
#######################################################
#                                                     #
#                        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  158 ( 1268),  selected  157 , name one
# Molecule2: number of CA atoms  157 ( 1259),  selected  157 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:A  -ch2:A  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    49     109_A - 157_A       4.79    23.47
  LCS_AVERAGE:     27.20

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    28      30_A - 57_A        1.98    18.69
  LCS_AVERAGE:     13.25

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    21      87_A - 107_A       0.97    19.88
  LCS_AVERAGE:      8.97

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  157
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     L     1_A     L     1_A      3   26   34      0    3   15   17   22   25   26   27   28   28   29   29   31   35   38   43   44   49   51   55 
LCS_GDT     S     2_A     S     2_A     11   26   34      9   10   11   18   23   25   26   27   28   28   29   29   32   36   41   45   46   51   54   56 
LCS_GDT     D     3_A     D     3_A     11   26   34      9   10   17   19   23   25   26   27   28   28   29   29   30   31   34   45   46   48   53   56 
LCS_GDT     R     4_A     R     4_A     11   26   34      9   10   10   17   23   25   26   27   28   28   29   29   29   30   32   35   40   43   48   54 
LCS_GDT     E     5_A     E     5_A     11   26   34      9   10   14   19   23   25   26   27   28   28   29   29   31   36   40   43   47   51   54   55 
LCS_GDT     L     6_A     L     6_A     11   26   34      9   13   17   19   23   25   26   27   28   28   29   35   36   39   46   47   48   51   54   55 
LCS_GDT     E     7_A     E     7_A     11   26   34      9   10   17   19   23   25   26   27   28   28   29   29   31   35   38   43   44   49   54   55 
LCS_GDT     A     8_A     A     8_A     11   26   34      9   13   17   19   23   25   26   27   28   28   29   29   31   35   38   43   47   51   54   55 
LCS_GDT     S     9_A     S     9_A     11   26   43      9   10   10   18   23   25   26   27   28   28   31   36   42   45   46   47   49   51   54   55 
LCS_GDT     L    10_A     L    10_A     16   26   43      9   11   16   19   22   25   26   27   28   28   34   38   42   45   46   47   49   51   54   55 
LCS_GDT     Q    11_A     Q    11_A     16   26   43      5   12   16   19   23   25   26   27   28   28   30   35   42   45   46   47   49   51   54   55 
LCS_GDT     A    12_A     A    12_A     16   26   43      4   13   16   19   23   25   26   27   28   28   32   38   42   45   46   47   49   51   54   55 
LCS_GDT     F    13_A     F    13_A     16   26   43      4   13   17   19   23   25   26   27   28   33   35   38   42   45   46   47   49   51   54   55 
LCS_GDT     F    14_A     F    14_A     16   26   43      6   13   17   19   23   25   26   27   28   28   30   35   42   45   46   47   49   51   54   55 
LCS_GDT     E    15_A     E    15_A     16   26   43     10   13   17   19   23   25   26   27   28   28   29   35   42   45   46   47   49   51   54   55 
LCS_GDT     V    16_A     V    16_A     16   26   43     10   13   17   19   23   25   26   27   28   33   35   38   42   45   46   47   49   51   54   55 
LCS_GDT     H    17_A     H    17_A     16   26   43     10   13   17   19   23   25   26   27   30   33   35   38   42   45   46   47   49   51   54   56 
LCS_GDT     T    18_A     T    18_A     16   26   43     10   13   17   19   23   25   26   27   28   28   29   35   42   45   46   47   49   51   54   56 
LCS_GDT     R    19_A     R    19_A     16   26   43     10   13   17   19   23   25   26   27   28   29   34   38   42   45   46   47   49   51   54   55 
LCS_GDT     L    20_A     L    20_A     16   26   43     10   13   17   19   23   25   26   27   30   33   35   38   42   45   46   47   49   51   54   60 
LCS_GDT     V    21_A     V    21_A     16   26   43     10   13   17   19   23   25   26   27   30   33   35   38   42   45   46   47   52   58   67   70 
LCS_GDT     H    22_A     H    22_A     16   26   43     10   13   17   19   23   25   26   27   30   33   35   38   42   45   46   47   49   51   57   62 
LCS_GDT     R    23_A     R    23_A     16   26   43     10   13   17   19   23   25   26   27   30   33   35   38   42   45   46   47   49   51   56   60 
LCS_GDT     L    24_A     L    24_A     16   26   43     10   13   17   19   23   25   26   27   30   33   35   38   42   45   46   47   51   59   67   70 
LCS_GDT     A    25_A     A    25_A     16   26   43     10   13   17   19   23   25   26   27   30   33   35   38   42   45   46   53   56   61   67   70 
LCS_GDT     G    26_A     G    26_A      5   26   43      3    4    6   12   23   25   26   27   30   33   35   38   42   45   46   47   52   59   67   70 
LCS_GDT     I    27_A     I    27_A      5    7   43      2    4    5    8   14   22   25   27   30   33   35   38   42   45   48   53   58   61   67   70 
LCS_GDT     E    28_A     E    28_A      5   23   44      2    4    5    8   12   18   25   27   30   33   35   38   42   47   53   54   58   61   67   70 
LCS_GDT     P    29_A     P    29_A      5   27   44      3    4   15   19   21   23   26   31   34   37   38   39   43   47   53   54   58   61   66   70 
