15   18   21   21   25   26   28   30   32   35   39   45 
LCS_GDT     I   149_D     I   149_D      6    8   14      4    5    7    7    7    9    9   13   14   16   18   21   23   23   27   30   32   34   39   45 
LCS_GDT     N   150_D     N   150_D      6    8   14      4    5    7    7    7    9    9   10   11   12   14   15   18   20   24   27   32   34   37   41 
LCS_GDT     V   151_D     V   151_D      6    8   15      4    5    7    7    7    9    9   10   11   12   14   15   16   18   20   22   24   28   32   36 
LCS_GDT     Y   152_D     Y   152_D      6    8   15      4    5    7    7    7    9    9   10   11   12   14   15   16   18   20   22   27   32   35   37 
LCS_GDT     K   153_D     K   153_D      6    8   15      3    5    7    7    7    9    9   11   12   16   16   17   17   18   20   22   26   31   36   37 
LCS_GDT     D   154_D     D   154_D      6    8   15      4    4    7    7    7    9   10   11   12   16   16   17   19   24   27   32   33   34   36   37 
LCS_GDT     F   155_D     F   155_D      3    8   15      4    4    4    5    6    8   10   10   12   16   16   17   17   19   24   26   30   31   34   36 
LCS_GDT     E   156_D     E   156_D      3    4   15      4    4    4    4    5    6   10   10   12   12   15   18   21   25   27   32   33   34   36   37 
LCS_GDT     N   157_D     N   157_D      3    6   15      3    3    5    6    8    9   11   12   15   17   19   23   26   29   30   32   33   34   37   40 
LCS_GDT     K   158_D     K   158_D      4    6   15      4    4    5    6    8    9   11   14   15   18   21   23   28   29   31   32   34   36   38   42 
LCS_GDT     D   159_D     D   159_D      4    6   15      4    4    5    6    8    9   11   14   15   18   21   23   28   29   30   32   33   35   38   42 
LCS_GDT     E   160_D     E   160_D      4    6   15      4    4    5    6    8    9   11   12   15   18   21   23   28   29   30   32   33   34   38   42 
LCS_GDT     N   161_D     N   161_D      4    6   15      4    4    5    6    8    9   11   14   15   18   21   23   28   29   30   32   33   34   38   42 
LCS_GDT     N   162_D     N   162_D      4    6   15      3    3    5    6    6    9   11   14   15   18   21   23   28   29   30   32   33   34   41   45 
LCS_GDT     L   163_D     L   163_D      3    6   15      3    3    3    5    7    8   10   10   12   12   17   22   28   29   30   32   33   34   36   37 
LCS_GDT     C   164_D     C   164_D      4    6   15      3    3    5    5    6    7   10   10   12   14   21   23   28   29   30   35   40   45   48   51 
LCS_GDT     S   165_D     S   165_D      4    5   15      3    4    4    5    6    6    8   10   11   15   21   23   28   29   30   32   33   34   48   51 
LCS_GDT     G   166_D     G   166_D      4    5   16      3    4    4    5    5    6    8    8    8    8   14   15   20   28   30   32   33   34   37   40 
LCS_GDT     D   167_D     D   167_D      4    5   17      3    4    4    5    5    6    8    8    8    8    9   12   14   19   24   26   31   34   37   38 
LCS_GDT     D   168_D     D   168_D      4    5   19      3    4    4    5    5    6    8   10   10   14   17   22   28   29   30   32   34   36   38   42 
LCS_GDT     G   169_D     G   169_D      4    5   19      3    3    4    4    4    6    8   11   15   18   21   23   28   29   31   32   34   37   41   46 
LCS_GDT     E   170_D     E   170_D      6    8   19      4    4    6    7    8   10   12   19   22   23   24   25   29   33   34   37   39   44   47   51 
LCS_GDT     Y   171_D     Y   171_D      6    8   19      4    4    6    7    8   10   12   19   22   23   24   27   29   33   34   38   41   46   48   51 
LCS_GDT     T   172_D     T   172_D      6    8   19      4    4    6    7    8   10   12   19   22   23   24   27   29   33   34   38   41   46   48   51 
LCS_GDT     Y   173_D     Y   173_D      6    8   19      4    4    6    7    8   10   15   19   22   23   24   25   28   33   37   40   44   46   48   51 
