
#######################################################
#                                                     #
#                        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:    48     110_A - 157_A       4.79    23.58
  LCS_AVERAGE:     27.41

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    27      30_A - 56_A        1.96    18.22
  LCS_AVERAGE:     12.80

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    19      31_A - 49_A        0.91    16.96
  LCS_AVERAGE:      8.24

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   33      0   12   15   19   22   25   26   27   27   28   29   29   30   33   36   40   46   51   55   56 
LCS_GDT     S     2_A     S     2_A     11   26   33      9   10   12   18   23   25   26   27   27   28   29   29   30   33   36   41   47   53   55   56 
LCS_GDT     D     3_A     D     3_A     11   26   33      9   10   16   20   23   25   26   27   27   28   29   29   30   32   32   35   39   43   48   54 
LCS_GDT     R     4_A     R     4_A     11   26   33      9   10   11   15   23   25   26   27   27   28   29   29   30   32   32   33   37   43   45   54 
LCS_GDT     E     5_A     E     5_A     11   26   33      9   10   12   18   23   25   26   27   27   28   29   29   30   33   37   43   50   53   55   56 
LCS_GDT     L     6_A     L     6_A     11   26   33      9   11   16   20   23   25   26   27   27   28   29   30   34   39   43   48   50   53   55   56 
LCS_GDT     E     7_A     E     7_A     11   26   33      9   10   16   20   23   25   26   27   27   28   29   29   30   33   36   40   46   51   55   56 
LCS_GDT     A     8_A     A     8_A     11   26   33      9   11   16   20   23   25   26   27   27   28   29   29   30   33   36   40   47   53   55   56 
LCS_GDT     S     9_A     S     9_A     11   26   42      9   10   10   18   23   25   26   27   27   28   29   35   40   43   46   49   52   53   55   56 
LCS_GDT     L    10_A     L    10_A     16   26   42      9   10   15   18   22   25   26   27   27   28   29   35   40   43   47   49   52   53   55   56 
LCS_GDT     Q    11_A     Q    11_A     16   26   42      8   13   15   20   23   25   26   27   27   28   29   33   37   42   46   49   52   53   55   56 
LCS_GDT     A    12_A     A    12_A     16   26   42      8   13   15   20   23   25   26   27   27   28   29   35   40   43   47   49   52   53   55   56 
LCS_GDT     F    13_A     F    13_A     16   26   42      8   13   16   20   23   25   26   27   29   31   34   35   40   43   47   49   52   53   55   56 
LCS_GDT     F    14_A     F    14_A     16   26   42      8   13   16   20   23   25   26   27   27   28   29   33   39   43   47   49   52   53   55   56 
LCS_GDT     E    15_A     E    15_A     16   26   42      8   13   16   20   23   25   26   27   27   28   29   33   39   43   47   49   52   53   55   56 
LCS_GDT     V    16_A     V    16_A     16   26   42      8   13   16   20   23   25   26   27   30   31   34   35   40   43   47   49   52   53   55   56 
LCS_GDT     H    17_A     H    17_A     16   26   42      8   13   16   20   23   25   26   27   30   32   34   36   40   43   47   49   52   53   56   61 
LCS_GDT     T    18_A     T    18_A     16   26   42      8   13   16   20   23   25   26   27   27   28   29   35   40   43   47   49   52   53   56   61 
LCS_GDT     R    19_A     R    19_A     16   26   42      8   13   16   20   23   25   26   27   27   31   34   35   40   43   47   49   52   53   55   58 
LCS_GDT     L    20_A     L    20_A     16   26   42      6   13   16   20   23   25   26   27   30   32   34   36   40   43   47   49   52   53   56   61 
LCS_GDT     V    21_A     V    21_A     16   26   42      3    5   15   20   23   25   26   27   30   32   34   36   40   43   47   52   56   62   67   71 
LCS_GDT     H    22_A     H    22_A     16   26   42      8   13   16   20   23   25   26   27   30   32   34   36   40   43   47   49   52   58   67   70 
LCS_GDT     R    23_A     R    23_A     16   26   42      3   13   16   20   23   25   26   27   30   31   34   36   40   43   47   49   52   53   56   62 
LCS_GDT     L    24_A     L    24_A     16   26   42      4   13   16   20   23   25   26   27   27   32   34   36   40   43   47   49   55   60   67   71 
LCS_GDT     A    25_A     A    25_A     16   26   42      3   12   16   20   23   25   26   27   28   32   33   36   41   47   51   56   60   62   67   71 