LCS_GDT     D    30_A     D    30_A     20   28   44      3    4    8   20   26   29   30   34   36   37   38   39   43   47   53   54   58   60   63   66 
LCS_GDT     P    31_A     P    31_A     20   28   44      5   17   19   20   26   29   30   34   36   37   38   39   43   47   53   54   58   61   64   68 
LCS_GDT     R    32_A     R    32_A     20   28   44      5   17   19   20   26   29   30   34   36   37   38   39   42   45   53   53   58   61   64   69 
LCS_GDT     F    33_A     F    33_A     20   28   44     12   17   19   20   26   29   30   34   36   37   38   39   43   47   53   54   58   61   67   70 
LCS_GDT     E    34_A     E    34_A     20   28   44     12   17   19   20   26   29   30   34   36   37   38   39   43   47   53   54   58   61   67   70 
LCS_GDT     I    35_A     I    35_A     20   28   44     12   17   19   20   26   29   30   34   36   37   38   39   43   47   53   54   58   61   67   70 
LCS_GDT     L    36_A     L    36_A     20   28   44     12   17   19   20   26   29   30   34   36   37   38   41   43   47   53   54   58   61   67   70 
LCS_GDT     D    37_A     D    37_A     20   28   44     12   17   19   20   26   29   30   34   36   37   38   41   44   47   53   54   58   61   67   70 
LCS_GDT     K    38_A     K    38_A     20   28   44     12   17   19   20   26   29   30   34   36   37   39   41   44   47   53   54   58   61   67   70 
LCS_GDT     Y    39_A     Y    39_A     20   28   44     12   17   19   20   26   29   30   34   36   37   41   44   46   48   53   54   58   61   67   70 
LCS_GDT     I    40_A     I    40_A     20   28   44     12   17   19   20   26   29   30   34   39   41   41   44   46   48   53   54   58   61   67   70 
LCS_GDT     F    41_A     F    41_A     20   28   44     12   17   19   20   26   29   30   34   36   40   41   44   45   47   53   54   58   61   67   70 
LCS_GDT     R    42_A     R    42_A     20   28   44     12   17   19   20   26   29   30   34   38   41   41   44   46   48   53   54   58   61   67   70 
LCS_GDT     Q    43_A     Q    43_A     20   28   44     12   17   19   20   26   29   30   34   36   37   38   39   43   47   53   54   58   61   67   70 
LCS_GDT     I    44_A     I    44_A     20   28   44     11   17   19   20   26   29   30   34   36   37   38   39   43   47   53   54   58   61   67   70 
LCS_GDT     V    45_A     V    45_A     20   28   44      9   17   19   20   26   29   30   34   36   37   38   39   43   47   53   54   58   61   67   70 
LCS_GDT     A    46_A     A    46_A     20   28   44      9   17   19   20   26   29   30   34   36   37   38   39   43   47   53   54   58   61   67   70 
LCS_GDT     D    47_A     D    47_A     20   28   44     12   17   19   20   26   29   30   34   36   37   38   39   42   46   53   53   58   61   67   70 
LCS_GDT     N    48_A     N    48_A     20   28   44      7   17   19   20   26   29   30   34   36   37   38   39   43   47   53   54   58   61   67   70 
LCS_GDT     P    49_A     P    49_A     20   28   44      5   17   19   20   26   29   30   34   36   37   38   39   43   47   53   54   58   61   67   70 
LCS_GDT     E    50_A     E    50_A     20   28   44      5    5   10   19   21   25   30   34   36   37   38   39   43   47   53   54   58   61   67   70 
LCS_GDT     E    51_A     E    51_A     13   28   44     10   12   13   15   20   25   30   34   36   37   38   39   41   45   53   54   58   61   67   70 
LCS_GDT     R    52_A     R    52_A     13   28   44     10   12   15   20   26   29   30   34   36   37   38   39   43   47   53   54   58   61   67   70 
LCS_GDT     E    53_A     E    53_A     13   28   44     10   12   13   20   26   29   30   34   36   37   38   39   43   47   53   54   58   61   67   70 
LCS_GDT     K    54_A     K    54_A     13   28   44     10   12   15   20   26   29   30   34   36   37   38   39   43   47   53   54   58   61   67   70 
LCS_GDT     I    55_A     I    55_A     13   28   44     10   12   13   18   26   29   30   34   36   37   38   39   43   47   53   54   58   61   67   70 
LCS_GDT     R    56_A     R    56_A     13   28   44     10   12   13   18   26   29   30   34   36   37   38   39   44   47   53   54   58   61   67   70 
LCS_GDT     L    57_A     L    57_A     13   28   44     10   12   13   18   25   29   30   34   36   37   38   39   43   47   53   54   58   61   67   70 
LCS_GDT     D    58_A     D    58_A     13   22   44     10   12   13   18   26   29   30   34   36   37   38   39   43   47   53   54   58   61   67   70 
LCS_GDT     Y    59_A     Y    59_A     13   22   44     10   12   13   15   18   22   28   34   36   37   38   41   43   47   53   54   58   61   67   70 
LCS_GDT     G    60_A     G    60_A     13   22   44     10   12   13   15   18   22   27   31   36   37   38   41   43   47   53   54   58   61   67   70 
LCS_GDT     R    61_A     R    61_A     13   22   44      8   12   13   16   22   29   30   34   36   37   38   39   43   47   53   54   58   61   67   70 
LCS_GDT     A    62_A     A    62_A     13   22   44      8   12   13   15   18   22   28   34   36   37   38   39   43   47   53   54   58   60   66   70 
LCS_GDT     A    63_A     A    63_A      3   22   44      3    4   10   18   23   29   30   34   36   37   38   39   43   47   53   54   58   61   67   70 