LCS_GDT     R   174_D     R   174_D      6    8   19      4    4    6    7    8   10   12   14   16   18   21   23   28   29   33   37   38   42   46   48 
LCS_GDT     I   175_D     I   175_D      6    8   19      4    4    6    7    8   10   12   14   16   20   21   23   28   29   33   38   39   42   46   48 
LCS_GDT     K   176_D     K   176_D      4    8   19      4    4    6    7    8   10   12   14   15   18   21   23   28   29   30   38   39   41   46   47 
LCS_GDT     Y   177_D     Y   177_D      4    8   19      3    4    4    7    8   10   12   14   15   17   20   23   28   30   33   38   39   44   46   47 
LCS_GDT     P   178_D     P   178_D      4    8   19      3    4    4    5    7   10   12   14   17   18   21   25   28   30   33   37   40   44   46   48 
LCS_GDT     E   179_D     E   179_D      4   10   19      3    4    4    7    8   10   12   14   17   17   21   25   28   30   33   37   40   44   46   48 
LCS_GDT     Q   180_D     Q   180_D      9   10   19      7    9    9    9    9   10   12   14   15   16   21   23   28   29   31   35   40   44   46   48 
LCS_GDT     L   181_D     L   181_D      9   10   19      7    9    9    9    9   10   12   14   15   18   21   23   28   29   31   35   40   44   46   48 
LCS_GDT     E   182_D     E   182_D      9   10   19      7    9    9    9    9   10   12   14   15   18   20   23   28   29   31   33   36   40   46   48 
LCS_GDT     E   183_D     E   183_D      9   10   19      7    9    9    9    9   10   10   13   15   17   18   20   24   28   30   34   37   40   44   48 
LCS_GDT     V   184_D     V   184_D      9   10   19      7    9    9    9    9   10   10   12   12   14   16   19   21   25   30   35   40   44   46   48 
LCS_GDT     F   185_D     F   185_D      9   10   19      7    9    9    9    9   10   10   13   17   19   20   26   28   29   31   35   38   42   46   48 
LCS_GDT     N   186_D     N   186_D      9   10   19      6    9    9    9    9    9   10   12   12   14   16   22   27   29   29   31   33   36   40   43 
LCS_GDT     Y   187_D     Y   187_D      9   10   18      6    9    9    9    9   10   10   12   12   14   14   16   16   18   27   31   33   35   37   40 
LCS_GDT     Y   188_D     Y   188_D      9   10   17      7    9    9    9    9   10   10   12   12   14   14   16   16   17   28   31   33   39   45   47 
LCS_GDT     D   189_D     D   189_D      3   10   17      3    3    3    4    9    9   10   12   12   14   17   23   26   26   31   32   38   44   46   48 
LCS_GDT     K   190_D     K   190_D      3    5   17      3    3    4    4    6    8   10   12   12   16   20   23   27   30   33   38   39   44   46   48 
LCS_GDT     F   191_D     F   191_D      3    5   17      3    3    4    4    6    8   10   12   12   14   14   16   16   16   24   25   31   37   42   47 
LCS_GDT     T   192_D     T   192_D      3    3   17      0    2    4    4    5    6    6    6    6    7   10   16   16   16   27   30   35   39   42   47 
LCS_AVERAGE  LCS_A:   7.87  (   3.67    5.41   14.55 )

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     22     22     25     29     31     36     40     42     46     47     48     49     50     50     51     51     52 
GDT PERCENT_AT   7.81   9.38   9.38  11.46  11.46  13.02  15.10  16.15  18.75  20.83  21.88  23.96  24.48  25.00  25.52  26.04  26.04  26.56  26.56  27.08
GDT RMS_LOCAL    0.24   0.57   0.57   1.25   1.25   1.70   2.33   2.50   3.03   3.40   3.66   4.10   4.15   4.29   4.39   4.60   4.56   4.76   4.76   5.12
GDT RMS_ALL_AT  36.80  38.43  38.43  37.58  37.58  37.22  31.60  31.49  32.04  32.56  33.04  34.06  33.93  34.32  34.31  34.66  34.60  34.95  34.95  35.26