LCS_GDT     G    26_A     G    26_A     14   26   43      3    5   12   20   22   25   26   27   30   32   34   36   40   43   47   52   57   62   67   71 
LCS_GDT     I    27_A     I    27_A      4    7   45      3    4    5    6    7   13   17   25   30   32   34   36   40   46   51   56   60   62   67   71 
LCS_GDT     E    28_A     E    28_A      4    7   46      3    4    6   10   12   14   19   24   28   32   34   38   41   47   51   56   60   62   67   71 
LCS_GDT     P    29_A     P    29_A      4   26   46      3    4   14   17   20   22   25   29   33   36   37   39   41   47   51   56   60   62   67   71 
LCS_GDT     D    30_A     D    30_A     17   27   46      4   10   12   20   25   28   30   33   35   37   37   39   41   46   50   56   60   62   64   69 
LCS_GDT     P    31_A     P    31_A     19   27   46      8   11   18   20   25   28   30   33   35   37   37   39   41   46   50   56   60   62   65   71 
LCS_GDT     R    32_A     R    32_A     19   27   46      8   15   18   20   25   28   30   33   35   37   37   39   41   46   51   56   60   62   65   71 
LCS_GDT     F    33_A     F    33_A     19   27   46      8   15   18   20   25   28   30   33   35   37   37   39   41   47   51   56   60   62   67   71 
LCS_GDT     E    34_A     E    34_A     19   27   46      8   15   18   20   25   28   30   33   35   37   37   39   41   47   51   56   60   62   67   71 
LCS_GDT     I    35_A     I    35_A     19   27   46      8   15   18   20   25   28   30   33   35   37   37   39   41   47   51   56   60   62   67   71 
LCS_GDT     L    36_A     L    36_A     19   27   46      8   15   18   20   25   28   30   33   35   37   37   39   41   47   51   56   60   62   67   71 
LCS_GDT     D    37_A     D    37_A     19   27   46      8   15   18   20   25   28   30   33   35   37   37   41   44   47   51   56   60   62   67   71 
LCS_GDT     K    38_A     K    38_A     19   27   46      8   15   18   20   25   28   30   33   35   37   37   42   44   47   51   56   60   62   67   71 
LCS_GDT     Y    39_A     Y    39_A     19   27   46      8   14   18   20   25   28   30   33   35   37   37   39   41   47   51   56   60   62   67   71 
LCS_GDT     I    40_A     I    40_A     19   27   46      8   15   18   20   25   28   30   33   35   37   40   43   46   48   51   56   60   62   67   71 
LCS_GDT     F    41_A     F    41_A     19   27   46      3   15   18   20   25   28   30   33   35   37   40   42   46   48   51   56   60   62   67   71 
LCS_GDT     R    42_A     R    42_A     19   27   46      8   15   18   20   25   28   30   33   35   37   40   43   46   48   51   56   60   62   67   71 
LCS_GDT     Q    43_A     Q    43_A     19   27   46      8   15   18   20   25   28   30   33   35   37   37   39   41   47   51   56   60   62   67   71 
LCS_GDT     I    44_A     I    44_A     19   27   46      8   15   18   20   25   28   30   33   35   37   37   39   41   47   51   56   60   62   67   71 
LCS_GDT     V    45_A     V    45_A     19   27   46      8   15   18   20   25   28   30   33   35   37   37   39   41   47   51   56   60   62   67   71 
LCS_GDT     A    46_A     A    46_A     19   27   46      8   15   18   20   25   28   30   33   35   37   37   39   41   47   51   56   60   62   67   71 
LCS_GDT     D    47_A     D    47_A     19   27   46      8   15   18   20   23   28   30   33   35   37   37   39   41   47   51   56   60   62   67   71 
LCS_GDT     N    48_A     N    48_A     19   27   46      8   15   18   20   25   28   30   33   35   37   37   39   41   47   51   56   60   62   67   71 
LCS_GDT     P    49_A     P    49_A     19   27   46      5   10   17   19   25   28   30   33   35   37   37   39   41   47   51   56   60   62   67   71 
LCS_GDT     E    50_A     E    50_A      6   27   46      5    5    7   13   20   21   29   33   35   37   37   39   41   47   51   56   60   62   67   71 
LCS_GDT     E    51_A     E    51_A     12   27   46      5   10   13   14   18   21   27   33   35   37   37   39   41   47   51   56   60   62   67   71 
LCS_GDT     R    52_A     R    52_A     12   27   46      7   11   18   20   25   28   30   33   35   37   37   39   41   47   51   56   60   62   67   71 
LCS_GDT     E    53_A     E    53_A     12   27   46      7   11   13   20   24   28   30   33   35   37   37   39   41   47   51   56   60   62   67   71 