LCS_GDT     E    64_A     E    64_A      8   11   44      7    8    9   11   17   18   18   22   26   32   35   38   42   47   53   54   58   61   67   70 
LCS_GDT     I    65_A     I    65_A      8   11   44      7    8    9   10   10   11   13   16   20   25   29   36   41   45   48   54   58   61   66   69 
LCS_GDT     F    66_A     F    66_A      8   11   44      7    8    9   10   10   11   13   16   20   25   29   31   39   45   48   53   58   61   67   70 
LCS_GDT     R    67_A     R    67_A      8   11   44      7    8    9   10   10   11   12   16   19   21   29   36   41   45   50   54   58   61   67   70 
LCS_GDT     D    68_A     D    68_A      8   11   44      7    8    9   10   10   11   13   16   19   21   23   34   41   45   48   53   58   61   67   70 
LCS_GDT     A    69_A     A    69_A      8   11   44      7    8    9   10   10   11   13   16   19   21   23   25   29   40   46   52   58   61   64   69 
LCS_GDT     L    70_A     L    70_A      8   11   44      7    8    9   10   10   11   12   16   19   21   23   25   29   38   46   52   58   61   67   70 
LCS_GDT     A    71_A     A    71_A      8   11   44      7    8    9   10   10   11   12   16   19   21   23   25   29   38   46   53   58   61   67   70 
LCS_GDT     R    72_A     R    72_A      3   11   25      3    3    7   10   10   11   12   15   19   21   23   30   39   45   48   53   58   61   64   69 
LCS_GDT     D    73_A     D    73_A      4   11   28      3    4    4    8    9   10   13   14   15   16   19   21   24   31   43   51   52   57   62   65 
LCS_GDT     I    74_A     I    74_A      4   11   35      3    4    7   10   10   11   13   15   19   21   23   25   32   40   46   51   58   61   64   67 
LCS_GDT     T    75_A     T    75_A      4    7   35      3    4    5    8    9   10   13   14   19   21   30   36   41   45   48   52   58   61   64   68 
LCS_GDT     T    76_A     T    76_A      4   12   35      3    4    4    7    9   10   14   15   17   21   23   30   40   45   48   53   58   61   67   70 
LCS_GDT     P    77_A     P    77_A      4   12   35      3    4    5    8    9   12   18   21   23   25   29   30   35   41   48   53   58   61   67   70 
LCS_GDT     E    78_A     E    78_A     10   12   35      5   10   11   11   12   14   16   19   23   25   29   30   30   36   41   47   56   60   67   70 
LCS_GDT     A    79_A     A    79_A     10   12   35      5   10   11   11   12   14   15   16   18   21   23   25   28   36   44   52   57   61   67   70 
LCS_GDT     F    80_A     F    80_A     10   12   35      5   10   11   11   12   15   21   23   24   26   29   30   30   36   41   50   56   61   67   70 
LCS_GDT     N    81_A     N    81_A     10   12   35      5   10   11   11   17   19   20   23   24   26   29   30   30   36   41   46   52   60   67   70 
LCS_GDT     A    82_A     A    82_A     10   12   35      5   10   11   11   12   14   15   19   23   25   29   30   30   36   41   46   54   60   67   70 
LCS_GDT     Y    83_A     Y    83_A     10   12   35      4   10   11   11   12   14   15   19   24   25   27   30   30   34   37   45   51   52   61   68 
LCS_GDT     L    84_A     L    84_A     10   12   35      5   10   11   11   12   21   22   23   24   26   29   31   34   37   40   44   47   51   56   61 
LCS_GDT     E    85_A     E    85_A     10   12   35      5   10   11   11   12   14   18   21   23   26   29   30   30   32   34   37   42   49   56   63 
LCS_GDT     A    86_A     A    86_A     10   22   35      5   10   11   11   17   21   22   23   24   26   29   30   32   39   40   44   47   51   56   61 
LCS_GDT     L    87_A     L    87_A     21   22   35      3    6   11   19   21   22   23   24   25   28   30   31   34   37   40   44   46   49   53   58 
LCS_GDT     G    88_A     G    88_A     21   22   35      6   14   20   20   21   22   24   24   26   28   30   31   34   39   40   44   47   51   56   60 
LCS_GDT     P    89_A     P    89_A     21   22   35      6   15   20   20   21   22   24   25   26   29   31   31   34   39   40   44   47   51   56   63 
LCS_GDT     D    90_A     D    90_A     21   22   35      7   18   20   20   21   22   24   25   26   29   31   31   34   39   40   44   47   51   56   63 
LCS_GDT     A    91_A     A    91_A     21   22   35      6   18   20   20   21   22   24   25   26   29   31   31   34   39   40   45   51   51   56   63 
LCS_GDT     V    92_A     V    92_A     21   22   35      6   18   20   20   21   22   24   25   26   29   31   31   34   39   41   45   51   54   65   69 
LCS_GDT     R    93_A     R    93_A     21   22   35      6   18   20   20   21   22   24   25   26   29   31   31   34   39   41   45   51   57   65   69 
LCS_GDT     T    94_A     T    94_A     21   22   35      7   18   20   20   21   22   24   25   26   29   31   31   34   39   40   44   51   53   61   69 
LCS_GDT     V    95_A     V    95_A     21   22   35     12   18   20   20   21   22   24   25   26   29   31   32   34   39   41   45   51   59   67   70 
LCS_GDT     Q    96_A     Q    96_A     21   22   35     12   18   20   20   21   22   24   25   27   31   33   34   36   39   42   53   58   61   67   70 
LCS_GDT     D    97_A     D    97_A     21   22   35     12   18   20   20   21   22   24   25   26   29   31   31   34   39   41   47   50   57   67   70 
LCS_GDT     L    98_A     L    98_A     21   22   35     12   18   20   20   21   22   24   25   27   29   31   31   34   39   41   47   51   59   67   70 