# Checking swapping
#   possible swapping detected:  E     8_D      E     8_D
#   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:  E    24_D      E    24_D
#   possible swapping detected:  E    30_D      E    30_D
#   possible swapping detected:  Y    31_D      Y    31_D
#   possible swapping detected:  E    79_D      E    79_D
#   possible swapping detected:  E    80_D      E    80_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:  E   120_D      E   120_D
#   possible swapping detected:  F   143_D      F   143_D
#   possible swapping detected:  F   147_D      F   147_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:  D   159_D      D   159_D
#   possible swapping detected:  E   160_D      E   160_D
#   possible swapping detected:  D   168_D      D   168_D
#   possible swapping detected:  Y   171_D      Y   171_D
#   possible swapping detected:  E   179_D      E   179_D
#   possible swapping detected:  E   182_D      E   182_D
#   possible swapping detected:  Y   187_D      Y   187_D
#   possible swapping detected:  Y   188_D      Y   188_D
#   possible swapping detected:  D   189_D      D   189_D

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    M     1_D      M     1_D    66.785     0    0.596   1.062    69.196    0.000    0.000
LGA    N     2_D      N     2_D    70.224     0    0.703   0.838    72.359    0.000    0.000
LGA    S     3_D      S     3_D    69.416     0    0.717   0.855    72.025    0.000    0.000
LGA    I     4_D      I     4_D    63.970     0    0.577   1.462    65.943    0.000    0.000
LGA    T     5_D      T     5_D    67.130     0    0.555   0.952    70.390    0.000    0.000
LGA    H     6_D      H     6_D    67.519     0    0.608   0.622    70.141    0.000    0.000
LGA    A     7_D      A     7_D    61.665     0    0.599   0.594    63.697    0.000    0.000
LGA    E     8_D      E     8_D    56.296     0    0.650   0.736    58.463    0.000    0.000
LGA    F     9_D      F     9_D    55.873     0    0.637   0.622    57.328    0.000    0.000
LGA    E    10_D      E    10_D    52.421     0    0.621   1.062    55.596    0.000    0.000
LGA    F    11_D      F    11_D    45.808     0    0.652   1.357    48.241    0.000    0.000
LGA    S    12_D      S    12_D    42.230     0    0.656   0.580    44.374    0.000    0.000
LGA    L    13_D      L    13_D    40.349     0    0.641   0.664    41.334    0.000    0.000
LGA    L    14_D      L    14_D    35.699     0    0.649   0.541    38.900    0.000    0.000
LGA    E    15_D      E    15_D    29.896     0    0.654   1.182    32.215    0.000    0.000
LGA    N    16_D      N    16_D    31.339     0    0.646   1.132    34.153    0.000    0.000
LGA    V    17_D      V    17_D    28.216     0    0.026   0.994    29.537    0.000    0.000
LGA    K    18_D      K    18_D    24.143     0    0.195   1.011    27.019    0.000    0.000
LGA    Y    19_D      Y    19_D    19.618     0    0.166   1.273    21.222    0.000    0.000
LGA    E    20_D      E    20_D    14.956     0    0.642   1.512    18.852    0.000    0.000
LGA    T    21_D      T    21_D     9.988     0    0.076   1.120    12.552    3.690    2.109
LGA    E    22_D      E    22_D     3.836     0    0.537   1.077     5.937   29.405   36.614
LGA    D    23_D      D    23_D     7.457     0    0.242   1.111     9.897   12.143    6.667
LGA    E    24_D      E    24_D     6.318     0    0.217   0.889    10.946   19.405   11.693
LGA    V    25_D      V    25_D     2.827     0    0.605   0.577     5.114   39.524   55.170
LGA    P    26_D      P    26_D     7.794     0    0.630   0.616     9.857   14.762   10.000
LGA    I    27_D      I    27_D     5.687     0    0.068   0.996     7.540   30.476   23.690
LGA    V    28_D      V    28_D     3.296     0    0.117   1.316     6.791   56.190   45.646
LGA    L    29_D      L    29_D     1.262     0    0.066   0.218     2.033   72.976   73.988
LGA    E    30_D      E    30_D     2.850     0    0.081   0.681     6.587   62.976   42.540
LGA    Y    31_D      Y    31_D     1.121     0    0.314   1.466     7.287   81.548   57.698
LGA    K    32_D      K    32_D     2.956     0    0.038   0.649     5.698   59.048   43.386