LCS_GDT     K    54_A     K    54_A     12   27   46      7   11   16   20   25   28   30   33   35   37   37   39   41   47   51   56   60   62   67   71 
LCS_GDT     I    55_A     I    55_A     12   27   46      7   11   13   20   25   28   30   33   35   37   37   39   41   47   51   56   60   62   67   71 
LCS_GDT     R    56_A     R    56_A     12   27   46      7   11   13   20   25   28   30   33   35   37   37   39   41   47   51   56   60   62   67   71 
LCS_GDT     L    57_A     L    57_A     12   21   46      7   11   13   20   25   28   30   33   35   37   37   39   41   47   51   56   60   62   67   71 
LCS_GDT     D    58_A     D    58_A     12   21   46      7   11   13   19   25   28   30   33   35   37   37   39   41   47   51   56   60   62   67   71 
LCS_GDT     Y    59_A     Y    59_A     12   21   46      7   11   13   16   18   24   30   33   35   37   37   39   41   47   51   56   60   62   67   71 
LCS_GDT     G    60_A     G    60_A     12   21   46      5   11   13   16   18   23   29   33   35   37   37   39   41   47   51   56   60   62   67   71 
LCS_GDT     R    61_A     R    61_A     12   21   46      5   11   13   17   25   28   30   33   35   37   37   39   41   47   51   56   60   62   67   71 
LCS_GDT     A    62_A     A    62_A     12   21   46      5   11   13   16   19   28   30   33   35   37   37   39   41   46   51   56   60   62   67   71 
LCS_GDT     A    63_A     A    63_A      3   21   46      3    4   11   17   25   28   30   33   35   37   37   39   41   47   51   56   60   62   67   71 
LCS_GDT     E    64_A     E    64_A      9   12   46      4    8   10   11   16   20   24   26   28   31   33   38   41   47   51   56   60   62   67   70 
LCS_GDT     I    65_A     I    65_A      9   12   46      6    8   10   11   11   12   13   17   19   22   32   38   41   47   51   56   60   62   67   70 
LCS_GDT     F    66_A     F    66_A      9   12   46      6    8   10   11   11   12   13   18   22   26   30   35   41   47   51   56   60   62   67   71 
LCS_GDT     R    67_A     R    67_A      9   12   46      6    8   10   11   12   16   16   18   21   24   30   35   41   47   51   56   60   62   67   71 
LCS_GDT     D    68_A     D    68_A      9   12   46      6    8   10   11   11   12   16   18   22   22   28   35   41   47   51   56   60   62   67   71 
LCS_GDT     A    69_A     A    69_A      9   12   46      6    8   10   11   11   12   13   17   22   22   25   32   41   47   51   56   60   62   67   70 
LCS_GDT     L    70_A     L    70_A      9   12   46      6    8   10   11   11   12   14   18   19   21   25   29   35   45   51   56   60   62   67   71 
LCS_GDT     A    71_A     A    71_A      9   12   46      6    8   10   11   11   12   14   17   19   21   24   30   41   47   51   56   60   62   67   71 
LCS_GDT     R    72_A     R    72_A      9   12   46      3    7   10   11   11   12   13   17   19   21   24   32   41   47   51   56   60   62   65   69 
LCS_GDT     D    73_A     D    73_A      4   12   46      3    4    5    6   11   11   13   14   16   19   22   24   38   42   50   56   60   62   65   69 
LCS_GDT     I    74_A     I    74_A      4   12   46      3    7   10   11   11   12   13   17   19   21   24   26   29   42   50   55   60   62   65   68 
LCS_GDT     T    75_A     T    75_A      4   12   35      3    4    4    5    8   11   13   14   19   21   24   26   35   44   50   56   60   62   65   69 
LCS_GDT     T    76_A     T    76_A     11   12   35      6   10   10   11   12   14   15   16   18   21   24   26   30   35   44   51   58   60   63   68 
LCS_GDT     P    77_A     P    77_A     11   12   35      6   10   10   11   14   19   21   23   24   27   28   32   41   47   51   56   60   62   67   71 
LCS_GDT     E    78_A     E    78_A     11   12   35      6   10   10   11   12   14   15   16   18   19   27   32   41   46   51   56   60   62   67   71 
LCS_GDT     A    79_A     A    79_A     11   12   35      6   10   10   11   12   14   15   16   19   20   24   29   35   46   51   56   60   62   67   70 
LCS_GDT     F    80_A     F    80_A     11   12   35      6   10   10   12   16   17   21   23   25   27   28   29   34   40   49   53   57   62   67   71 