LCS_GDT     T    99_A     T    99_A     21   22   35     12   18   20   20   24   27   30   32   34   37   38   39   41   45   50   54   58   61   67   70 
LCS_GDT     R   100_A     R   100_A     21   22   35     12   18   20   20   21   22   30   34   36   37   38   39   43   47   53   54   57   60   67   70 
LCS_GDT     R   101_A     R   101_A     21   22   35     12   18   20   20   21   22   24   27   31   33   36   39   43   47   53   54   57   60   67   70 
LCS_GDT     F   102_A     F   102_A     21   22   35     12   18   20   20   21   22   24   34   36   37   38   39   43   47   53   54   57   60   67   70 
LCS_GDT     V   103_A     V   103_A     21   22   35     12   18   20   20   21   22   24   25   26   29   32   39   43   47   53   54   57   60   67   70 
LCS_GDT     D   104_A     D   104_A     21   22   35     12   18   20   20   21   22   24   25   26   29   31   35   43   47   53   54   57   60   61   66 
LCS_GDT     V   105_A     V   105_A     21   22   35     12   18   20   20   21   22   24   26   28   29   31   31   39   43   50   53   54   57   60   65 
LCS_GDT     I   106_A     I   106_A     21   22   35     12   18   20   20   21   22   24   25   26   29   31   31   34   41   47   51   54   55   58   64 
LCS_GDT     R   107_A     R   107_A     21   22   35      8   18   20   20   21   22   24   25   26   28   31   31   33   37   40   44   47   54   57   58 
LCS_GDT     A   108_A     A   108_A      3   22   35      3    3    4    7   13   14   16   20   26   29   31   35   43   47   53   54   57   60   61   66 
LCS_GDT     D   109_A     D   109_A     10   12   49      6    9   11   11   12   14   16   18   23   25   31   35   43   47   53   54   57   60   61   66 
LCS_GDT     P   110_A     P   110_A     10   12   49      8    9   11   11   12   14   16   18   23   25   31   35   43   47   53   54   57   60   61   65 
LCS_GDT     E   111_A     E   111_A     10   12   49      8    9   11   11   12   14   16   18   23   25   31   37   42   47   53   54   57   60   61   65 
LCS_GDT     A   112_A     A   112_A     10   12   49      8    9   11   11   12   14   16   22   32   38   39   44   46   48   53   54   57   60   61   66 
LCS_GDT     I   113_A     I   113_A     10   12   49      8    9   11   11   12   14   16   18   23   33   38   44   46   48   53   54   57   60   61   66 
LCS_GDT     A   114_A     A   114_A     10   12   49      8    9   11   11   12   14   16   18   23   27   39   44   46   48   53   54   57   60   61   66 
LCS_GDT     K   115_A     K   115_A     10   12   49      8    9   11   18   23   27   31   35   39   41   41   44   46   48   53   54   57   60   61   66 
LCS_GDT     L   116_A     L   116_A     10   12   49      8   12   14   18   23   27   31   35   39   41   41   44   46   48   53   54   57   60   61   66 
LCS_GDT     L   117_A     L   117_A     10   12   49      8    9   11   11   12   18   20   30   36   38   41   44   46   48   53   54   57   60   61   66 
LCS_GDT     N   118_A     N   118_A     10   12   49      4    9   11   11   18   24   31   35   39   41   41   44   46   48   53   54   57   60   61   66 
LCS_GDT     I   119_A     I   119_A      3   20   49      4    8   14   16   22   27   31   35   39   41   41   44   46   48   49   51   56   60   67   70 
LCS_GDT     S   120_A     S   120_A     11   20   49      5    7   10   11   14   17   20   23   27   34   36   43   46   48   49   51   53   57   60   66 
LCS_GDT     K   121_A     K   121_A     11   20   49      5   10   12   16   22   27   31   35   39   41   41   44   46   48   49   51   54   58   62   66 
LCS_GDT     E   122_A     E   122_A     11   20   49      5   10   13   16   22   27   31   34   38   41   41   44   46   48   49   53   58   61   67   70 
LCS_GDT     D   123_A     D   123_A     12   20   49      5   10   13   16   22   27   31   35   39   41   41   44   46   48   49   53   58   61   67   70 
LCS_GDT     V   124_A     V   124_A     13   20   49      5   10   14   18   23   27   31   35   39   41   41   44   46   48   49   53   58   61   67   70 
LCS_GDT     Q   125_A     Q   125_A     13   20   49      5   12   14   18   23   27   31   35   39   41   41   44   46   48   49   53   58   61   64   69 
LCS_GDT     G   126_A     G   126_A     13   20   49      5   10   14   18   23   27   31   35   39   41   41   44   46   48   49   53   58   61   65   69 
LCS_GDT     L   127_A     L   127_A     13   20   49      5   12   14   18   23   27   31   35   39   41   41   44   46   48   49   53   58   61   65   69 
LCS_GDT     A   128_A     A   128_A     13   20   49      6   12   14   18   23   27   31   35   39   41   41   44   46   48   49   51   55   60   64   68 
LCS_GDT     R   129_A     R   129_A     13   20   49      5   12   14   18   23   27   31   35   39   41   41   44   46   48   49   51   54   57   64   67 
LCS_GDT     A   130_A     A   130_A     13   20   49      6   12   14   18   23   27   31   35   39   41   41   44   46   48   49   51   54   57   60   66 
LCS_GDT     G   131_A     G   131_A     13   20   49      5   12   14   18   23   27   31   35   39   41   41   44   46   48   49   51   54   57   60   64 
LCS_GDT     E   132_A     E   132_A     13   20   49      6   12   14   18   23   27   31   35   39   41   41   44   46   48   49   51   54   57   60   64 