LGA    E    33_D      E    33_D     3.319     0    0.030   0.835     7.625   53.571   37.249
LGA    E    34_D      E    34_D     1.870     0    0.043   1.678     5.031   75.119   63.810
LGA    I    35_D      I    35_D     0.871     0    0.029   0.898     3.191   85.952   76.607
LGA    I    36_D      I    36_D     2.068     0    0.037   0.999     2.947   70.833   63.988
LGA    N    37_D      N    37_D     1.753     0    0.031   1.052     3.402   77.143   68.155
LGA    L    38_D      L    38_D     0.996     0    0.036   1.112     4.608   88.214   77.619
LGA    I    39_D      I    39_D     1.734     0    0.036   0.104     3.134   77.143   67.202
LGA    K    40_D      K    40_D     1.573     0    0.035   1.136     8.129   83.810   58.571
LGA    K    41_D      K    41_D     1.368     0    0.026   0.844     7.745   81.548   55.397
LGA    F    42_D      F    42_D     2.095     0    0.031   0.387     5.992   70.952   47.446
LGA    S    43_D      S    43_D     1.759     0    0.145   0.660     2.297   72.976   71.587
LGA    N    44_D      N    44_D     0.701     0    0.287   0.379     2.356   88.214   80.714
LGA    S    45_D      S    45_D     2.062     0    0.318   0.747     4.945   66.905   59.365
LGA    G    46_D      G    46_D     2.124     0    0.478   0.478     3.878   61.429   61.429
LGA    Q    47_D      Q    47_D     3.045     0    0.574   1.454    10.781   71.548   36.349
LGA    S    48_D      S    48_D     2.791     0    0.052   0.086     5.007   45.714   43.175
LGA    G    49_D      G    49_D     5.991     0    0.549   0.549     5.991   26.429   26.429
LGA    M    50_D      M    50_D     3.159     0    0.561   1.378     8.449   62.500   40.952
LGA    S    51_D      S    51_D     5.017     0    0.649   0.759     9.821   34.881   24.524
LGA    A    52_D      A    52_D     6.621     0    0.036   0.039     8.034   19.524   16.571
LGA    P    53_D      P    53_D     5.230     0    0.083   0.158     6.867   35.238   27.551
LGA    I    54_D      I    54_D     2.459     0    0.076   1.078     3.575   61.429   63.512
LGA    T    55_D      T    55_D     3.846     0    0.044   1.034     7.793   48.333   36.871
LGA    A    56_D      A    56_D     3.366     0    0.044   0.047     4.466   57.738   53.619
LGA    S    57_D      S    57_D     2.090     0    0.036   0.658     2.877   62.857   62.222
LGA    I    58_D      I    58_D     3.208     0    0.035   1.286     5.691   48.810   39.048
LGA    I    59_D      I    59_D     3.451     0    0.063   0.645     4.839   50.119   46.071
LGA    T    60_D      T    60_D     2.548     0    0.065   1.223     5.564   49.167   45.442
LGA    N    61_D      N    61_D     5.879     0    0.047   0.207     8.516   20.714   14.107
LGA    C    62_D      C    62_D     7.217     0    0.055   0.779     8.822   10.000    8.810
LGA    I    63_D      I    63_D     5.908     0    0.029   1.082     7.737   15.833   32.738
LGA    K    64_D      K    64_D     8.014     0    0.031   1.214    13.705    4.643    2.593
LGA    N    65_D      N    65_D    11.467     0    0.037   0.310    13.211    0.119    0.060
LGA    L    66_D      L    66_D    11.674     0    0.053   0.090    13.378    0.000    0.000
LGA    M    67_D      M    67_D    10.411     0    0.081   0.763    12.712    0.000    3.869
LGA    A    68_D      A    68_D    13.697     0    0.247   0.244    16.006    0.000    0.000
LGA    F    69_D      F    69_D    16.023     0    0.282   1.317    21.603    0.000    0.000
LGA    K    70_D      K    70_D    17.516     0    0.545   0.895    23.876    0.000    0.000
LGA    P    71_D      P    71_D    19.840     0    0.667   0.744    21.554    0.000    0.000
LGA    I    72_D      I    72_D    18.158     0    0.362   0.664    21.283    0.000    0.000
LGA    G    73_D      G    73_D    22.554     0    0.522   0.522    23.596    0.000    0.000
LGA    P    74_D      P    74_D    26.220     0    0.613   0.687    28.669    0.000    0.000
LGA    L    75_D      L    75_D    23.738     0    0.028   0.082    24.997    0.000    0.000