LCS_GDT     N    81_A     N    81_A     11   12   35      6   10   10   11   16   19   21   23   25   27   28   29   34   38   44   48   55   60   67   71 
LCS_GDT     A    82_A     A    82_A     11   12   35      5   10   10   11   12   14   15   18   22   25   28   29   34   38   44   49   55   60   67   71 
LCS_GDT     Y    83_A     Y    83_A     11   12   35      5   10   10   11   12   14   15   16   18   24   27   29   32   36   38   44   51   58   64   69 
LCS_GDT     L    84_A     L    84_A     11   12   35      5   10   10   11   12   22   23   23   25   27   29   29   32   38   40   44   49   53   59   68 
LCS_GDT     E    85_A     E    85_A     11   20   35      5   10   10   11   13   17   21   23   25   27   28   29   30   33   34   38   46   53   57   68 
LCS_GDT     A    86_A     A    86_A     11   22   35      3    6   14   18   21   22   23   23   25   27   29   30   34   38   40   44   49   53   56   61 
LCS_GDT     L    87_A     L    87_A     14   22   35      3    3   19   20   21   22   23   25   27   28   29   31   34   38   40   44   49   53   56   61 
LCS_GDT     G    88_A     G    88_A     17   22   35      3    8   15   19   21   22   23   25   27   28   29   31   34   38   40   44   49   53   56   61 
LCS_GDT     P    89_A     P    89_A     17   22   35      7   12   16   20   21   22   23   25   27   28   29   31   34   38   40   44   49   53   56   66 
LCS_GDT     D    90_A     D    90_A     18   22   35      7   14   19   20   21   22   23   25   27   28   29   31   34   38   40   44   49   53   56   61 
LCS_GDT     A    91_A     A    91_A     18   22   35      7   14   19   20   21   22   23   25   27   28   29   31   34   38   40   44   49   53   57   68 
LCS_GDT     V    92_A     V    92_A     18   22   35      7   14   19   20   21   22   23   25   27   28   29   31   34   38   41   44   50   57   64   70 
LCS_GDT     R    93_A     R    93_A     18   22   35      7   14   19   20   21   22   23   25   27   28   29   31   34   38   40   44   49   55   64   71 
LCS_GDT     T    94_A     T    94_A     18   22   35      7   14   19   20   21   22   23   25   27   28   29   31   34   38   40   44   49   53   61   71 
LCS_GDT     V    95_A     V    95_A     18   22   35      7   14   19   20   21   22   23   25   27   28   29   31   34   38   41   48   55   60   67   71 
LCS_GDT     Q    96_A     Q    96_A     18   22   35      7   14   19   20   21   22   23   25   27   28   31   34   35   40   44   54   57   62   67   71 
LCS_GDT     D    97_A     D    97_A     18   22   35      7   14   19   20   21   22   23   25   27   28   29   31   34   38   40   48   52   60   67   71 
LCS_GDT     L    98_A     L    98_A     18   22   35      9   14   19   20   21   22   23   25   27   28   29   31   34   38   40   48   52   60   67   71 
LCS_GDT     T    99_A     T    99_A     18   22   35      7   14   19   20   21   24   29   31   35   37   37   39   41   46   50   56   60   62   67   71 
LCS_GDT     R   100_A     R   100_A     18   22   35      9   14   19   20   21   22   26   33   35   37   37   39   40   43   50   53   57   60   67   71 
LCS_GDT     R   101_A     R   101_A     18   22   35      9   14   19   20   21   22   26   27   27   30   31   39   39   42   50   53   57   60   65   71 
LCS_GDT     F   102_A     F   102_A     18   22   35      9   14   19   20   21   22   23   31   35   37   37   39   40   42   50   53   57   60   67   71 
LCS_GDT     V   103_A     V   103_A     18   22   35      9   14   19   20   21   22   23   25   27   33   33   39   39   42   50   53   57   60   67   71 
LCS_GDT     D   104_A     D   104_A     18   22   35      9   14   19   20   21   22   23   25   27   28   29   35   37   42   50   53   57   58   63   69 
LCS_GDT     V   105_A     V   105_A     18   22   35      9   14   19   20   21   22   25   27   27   28   29   32   36   42   50   51   53   55   63   65 
LCS_GDT     I   106_A     I   106_A     18   22   35      9   14   19   20   21   22   23   25   27   28   29   31   36   40   50   51   53   55   63   65 
LCS_GDT     R   107_A     R   107_A     18   22   35      9   14   19   20   21   22   23   25   27   28   29   31   34   38   40   43   49   51   57   61 
LCS_GDT     A   108_A     A   108_A      3   22   35      3    3    5    9   12   14   16   21   25   27   29   35   37   42   50   53   57   58   65   70 