LCS_GDT     A   133_A     A   133_A     13   20   49      6   12   14   18   23   27   31   35   39   41   41   44   46   48   49   51   54   57   60   64 
LCS_GDT     A   134_A     A   134_A     13   20   49      6   12   14   18   23   27   31   35   39   41   41   44   46   48   49   51   54   57   60   64 
LCS_GDT     I   135_A     I   135_A     13   20   49      6   12   14   17   23   27   31   35   39   41   41   44   46   48   49   51   54   57   60   64 
LCS_GDT     E   136_A     E   136_A     13   20   49      6   12   14   18   23   27   31   35   39   41   41   44   46   48   49   51   54   57   60   64 
LCS_GDT     R   137_A     R   137_A     13   20   49      4   10   14   18   23   27   31   35   39   41   41   44   46   48   49   51   54   57   60   64 
LCS_GDT     G   138_A     G   138_A     12   20   49      3    7   13   17   23   27   31   35   39   41   41   44   46   48   49   51   54   57   60   64 
LCS_GDT     E   139_A     E   139_A      9   19   49      3    7   11   16   23   25   31   34   39   41   41   44   46   48   49   51   54   57   60   64 
LCS_GDT     G   140_A     G   140_A      4   18   49      3    3    4    5    6   18   29   35   39   41   41   44   46   48   49   51   53   57   60   64 
LCS_GDT     A   141_A     A   141_A     17   18   49      5   15   16   18   18   19   20   35   39   41   41   44   46   48   49   51   53   57   60   64 
LCS_GDT     S   142_A     S   142_A     17   18   49      9   15   16   18   23   27   31   35   39   41   41   44   46   48   49   51   54   57   60   64 
LCS_GDT     L   143_A     L   143_A     17   18   49      9   15   16   18   18   24   31   34   39   41   41   44   46   48   49   51   54   57   60   64 
LCS_GDT     G   144_A     G   144_A     17   18   49      9   15   16   18   18   27   31   35   39   41   41   44   46   48   49   51   54   57   60   64 
LCS_GDT     V   145_A     V   145_A     17   18   49      9   15   16   18   23   27   31   35   39   41   41   44   46   48   49   51   54   57   64   68 
LCS_GDT     L   146_A     L   146_A     17   18   49      9   15   16   18   23   27   31   35   39   41   41   44   46   48   49   51   54   57   65   69 
LCS_GDT     R   147_A     R   147_A     17   18   49      9   15   16   18   23   27   31   35   39   41   41   44   46   48   49   51   54   57   60   64 
LCS_GDT     E   148_A     E   148_A     17   18   49      9   15   16   18   23   27   31   35   39   41   41   44   46   48   49   51   54   57   65   68 
LCS_GDT     L   149_A     L   149_A     17   18   49      9   15   16   18   19   25   31   35   39   41   41   44   46   48   49   53   57   61   67   70 
LCS_GDT     R   150_A     R   150_A     17   18   49      9   15   16   18   22   25   31   35   39   41   41   44   46   48   49   51   54   57   65   69 
LCS_GDT     K   151_A     K   151_A     17   18   49      9   15   16   18   23   27   31   35   39   41   41   44   46   48   49   51   54   57   65   69 
LCS_GDT     I   152_A     I   152_A     17   18   49      9   15   16   18   18   25   31   35   39   41   41   44   46   48   49   53   57   61   67   70 
LCS_GDT     E   153_A     E   153_A     17   18   49      7   15   16   18   18   23   31   35   39   41   41   44   46   48   49   51   54   59   67   70 
LCS_GDT     K   154_A     K   154_A     17   18   49      5   15   16   18   18   25   31   35   39   41   41   44   46   48   49   51   54   57   60   70 
LCS_GDT     K   155_A     K   155_A     17   18   49      3   15   16   18   18   25   31   35   39   41   41   44   46   48   49   51   54   59   67   70 
LCS_GDT     R   156_A     R   156_A     17   18   49      3    4   11   18   18   19   19   23   24   38   39   42   45   47   49   51   54   58   67   70 
LCS_GDT     N   157_A     N   157_A     17   18   49      3    3    6   18   18   19   19   21   34   38   39   44   46   48   49   51   53   57   60   64 
LCS_AVERAGE  LCS_A:  16.47  (   8.97   13.25   27.20 )

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     12     18     20     20     26     29     31     35     39     41     41     44     46     48     53     54     58     61     67     70 
GDT PERCENT_AT   7.64  11.46  12.74  12.74  16.56  18.47  19.75  22.29  24.84  26.11  26.11  28.03  29.30  30.57  33.76  34.39  36.94  38.85  42.68  44.59
GDT RMS_LOCAL    0.25   0.62   0.81   0.81   1.82   2.07   2.30   2.68   2.91   3.04   3.04   3.34   3.68   3.84   5.27   5.43   6.01   6.45   7.31   7.45
GDT RMS_ALL_AT  16.68  19.78  19.74  19.74  18.90  19.53  22.49  23.31  22.90  23.06  23.06  22.82  23.38  23.34  20.39  20.09  17.38  16.85  16.00  16.03

# Checking swapping
#   possible swapping detected:  E     5_A      E     5_A
#   possible swapping detected:  E     7_A      E     7_A
#   possible swapping detected:  F    13_A      F    13_A
#   possible swapping detected:  F    14_A      F    14_A
#   possible swapping detected:  E    15_A      E    15_A
#   possible swapping detected:  E    28_A      E    28_A
#   possible swapping detected:  F    33_A      F    33_A
#   possible swapping detected:  E    34_A      E    34_A
#   possible swapping detected:  D    58_A      D    58_A
#   possible swapping detected:  E    64_A      E    64_A
#   possible swapping detected:  F    80_A      F    80_A
#   possible swapping detected:  E    85_A      E    85_A
#   possible swapping detected:  F   102_A      F   102_A
#   possible swapping detected:  D   104_A      D   104_A
#   possible swapping detected:  E   111_A      E   111_A
#   possible swapping detected:  E   122_A      E   122_A
#   possible swapping detected:  D   123_A      D   123_A
#   possible swapping detected:  E   136_A      E   136_A
#   possible swapping detected:  E   139_A      E   139_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    L     1_A      L     1_A    33.518     0    0.135   1.173    36.123    0.000    0.000
LGA    S     2_A      S     2_A    26.386     0    0.598   0.581    28.846    0.000    0.000