LGA    V    76_D      V    76_D    23.494     0    0.637   1.429    26.038    0.000    0.000
LGA    G    77_D      G    77_D    21.397     0    0.161   0.161    22.834    0.000    0.000
LGA    N    78_D      N    78_D    23.346     0    0.123   1.081    23.977    0.000    0.000
LGA    E    79_D      E    79_D    22.831     0    0.634   0.743    25.900    0.000    0.000
LGA    E    80_D      E    80_D    22.050     0    0.713   1.004    22.050    0.000    0.000
LGA    E    81_D      E    81_D    19.200     0    0.668   1.354    20.816    0.000    0.000
LGA    W    82_D      W    82_D    19.528     0    0.039   1.139    23.462    0.000    0.000
LGA    N    83_D      N    83_D    25.054     0    0.576   0.619    29.719    0.000    0.000
LGA    Y    84_D      Y    84_D    26.378     0    0.283   1.237    29.631    0.000    0.000
LGA    N    85_D      N    85_D    29.421     0    0.241   0.840    31.793    0.000    0.000
LGA    S    86_D      S    86_D    32.738     0    0.661   0.915    34.832    0.000    0.000
LGA    D    87_D      D    87_D    34.461     0    0.070   0.205    37.566    0.000    0.000
LGA    D    88_D      D    88_D    30.831     0    0.517   1.034    31.620    0.000    0.000
LGA    S    89_D      S    89_D    29.878     0    0.589   0.507    30.634    0.000    0.000
LGA    F    90_D      F    90_D    27.473     0    0.596   0.702    30.759    0.000    0.000
LGA    Q    91_D      Q    91_D    24.063     0    0.039   1.478    26.510    0.000    0.000
LGA    N    92_D      N    92_D    24.890     0    0.261   1.179    24.890    0.000    0.000
LGA    N    93_D      N    93_D    26.392     0    0.670   0.596    32.751    0.000    0.000
LGA    R    94_D      R    94_D    20.430     0    0.465   1.368    24.233    0.000    0.000
LGA    L    95_D      L    95_D    16.724     0    0.510   1.079    18.311    0.000    0.000
LGA    S    96_D      S    96_D    18.240     0    0.669   0.914    20.332    0.000    0.000
LGA    A    97_D      A    97_D    17.544     0    0.646   0.598    18.847    0.000    0.000
LGA    V    98_D      V    98_D    21.088     0    0.170   1.218    23.491    0.000    0.000
LGA    F    99_D      F    99_D    27.026     0    0.131   1.243    28.364    0.000    0.000
LGA    K   100_D      K   100_D    32.025     0    0.092   1.072    34.321    0.000    0.000
LGA    T   101_D      T   101_D    38.315     0    0.189   1.032    40.600    0.000    0.000
LGA    G   102_D      G   102_D    42.345     0    0.213   0.213    42.345    0.000    0.000
LGA    L   103_D      L   103_D    40.747     0    0.035   1.010    45.993    0.000    0.000
LGA    N   104_D      N   104_D    40.961     0    0.571   0.491    46.989    0.000    0.000
LGA    G   105_D      G   105_D    36.128     0    0.108   0.108    37.401    0.000    0.000
LGA    K   106_D      K   106_D    33.356     0    0.135   0.808    38.729    0.000    0.000
LGA    P   107_D      P   107_D    26.859     0    0.053   0.260    29.151    0.000    0.000
LGA    Y   108_D      Y   108_D    26.174     0    0.068   1.333    32.765    0.000    0.000
LGA    Y   109_D      Y   109_D    21.535     0    0.092   0.456    23.752    0.000    0.000
LGA    L   110_D      L   110_D    23.381     0    0.663   1.054    27.330    0.000    0.000
LGA    D   111_D      D   111_D    21.258     0    0.481   1.375    22.846    0.000    0.000
LGA    A   112_D      A   112_D    24.327     0    0.634   0.608    25.943    0.000    0.000
LGA    I   113_D      I   113_D    26.579     0    0.078   0.647    29.711    0.000    0.000
LGA    T   114_D      T   114_D    29.278     0    0.039   1.135    30.238    0.000    0.000
LGA    F   115_D      F   115_D    33.365     0    0.062   0.114    35.009    0.000    0.000
LGA    V   116_D      V   116_D    35.186     0    0.131   0.132    36.689    0.000    0.000
LGA    G   117_D      G   117_D    40.170     0    0.575   0.575    40.170    0.000    0.000