LCS_GDT     D   109_A     D   109_A     10   11   35      8   10   10   11   12   14   16   20   23   25   29   35   37   42   50   53   57   58   63   69 
LCS_GDT     P   110_A     P   110_A     10   11   48      8   10   10   11   12   14   16   20   23   25   29   35   37   42   50   53   57   58   63   69 
LCS_GDT     E   111_A     E   111_A     10   11   48      8   10   10   11   12   14   16   20   23   25   30   36   43   44   50   53   57   58   63   65 
LCS_GDT     A   112_A     A   112_A     10   11   48      8   10   10   11   12   14   17   21   26   33   39   43   46   48   50   53   57   58   63   69 
LCS_GDT     I   113_A     I   113_A     10   11   48      8   10   10   11   12   14   16   20   23   28   40   43   46   48   50   53   57   58   63   69 
LCS_GDT     A   114_A     A   114_A     10   11   48      8   10   10   11   12   14   16   20   23   37   40   43   46   48   50   53   57   58   63   69 
LCS_GDT     K   115_A     K   115_A     10   11   48      8   10   10   11   13   17   24   29   35   37   40   43   46   48   50   53   57   58   63   69 
LCS_GDT     L   116_A     L   116_A     10   11   48      8   10   10   11   13   18   25   29   35   37   40   43   46   48   50   53   57   58   63   69 
LCS_GDT     L   117_A     L   117_A     10   11   48      6   10   10   13   16   17   19   27   31   37   40   42   45   48   50   53   57   58   63   69 
LCS_GDT     N   118_A     N   118_A     10   11   48      6   10   10   11   12   16   25   29   35   37   40   43   46   48   50   53   57   58   63   69 
LCS_GDT     I   119_A     I   119_A      3   17   48      3    5    9   13   16   17   19   25   33   37   40   43   46   48   49   51   53   60   67   71 
LCS_GDT     S   120_A     S   120_A     10   17   48      5    6    9   11   13   14   16   19   20   24   24   29   37   46   48   51   53   56   62   66 
LCS_GDT     K   121_A     K   121_A     11   17   48      5    7   10   13   14   16   18   25   34   37   40   43   46   48   49   51   57   60   63   71 
LCS_GDT     E   122_A     E   122_A     12   17   48      6    8   12   14   16   17   19   22   28   35   40   43   46   48   51   56   60   62   65   71 
LCS_GDT     D   123_A     D   123_A     12   17   48      5    8   12   14   16   17   19   24   33   37   40   43   46   48   51   56   60   62   65   71 
LCS_GDT     V   124_A     V   124_A     12   17   48      6    8   12   14   16   18   28   29   35   37   40   43   46   48   51   56   60   62   65   71 
LCS_GDT     Q   125_A     Q   125_A     12   17   48      6    9   12   14   22   23   26   29   35   37   40   43   46   48   51   56   60   62   65   71 
LCS_GDT     G   126_A     G   126_A     12   17   48      6    9   12   14   16   18   26   29   35   37   40   43   46   48   51   56   60   62   65   71 
LCS_GDT     L   127_A     L   127_A     12   17   48      5    9   12   14   16   21   26   29   35   37   40   43   46   48   51   56   60   62   65   71 
LCS_GDT     A   128_A     A   128_A     12   17   48      6    9   12   14   16   21   26   29   35   37   40   43   46   48   49   51   54   60   64   68 
LCS_GDT     R   129_A     R   129_A     12   17   48      6    9   12   14   16   21   26   29   35   37   40   43   46   48   49   51   53   56   63   68 
LCS_GDT     A   130_A     A   130_A     12   17   48      5    9   12   14   16   21   26   29   35   37   40   43   46   48   49   51   53   56   63   68 
LCS_GDT     G   131_A     G   131_A     12   17   48      5    9   12   14   16   20   24   29   35   37   40   43   46   48   49   51   53   56   59   66 
LCS_GDT     E   132_A     E   132_A     12   17   48      5    9   12   14   16   20   24   29   35   37   40   43   46   48   49   51   53   54   57   60 
LCS_GDT     A   133_A     A   133_A     12   17   48      5    9   12   14   16   21   26   29   35   37   40   43   46   48   49   51   53   56   59   62 
LCS_GDT     A   134_A     A   134_A     11   17   48      3    8   11   14   16   20   26   29   35   37   40   43   46   48   49   51   53   56   59   62 
LCS_GDT     I   135_A     I   135_A     11   17   48      3    8   11   14   16   17   24   28   35   37   40   43   46   48   49   51   53   56   59   62 
LCS_GDT     E   136_A     E   136_A      8   16   48      3    5    9   12   16   21   26   29   35   37   40   43   46   48   49   51   53   56   59   62 