LGA    D     3_A      D     3_A    24.823     0    0.042   1.242    26.470    0.000    0.000
LGA    R     4_A      R     4_A    28.377     0    0.038   1.119    31.178    0.000    0.000
LGA    E     5_A      E     5_A    30.627     0    0.046   0.632    31.500    0.000    0.000
LGA    L     6_A      L     6_A    28.158     0    0.080   0.175    29.281    0.000    0.000
LGA    E     7_A      E     7_A    29.398     0    0.056   0.734    31.517    0.000    0.000
LGA    A     8_A      A     8_A    33.362     0    0.032   0.033    34.817    0.000    0.000
LGA    S     9_A      S     9_A    33.407     0    0.073   0.200    33.865    0.000    0.000
LGA    L    10_A      L    10_A    31.140     0    0.260   0.238    32.182    0.000    0.000
LGA    Q    11_A      Q    11_A    34.843     0    0.051   1.283    42.449    0.000    0.000
LGA    A    12_A      A    12_A    36.938     0    0.091   0.104    38.210    0.000    0.000
LGA    F    13_A      F    13_A    31.345     0    0.060   1.325    33.235    0.000    0.000
LGA    F    14_A      F    14_A    29.990     0    0.051   1.367    31.281    0.000    0.000
LGA    E    15_A      E    15_A    34.785     0    0.050   0.259    42.356    0.000    0.000
LGA    V    16_A      V    16_A    32.908     0    0.079   1.135    33.599    0.000    0.000
LGA    H    17_A      H    17_A    28.312     0    0.088   0.891    29.871    0.000    0.000
LGA    T    18_A      T    18_A    30.177     0    0.081   1.014    33.467    0.000    0.000
LGA    R    19_A      R    19_A    32.352     0    0.029   1.242    41.776    0.000    0.000
LGA    L    20_A      L    20_A    28.958     0    0.049   0.058    30.151    0.000    0.000
LGA    V    21_A      V    21_A    26.600     0    0.051   0.089    27.504    0.000    0.000
LGA    H    22_A      H    22_A    29.815     0    0.077   1.144    31.575    0.000    0.000
LGA    R    23_A      R    23_A    29.844     0    0.048   1.801    35.733    0.000    0.000
LGA    L    24_A      L    24_A    25.978     0    0.041   0.152    27.337    0.000    0.000
LGA    A    25_A      A    25_A    27.114     0    0.638   0.587    28.180    0.000    0.000
LGA    G    26_A      G    26_A    29.970     0    0.186   0.186    29.970    0.000    0.000
LGA    I    27_A      I    27_A    29.079     0    0.102   0.209    31.520    0.000    0.000
LGA    E    28_A      E    28_A    31.417     0    0.158   1.096    33.175    0.000    0.000
LGA    P    29_A      P    29_A    30.291     0    0.196   0.644    34.075    0.000    0.000
LGA    D    30_A      D    30_A    27.756     0    0.615   1.410    29.771    0.000    0.000
LGA    P    31_A      P    31_A    25.900     0    0.144   0.562    30.389    0.000    0.000
LGA    R    32_A      R    32_A    20.287     0    0.062   1.307    26.388    0.000    0.000
LGA    F    33_A      F    33_A    17.439     0    0.190   1.688    19.197    0.000    0.000
LGA    E    34_A      E    34_A    17.387     0    0.070   0.924    24.054    0.000    0.000
LGA    I    35_A      I    35_A    14.583     0    0.039   0.065    20.562    0.000    0.000
LGA    L    36_A      L    36_A     9.268     0    0.026   1.001    11.572    5.833    3.869
LGA    D    37_A      D    37_A    10.020     0    0.053   1.334    15.288    2.619    1.310
LGA    K    38_A      K    38_A     8.502     0    0.039   0.803    14.836   11.905    5.291
LGA    Y    39_A      Y    39_A     5.570     0    0.040   1.435    14.735   26.786   10.675
LGA    I    40_A      I    40_A     4.853     0    0.035   0.123     8.337   25.000   20.655
LGA    F    41_A      F    41_A     6.945     0    0.073   1.671    14.141   16.548    6.710
LGA    R    42_A      R    42_A     5.173     0    0.059   1.094     8.938   17.619   13.550
LGA    Q    43_A      Q    43_A     9.636     0    0.032   1.114    14.098    2.619    1.323
LGA    I    44_A      I    44_A    12.745     0    0.051   1.010    15.701    0.000    0.000
LGA    V    45_A      V    45_A    12.697     0    0.043   0.057    15.818    0.000    0.408
LGA    A    46_A      A    46_A    15.739     0    0.057   0.063    19.925    0.000    0.000
LGA    D    47_A      D    47_A    19.870     0    0.077   1.179    23.754    0.000    0.000
LGA    N    48_A      N    48_A    21.883     0    0.331   0.445    25.246    0.000    0.000
LGA    P    49_A      P    49_A    20.963     0    0.065   0.366    24.255    0.000    0.000
LGA    E    50_A      E    50_A    23.324     0    0.177   1.336    26.532    0.000    0.000
LGA    E    51_A      E    51_A    20.066     0    0.252   1.603    24.812    0.000    0.000
LGA    R    52_A      R    52_A    15.247     0    0.068   1.503    17.712    0.000    0.000
LGA    E    53_A      E    53_A    17.100     0    0.042   0.975    21.063    0.000    0.000