LGA    E   118_D      E   118_D    41.673     0    0.121   1.244    47.497    0.000    0.000
LGA    E   119_D      E   119_D    39.673     0    0.050   0.307    45.375    0.000    0.000
LGA    E   120_D      E   120_D    34.375     0    0.034   1.023    36.365    0.000    0.000
LGA    Y   121_D      Y   121_D    32.427     0    0.700   1.197    33.070    0.000    0.000
LGA    D   122_D      D   122_D    31.454     0    0.148   0.856    35.444    0.000    0.000
LGA    T   123_D      T   123_D    27.959     0    0.105   1.185    29.351    0.000    0.000
LGA    F   124_D      F   124_D    27.211     0    0.119   1.201    27.954    0.000    0.000
LGA    H   125_D      H   125_D    26.321     0    0.221   1.272    26.932    0.000    0.000
LGA    G   126_D      G   126_D    25.851     0    0.247   0.247    26.932    0.000    0.000
LGA    H   127_D      H   127_D    26.120     0    0.095   0.420    27.876    0.000    0.000
LGA    V   128_D      V   128_D    26.219     0    0.589   0.499    26.219    0.000    0.000
LGA    E   129_D      E   129_D    25.581     0    0.474   0.922    26.164    0.000    0.000
LGA    G   130_D      G   130_D    26.467     0    0.103   0.103    27.499    0.000    0.000
LGA    I   131_D      I   131_D    26.991     0    0.610   1.567    30.939    0.000    0.000
LGA    S   132_D      S   132_D    26.116     0    0.608   0.784    27.587    0.000    0.000
LGA    S   133_D      S   133_D    21.324     0    0.613   0.703    23.281    0.000    0.000
LGA    R   134_D      R   134_D    25.627     0    0.167   1.259    28.106    0.000    0.000
LGA    Q   135_D      Q   135_D    27.511     0    0.041   0.841    29.628    0.000    0.000
LGA    Y   136_D      Y   136_D    31.869     0    0.070   1.140    42.483    0.000    0.000
LGA    L   137_D      L   137_D    32.425     0    0.080   0.283    35.809    0.000    0.000
LGA    K   138_D      K   138_D    33.903     0    0.611   0.888    35.634    0.000    0.000
LGA    G   139_D      G   139_D    35.629     0    0.193   0.193    35.629    0.000    0.000
LGA    F   140_D      F   140_D    33.824     0    0.095   1.275    36.145    0.000    0.000
LGA    P   141_D      P   141_D    33.271     0    0.050   0.239    34.768    0.000    0.000
LGA    F   142_D      F   142_D    31.977     0    0.577   1.081    33.251    0.000    0.000
LGA    F   143_D      F   143_D    32.325     0    0.145   0.985    34.210    0.000    0.000
LGA    P   144_D      P   144_D    34.225     0    0.077   0.408    34.570    0.000    0.000
LGA    K   145_D      K   145_D    35.325     0    0.213   1.034    38.023    0.000    0.000
LGA    T   146_D      T   146_D    38.206     0    0.604   1.195    39.577    0.000    0.000
LGA    F   147_D      F   147_D    36.401     0    0.039   1.261    40.022    0.000    0.000
LGA    Y   148_D      Y   148_D    34.722     0    0.598   1.221    35.596    0.000    0.000
LGA    I   149_D      I   149_D    34.941     0    0.162   0.186    36.223    0.000    0.000
LGA    N   150_D      N   150_D    33.844     0    0.085   0.344    34.232    0.000    0.000
LGA    V   151_D      V   151_D    34.961     0    0.127   0.214    35.973    0.000    0.000
LGA    Y   152_D      Y   152_D    34.690     0    0.076   1.498    45.183    0.000    0.000
LGA    K   153_D      K   153_D    33.939     0    0.265   1.220    34.916    0.000    0.000
LGA    D   154_D      D   154_D    34.707     0    0.587   1.011    37.470    0.000    0.000
LGA    F   155_D      F   155_D    38.819     0    0.649   0.650    42.941    0.000    0.000
LGA    E   156_D      E   156_D    43.617     0    0.541   1.302    46.077    0.000    0.000
LGA    N   157_D      N   157_D    47.715     0    0.570   1.087    50.190    0.000    0.000
LGA    K   158_D      K   158_D    48.696     0    0.557   0.992    54.282    0.000    0.000
LGA    D   159_D      D   159_D    48.080     0    0.122   1.236    48.244    0.000    0.000