LCS_GDT     R   137_A     R   137_A      8   16   48      3    5    9   11   16   20   26   29   35   37   40   43   46   48   49   51   53   56   59   62 
LCS_GDT     G   138_A     G   138_A      4   12   48      3    3    4    5    9   12   24   26   31   34   40   43   46   48   49   51   53   56   59   62 
LCS_GDT     E   139_A     E   139_A      3   17   48      3    3    4   10   16   20   24   27   31   34   39   43   46   48   49   51   53   56   59   62 
LCS_GDT     G   140_A     G   140_A     12   18   48      3    6   12   15   16   21   26   29   35   37   40   43   46   48   49   51   53   56   59   62 
LCS_GDT     A   141_A     A   141_A     12   18   48      5   10   12   15   16   18   25   29   35   37   40   43   46   48   49   51   53   56   59   62 
LCS_GDT     S   142_A     S   142_A     13   18   48      5   10   13   15   16   21   26   29   35   37   40   43   46   48   49   51   53   56   59   64 
LCS_GDT     L   143_A     L   143_A     13   18   48      5   10   13   15   16   21   26   29   35   37   40   43   46   48   49   51   53   56   59   62 
LCS_GDT     G   144_A     G   144_A     13   18   48      5   11   13   15   16   21   26   29   35   37   40   43   46   48   49   51   53   56   59   62 
LCS_GDT     V   145_A     V   145_A     13   18   48      5   11   13   15   16   21   26   29   35   37   40   43   46   48   49   51   53   57   64   69 
LCS_GDT     L   146_A     L   146_A     13   18   48      6   11   13   15   16   21   26   29   35   37   40   43   46   48   49   51   53   56   62   69 
LCS_GDT     R   147_A     R   147_A     13   18   48      6   11   13   15   16   21   26   29   35   37   40   43   46   48   49   51   53   56   59   62 
LCS_GDT     E   148_A     E   148_A     13   18   48      6   11   13   15   16   21   26   29   35   37   40   43   46   48   49   51   53   56   63   69 
LCS_GDT     L   149_A     L   149_A     13   18   48      6   11   13   15   16   21   26   29   35   37   40   43   46   48   49   51   55   60   67   71 
LCS_GDT     R   150_A     R   150_A     13   18   48      6   11   13   15   16   21   26   29   35   37   40   43   46   48   49   51   53   56   59   66 
LCS_GDT     K   151_A     K   151_A     13   18   48      6   11   13   15   16   21   26   29   35   37   40   43   46   48   49   51   53   56   61   69 
LCS_GDT     I   152_A     I   152_A     13   18   48      6   11   13   15   16   21   26   29   35   37   40   43   46   48   49   51   55   60   67   71 
LCS_GDT     E   153_A     E   153_A     13   18   48      6   11   13   15   16   21   26   29   35   37   40   43   46   48   49   51   53   60   67   70 
LCS_GDT     K   154_A     K   154_A     13   18   48      5   11   13   15   16   21   26   29   35   37   40   43   46   48   49   51   53   56   59   65 
LCS_GDT     K   155_A     K   155_A     13   18   48      3   10   13   15   16   21   26   29   35   37   40   43   46   48   49   51   53   60   67   70 
LCS_GDT     R   156_A     R   156_A     11   18   48      3    4   10   13   15   18   19   21   24   31   36   38   43   48   49   51   53   60   67   70 
LCS_GDT     N   157_A     N   157_A      9   18   48      3    3    9   13   15   18   19   25   28   31   40   43   46   48   49   51   53   56   59   62 
LCS_AVERAGE  LCS_A:  16.15  (   8.24   12.80   27.41 )

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      9     15     19     20     25     28     30     33     35     37     40     43     46     48     51     56     60     62     67     71 
GDT PERCENT_AT   5.73   9.55  12.10  12.74  15.92  17.83  19.11  21.02  22.29  23.57  25.48  27.39  29.30  30.57  32.48  35.67  38.22  39.49  42.68  45.22
GDT RMS_LOCAL    0.15   0.64   0.99   1.06   1.77   1.88   2.09   2.33   2.51   2.68   3.51   3.89   4.10   4.24   5.52   5.69   5.95   6.12   7.17   7.41
GDT RMS_ALL_AT  26.45  16.99  19.58  17.62  19.23  19.05  19.47  19.63  19.69  19.70  23.19  23.51  23.09  23.14  17.04  17.20  17.15  17.01  15.98  15.93