LGA    K    54_A      K    54_A    18.838     0    0.066   0.964    28.038    0.000    0.000
LGA    I    55_A      I    55_A    12.772     0    0.028   0.773    14.919    0.000    0.357
LGA    R    56_A      R    56_A    10.096     0    0.047   1.829    14.507    0.000    0.346
LGA    L    57_A      L    57_A    15.699     0    0.069   1.002    22.362    0.000    0.000
LGA    D    58_A      D    58_A    16.586     0    0.056   0.196    20.215    0.000    0.000
LGA    Y    59_A      Y    59_A    12.037     0    0.048   1.122    13.650    0.000    1.548
LGA    G    60_A      G    60_A    13.625     0    0.042   0.042    16.510    0.000    0.000
LGA    R    61_A      R    61_A    19.197     0    0.073   1.646    30.171    0.000    0.000
LGA    A    62_A      A    62_A    18.801     0    0.588   0.587    19.239    0.000    0.000
LGA    A    63_A      A    63_A    16.799     0    0.063   0.069    17.073    0.000    0.000
LGA    E    64_A      E    64_A    17.867     0    0.168   1.043    20.135    0.000    0.000
LGA    I    65_A      I    65_A    22.326     0    0.048   1.517    24.493    0.000    0.000
LGA    F    66_A      F    66_A    20.381     0    0.057   1.077    23.570    0.000    0.000
LGA    R    67_A      R    67_A    23.066     0    0.059   1.707    27.663    0.000    0.000
LGA    D    68_A      D    68_A    28.660     0    0.024   1.022    32.247    0.000    0.000
LGA    A    69_A      A    69_A    29.740     0    0.060   0.059    32.587    0.000    0.000
LGA    L    70_A      L    70_A    29.761     0    0.041   0.109    33.979    0.000    0.000
LGA    A    71_A      A    71_A    34.653     0    0.122   0.136    39.058    0.000    0.000
LGA    R    72_A      R    72_A    37.763     0    0.277   1.216    41.199    0.000    0.000
LGA    D    73_A      D    73_A    40.371     0    0.444   1.402    43.907    0.000    0.000
LGA    I    74_A      I    74_A    37.913     0    0.614   0.591    38.109    0.000    0.000
LGA    T    75_A      T    75_A    37.775     0    0.706   0.683    41.934    0.000    0.000
LGA    T    76_A      T    76_A    33.950     0    0.522   1.323    36.836    0.000    0.000
LGA    P    77_A      P    77_A    27.914     0    0.045   0.536    30.288    0.000    0.000
LGA    E    78_A      E    78_A    31.444     0    0.580   1.220    34.437    0.000    0.000
LGA    A    79_A      A    79_A    37.057     0    0.094   0.094    38.082    0.000    0.000
LGA    F    80_A      F    80_A    33.369     0    0.039   1.738    34.481    0.000    0.000
LGA    N    81_A      N    81_A    32.528     0    0.040   0.889    35.944    0.000    0.000
LGA    A    82_A      A    82_A    39.419     0    0.028   0.028    42.236    0.000    0.000
LGA    Y    83_A      Y    83_A    41.094     0    0.089   1.281    42.460    0.000    0.000
LGA    L    84_A      L    84_A    37.997     0    0.086   0.162    40.391    0.000    0.000
LGA    E    85_A      E    85_A    39.456     0    0.072   0.461    43.438    0.000    0.000
LGA    A    86_A      A    86_A    46.255     0    0.092   0.086    48.839    0.000    0.000
LGA    L    87_A      L    87_A    46.555     0    0.357   0.462    47.427    0.000    0.000
LGA    G    88_A      G    88_A    48.230     0    0.188   0.188    48.230    0.000    0.000
LGA    P    89_A      P    89_A    46.512     0    0.125   0.396    49.891    0.000    0.000
LGA    D    90_A      D    90_A    43.172     0    0.076   1.173    47.387    0.000    0.000
LGA    A    91_A      A    91_A    40.123     0    0.038   0.038    41.761    0.000    0.000
LGA    V    92_A      V    92_A    39.373     0    0.070   0.103    42.268    0.000    0.000
LGA    R    93_A      R    93_A    37.800     0    0.038   1.667    40.805    0.000    0.000
LGA    T    94_A      T    94_A    33.523     0    0.064   0.061    35.695    0.000    0.000
LGA    V    95_A      V    95_A    31.007     0    0.035   1.184    34.524    0.000    0.000
LGA    Q    96_A      Q    96_A    31.784     0    0.036   1.027    39.467    0.000    0.000
LGA    D    97_A      D    97_A    28.472     0    0.068   1.190    32.137    0.000    0.000
LGA    L    98_A      L    98_A    23.845     0    0.070   1.105    25.893    0.000    0.000
LGA    T    99_A      T    99_A    24.041     0    0.040   0.190    26.215    0.000    0.000
LGA    R   100_A      R   100_A    25.430     0    0.031   1.805    33.035    0.000    0.000
LGA    R   101_A      R   101_A    19.707     0    0.057   0.921    23.750    0.000    0.000
LGA    F   102_A      F   102_A    17.035     0    0.091   0.269    18.210    0.000    0.000
LGA    V   103_A      V   103_A    20.655     0    0.059   1.325    24.836    0.000    0.000
LGA    D   104_A      D   104_A    21.289     0    0.039   0.130    25.573    0.000    0.000
LGA    V   105_A      V   105_A    15.485     0    0.015   0.033    17.275    0.000    0.000
LGA    I   106_A      I   106_A    16.499     0    0.178   1.170    18.539    0.000    0.000
LGA    R   107_A      R   107_A    22.184     0    0.369   1.681    31.607    0.000    0.000
LGA    A   108_A      A   108_A    18.900     0    0.713   0.657    19.400    0.000    0.000
LGA    D   109_A      D   109_A    16.287     0    0.414   1.348    17.201    0.000    0.000
LGA    P   110_A      P   110_A    14.615     0    0.041   0.352    17.845    0.000    0.000