LGA    E   160_D      E   160_D    49.877     0    0.138   1.155    54.448    0.000    0.000
LGA    N   161_D      N   161_D    46.286     0    0.686   0.831    50.354    0.000    0.000
LGA    N   162_D      N   162_D    39.723     0    0.120   0.937    41.880    0.000    0.000
LGA    L   163_D      L   163_D    35.919     0    0.563   1.046    40.679    0.000    0.000
LGA    C   164_D      C   164_D    34.213     0    0.268   0.379    36.858    0.000    0.000
LGA    S   165_D      S   165_D    38.331     0    0.129   0.279    41.124    0.000    0.000
LGA    G   166_D      G   166_D    38.654     0    0.031   0.031    41.977    0.000    0.000
LGA    D   167_D      D   167_D    42.062     0    0.543   1.251    44.603    0.000    0.000
LGA    D   168_D      D   168_D    44.816     0    0.255   1.086    48.297    0.000    0.000
LGA    G   169_D      G   169_D    50.012     0    0.537   0.537    50.135    0.000    0.000
LGA    E   170_D      E   170_D    51.018     0    0.577   0.471    57.745    0.000    0.000
LGA    Y   171_D      Y   171_D    45.610     0    0.046   1.063    47.380    0.000    0.000
LGA    T   172_D      T   172_D    42.769     0    0.045   0.257    47.205    0.000    0.000
LGA    Y   173_D      Y   173_D    35.899     0    0.097   1.107    38.422    0.000    0.000
LGA    R   174_D      R   174_D    35.359     0    0.586   1.175    45.801    0.000    0.000
LGA    I   175_D      I   175_D    32.315     0    0.059   0.727    34.326    0.000    0.000
LGA    K   176_D      K   176_D    33.490     0    0.621   0.580    34.192    0.000    0.000
LGA    Y   177_D      Y   177_D    35.171     0    0.045   1.303    37.854    0.000    0.000
LGA    P   178_D      P   178_D    40.076     0    0.698   0.675    41.137    0.000    0.000
LGA    E   179_D      E   179_D    41.113     0    0.145   1.165    48.547    0.000    0.000
LGA    Q   180_D      Q   180_D    35.634     0    0.646   0.742    37.599    0.000    0.000
LGA    L   181_D      L   181_D    34.210     0    0.053   1.177    35.090    0.000    0.000
LGA    E   182_D      E   182_D    36.309     0    0.037   1.368    41.210    0.000    0.000
LGA    E   183_D      E   183_D    36.454     0    0.044   1.073    37.254    0.000    0.000
LGA    V   184_D      V   184_D    34.147     0    0.036   0.058    35.095    0.000    0.000
LGA    F   185_D      F   185_D    35.255     0    0.282   1.182    37.678    0.000    0.000
LGA    N   186_D      N   186_D    38.724     0    0.158   1.099    42.041    0.000    0.000
LGA    Y   187_D      Y   187_D    38.191     0    0.464   1.358    41.402    0.000    0.000
LGA    Y   188_D      Y   188_D    36.424     0    0.326   1.364    38.058    0.000    0.000
LGA    D   189_D      D   189_D    41.614     0    0.066   1.280    45.478    0.000    0.000
LGA    K   190_D      K   190_D    40.737     0    0.402   1.424    44.768    0.000    0.000
LGA    F   191_D      F   191_D    45.497     0    0.560   0.568    52.350    0.000    0.000
LGA    T   192_D      T   192_D    48.130     0    0.236   1.180    51.385    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):    20.250         20.110                 20.290           11.779   10.015

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  194  192    4.0     31    2.50    15.755    13.500     1.194

LGA_LOCAL      RMSD:   2.497  Number of atoms:   31  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  31.494  Number of assigned atoms:  192 
Std_ASGN_ATOMS RMSD:  20.250  Standard rmsd on all 192 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.301231 * X  +   0.452579 * Y  +  -0.839305 * Z  +  -8.535323
  Y_new =   0.662974 * X  +  -0.533231 * Y  +  -0.525480 * Z  +   8.898452
  Z_new =  -0.685365 * X  +  -0.714728 * Y  +  -0.139422 * Z  + -28.376373 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  1.997273  0.755104 -1.763447   [DEG:  114.4353   43.2643 -101.0381 ]
ZXZ: -1.011414  1.710674 -2.377164   [DEG:  -57.9497   98.0144 -136.2015 ]
 
# END of job