# 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:  E    15_A      E    15_A
#   possible swapping detected:  D    30_A      D    30_A
#   possible swapping detected:  E    34_A      E    34_A
#   possible swapping detected:  D    37_A      D    37_A
#   possible swapping detected:  F    41_A      F    41_A
#   possible swapping detected:  D    47_A      D    47_A
#   possible swapping detected:  E    50_A      E    50_A
#   possible swapping detected:  D    58_A      D    58_A
#   possible swapping detected:  E    64_A      E    64_A
#   possible swapping detected:  F    66_A      F    66_A
#   possible swapping detected:  D    68_A      D    68_A
#   possible swapping detected:  D    73_A      D    73_A
#   possible swapping detected:  D    90_A      D    90_A
#   possible swapping detected:  F   102_A      F   102_A
#   possible swapping detected:  E   111_A      E   111_A
#   possible swapping detected:  E   132_A      E   132_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    39.458     0    0.461   1.330    44.684    0.000    0.000
LGA    S     2_A      S     2_A    35.145     0    0.588   0.551    36.998    0.000    0.000
LGA    D     3_A      D     3_A    32.550     0    0.036   1.264    33.853    0.000    0.000
LGA    R     4_A      R     4_A    36.615     0    0.024   1.007    42.091    0.000    0.000
LGA    E     5_A      E     5_A    35.774     0    0.039   0.651    37.507    0.000    0.000
LGA    L     6_A      L     6_A    29.551     0    0.070   1.382    31.745    0.000    0.000
LGA    E     7_A      E     7_A    30.365     0    0.037   0.377    33.856    0.000    0.000
LGA    A     8_A      A     8_A    35.137     0    0.024   0.022    37.256    0.000    0.000
LGA    S     9_A      S     9_A    32.307     0    0.084   0.215    33.071    0.000    0.000
LGA    L    10_A      L    10_A    27.720     0    0.248   0.221    29.212    0.000    0.000
LGA    Q    11_A      Q    11_A    32.035     0    0.056   1.595    37.557    0.000    0.000
LGA    A    12_A      A    12_A    31.997     0    0.084   0.116    33.230    0.000    0.000
LGA    F    13_A      F    13_A    24.669     0    0.093   1.453    27.261    0.000    0.000
LGA    F    14_A      F    14_A    23.555     0    0.062   1.167    24.744    0.000    0.000
LGA    E    15_A      E    15_A    28.374     0    0.027   0.253    36.987    0.000    0.000
LGA    V    16_A      V    16_A    26.491     0    0.078   1.130    28.050    0.000    0.000
LGA    H    17_A      H    17_A    19.340     0    0.054   0.514    21.949    0.000    0.000
LGA    T    18_A      T    18_A    20.078     0    0.060   1.058    23.268    0.000    0.000
LGA    R    19_A      R    19_A    24.978     0    0.041   1.365    36.801    0.000    0.000
LGA    L    20_A      L    20_A    22.454     0    0.624   0.615    23.869    0.000    0.000
LGA    V    21_A      V    21_A    17.377     0    0.279   0.273    19.382    0.000    0.000
LGA    H    22_A      H    22_A    19.568     0    0.091   1.416    21.288    0.000    0.000
LGA    R    23_A      R    23_A    25.060     0    0.056   1.799    35.326    0.000    0.000
LGA    L    24_A      L    24_A    21.558     0    0.340   0.329    25.492    0.000    0.000
LGA    A    25_A      A    25_A    16.090     0    0.067   0.062    17.919    0.000    0.000
LGA    G    26_A      G    26_A    20.486     0    0.160   0.160    20.486    0.000    0.000
LGA    I    27_A      I    27_A    16.620     0    0.491   1.098    17.601    0.000    0.000
LGA    E    28_A      E    28_A    11.879     0    0.037   0.959    13.500    0.476    0.212
LGA    P    29_A      P    29_A     7.254     0    0.307   0.725     9.477   18.929   12.721
LGA    D    30_A      D    30_A     1.971     0    0.651   0.604     6.694   68.929   51.429
LGA    P    31_A      P    31_A     1.556     0    0.078   0.096     2.514   81.667   75.646
LGA    R    32_A      R    32_A     0.698     0    0.099   1.333     7.819   88.214   59.740
LGA    F    33_A      F    33_A     2.366     0    0.076   1.507     9.995   66.786   34.978
LGA    E    34_A      E    34_A     2.253     0    0.066   0.386     4.534   68.810   55.608
LGA    I    35_A      I    35_A     0.535     0    0.044   0.129     2.469   95.238   83.095
LGA    L    36_A      L    36_A     2.033     0    0.057   1.009     3.643   67.024   57.738
LGA    D    37_A      D    37_A     2.854     0    0.047   0.790     6.663   62.857   44.762
LGA    K    38_A      K    38_A     1.318     0    0.021   0.114     2.740   83.810   74.286
LGA    Y    39_A      Y    39_A     1.022     0    0.058   1.326    10.186   83.690   47.500
LGA    I    40_A      I    40_A     2.442     0    0.071   1.316     6.229   70.833   59.226
LGA    F    41_A      F    41_A     2.617     0    0.079   1.738    11.487   66.905   32.208