LGA    E   111_A      E   111_A    11.642     0    0.021   1.193    18.552    1.310    0.582
LGA    A   112_A      A   112_A     8.558     0    0.041   0.038    10.112   10.595    8.762
LGA    I   113_A      I   113_A     7.379     0    0.026   0.651     9.926   12.976    6.845
LGA    A   114_A      A   114_A     7.004     0    0.042   0.045     8.247   21.429   18.095
LGA    K   115_A      K   115_A     2.615     0    0.038   0.241    10.195   66.548   38.889
LGA    L   116_A      L   116_A     1.199     0    0.048   1.371     4.046   61.905   60.893
LGA    L   117_A      L   117_A     6.128     0    0.196   0.879     9.431   22.262   13.155
LGA    N   118_A      N   118_A     3.735     0    0.463   0.927     6.589   45.238   34.286
LGA    I   119_A      I   119_A     3.561     0    0.573   1.310     7.926   42.857   32.202
LGA    S   120_A      S   120_A     6.725     0    0.562   0.982    10.444   27.381   18.492
LGA    K   121_A      K   121_A     3.293     0    0.194   1.204     8.753   50.833   34.921
LGA    E   122_A      E   122_A     4.848     0    0.028   0.840     7.060   37.262   25.767
LGA    D   123_A      D   123_A     4.002     0    0.033   0.279     6.987   49.048   36.071
LGA    V   124_A      V   124_A     1.360     0    0.034   0.067     2.659   79.524   75.646
LGA    Q   125_A      Q   125_A     2.436     0    0.061   0.671     6.711   64.881   42.910
LGA    G   126_A      G   126_A     2.310     0    0.044   0.044     2.322   68.810   68.810
LGA    L   127_A      L   127_A     1.206     0    0.103   1.094     5.130   79.286   64.583
LGA    A   128_A      A   128_A     2.661     0    0.043   0.043     3.459   61.071   58.857
LGA    R   129_A      R   129_A     2.944     0    0.053   1.398     6.757   60.952   42.294
LGA    A   130_A      A   130_A     1.124     0    0.072   0.070     1.681   83.810   85.143
LGA    G   131_A      G   131_A     1.139     0    0.079   0.079     1.539   79.286   79.286
LGA    E   132_A      E   132_A     2.244     0    0.022   0.964     7.348   70.833   47.354
LGA    A   133_A      A   133_A     1.053     0    0.017   0.018     1.461   85.952   85.048
LGA    A   134_A      A   134_A     1.259     0    0.089   0.097     1.913   79.405   79.810
LGA    I   135_A      I   135_A     2.620     0    0.036   0.111     4.044   60.952   53.036
LGA    E   136_A      E   136_A     1.213     0    0.091   1.011     5.182   83.810   66.931
LGA    R   137_A      R   137_A     2.079     0    0.714   1.154     5.346   55.595   58.009
LGA    G   138_A      G   138_A     3.505     0    0.683   0.683     4.180   47.143   47.143
LGA    E   139_A      E   139_A     4.184     0    0.713   1.056    11.304   55.000   27.460
LGA    G   140_A      G   140_A     3.551     0    0.609   0.609     3.976   48.452   48.452
LGA    A   141_A      A   141_A     4.331     0    0.687   0.657     6.800   52.500   44.667
LGA    S   142_A      S   142_A     1.235     0    0.069   0.064     2.806   73.095   67.778
LGA    L   143_A      L   143_A     4.337     0    0.035   1.395    10.277   43.452   25.893
LGA    G   144_A      G   144_A     3.701     0    0.056   0.056     3.701   54.048   54.048
LGA    V   145_A      V   145_A     1.429     0    0.032   0.033     3.335   79.286   69.864
LGA    L   146_A      L   146_A     2.570     0    0.075   1.419     8.501   67.024   44.107
LGA    R   147_A      R   147_A     2.621     0    0.028   1.404     6.232   69.048   46.537
LGA    E   148_A      E   148_A     1.997     0    0.034   0.772     6.709   72.976   45.238
LGA    L   149_A      L   149_A     2.983     0    0.046   1.180     4.660   59.286   53.274
LGA    R   150_A      R   150_A     2.666     0    0.071   1.080     8.281   64.881   37.662
LGA    K   151_A      K   151_A     0.652     0    0.055   0.637     7.263   81.667   58.148
LGA    I   152_A      I   152_A     3.764     0    0.020   0.150     6.354   44.167   34.107
LGA    E   153_A      E   153_A     5.014     0    0.111   0.882     7.485   29.048   21.376
LGA    K   154_A      K   154_A     2.880     0    0.083   0.941     3.732   53.571   54.921
LGA    K   155_A      K   155_A     4.401     0    0.204   0.771    10.403   31.429   22.169
LGA    R   156_A      R   156_A     8.624     0    0.024   0.981    17.675    5.952    2.165
LGA    N   157_A      N   157_A     7.283     0    0.234   0.637    10.595   11.667    7.083

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      157     628    628  100.00    1259   1259  100.00               157
SUMMARY(RMSD_GDC):    14.368         14.321                 14.957           16.665   13.470

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  158  157    4.0     35    2.68    20.223    19.004     1.258

LGA_LOCAL      RMSD:   2.682  Number of atoms:   35  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  23.310  Number of assigned atoms:  157 
Std_ASGN_ATOMS RMSD:  14.368  Standard rmsd on all 157 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.953553 * X  +   0.288448 * Y  +   0.086802 * Z  +   4.328875
  Y_new =   0.171642 * X  +   0.757104 * Y  +  -0.630343 * Z  +   6.054294
  Z_new =  -0.247539 * X  +  -0.586166 * Y  +  -0.771449 * Z  + -20.782770 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  2.963497  0.250139 -2.491833   [DEG:  169.7959   14.3319 -142.7715 ]
ZXZ:  0.136845  2.451911 -2.742010   [DEG:    7.8407  140.4842 -157.1056 ]
 
# END of job