LGA    R    42_A      R    42_A     1.803     0    0.050   1.413     9.472   77.143   44.156
LGA    Q    43_A      Q    43_A     1.906     0    0.051   0.939     4.291   75.238   64.127
LGA    I    44_A      I    44_A     1.983     0    0.044   1.079     4.623   77.143   63.036
LGA    V    45_A      V    45_A     1.134     0    0.053   1.207     4.405   81.548   74.082
LGA    A    46_A      A    46_A     2.698     0    0.067   0.063     3.981   55.833   54.667
LGA    D    47_A      D    47_A     3.390     0    0.094   0.225     4.790   48.571   44.464
LGA    N    48_A      N    48_A     1.574     0    0.295   0.887     3.589   82.024   67.857
LGA    P    49_A      P    49_A     2.729     0    0.049   0.348     4.444   57.500   54.558
LGA    E    50_A      E    50_A     5.001     0    0.168   0.913     6.931   30.595   23.228
LGA    E    51_A      E    51_A     4.537     0    0.274   1.596     5.836   42.143   35.132
LGA    R    52_A      R    52_A     1.492     0    0.074   1.099     5.622   75.476   61.342
LGA    E    53_A      E    53_A     3.021     0    0.028   0.875     6.546   59.167   38.413
LGA    K    54_A      K    54_A     2.189     0    0.068   0.902     3.320   73.452   66.296
LGA    I    55_A      I    55_A     1.648     0    0.081   0.684     4.793   75.000   63.810
LGA    R    56_A      R    56_A     1.159     0    0.046   1.078     7.288   77.381   55.065
LGA    L    57_A      L    57_A     1.650     0    0.043   1.026     3.409   77.143   72.202
LGA    D    58_A      D    58_A     1.324     0    0.137   0.194     2.117   75.357   76.250
LGA    Y    59_A      Y    59_A     3.560     0    0.068   0.456     6.801   46.786   32.460
LGA    G    60_A      G    60_A     3.658     0    0.048   0.048     3.658   46.667   46.667
LGA    R    61_A      R    61_A     1.794     0    0.067   1.677     8.783   66.786   49.307
LGA    A    62_A      A    62_A     3.312     0    0.546   0.505     3.805   53.571   51.524
LGA    A    63_A      A    63_A     2.682     0    0.419   0.407     5.295   44.405   50.095
LGA    E    64_A      E    64_A     8.131     0    0.372   0.485    12.905    7.262    3.333
LGA    I    65_A      I    65_A     7.667     0    0.105   1.459    10.272    6.190    6.488
LGA    F    66_A      F    66_A     9.133     0    0.124   0.641    10.697    1.190    2.511
LGA    R    67_A      R    67_A    10.054     0    0.054   1.424    14.459    0.119    0.173
LGA    D    68_A      D    68_A    10.318     0    0.070   0.187    11.174    0.000    0.595
LGA    A    69_A      A    69_A    11.321     0    0.058   0.066    13.058    0.000    0.000
LGA    L    70_A      L    70_A    12.737     0    0.058   0.124    13.903    0.000    0.000
LGA    A    71_A      A    71_A    12.696     0    0.104   0.098    12.858    0.000    0.000
LGA    R    72_A      R    72_A    11.961     0    0.679   1.301    13.846    0.000    0.000
LGA    D    73_A      D    73_A    11.589     0    0.429   0.962    13.303    0.000    0.000
LGA    I    74_A      I    74_A    12.370     0    0.305   1.383    14.211    0.000    0.000
LGA    T    75_A      T    75_A    12.242     0    0.654   0.904    13.169    0.000    0.000
LGA    T    76_A      T    76_A    15.109     0    0.596   1.319    19.757    0.000    0.000
LGA    P    77_A      P    77_A    13.972     0    0.058   0.073    15.588    0.000    0.000
LGA    E    78_A      E    78_A    14.731     0    0.046   1.234    16.856    0.000    0.000
LGA    A    79_A      A    79_A    17.421     0    0.092   0.103    19.862    0.000    0.000
LGA    F    80_A      F    80_A    19.130     0    0.078   1.206    21.340    0.000    0.000
LGA    N    81_A      N    81_A    20.309     0    0.043   1.008    23.059    0.000    0.000
LGA    A    82_A      A    82_A    21.485     0    0.024   0.028    24.689    0.000    0.000
LGA    Y    83_A      Y    83_A    23.990     0    0.077   0.985    28.209    0.000    0.000
LGA    L    84_A      L    84_A    26.168     0    0.052   1.284    29.550    0.000    0.000
LGA    E    85_A      E    85_A    28.608     0    0.660   1.054    29.986    0.000    0.000
LGA    A    86_A      A    86_A    33.020     0    0.562   0.572    34.291    0.000    0.000
LGA    L    87_A      L    87_A    34.543     0    0.046   0.210    38.264    0.000    0.000
LGA    G    88_A      G    88_A    31.322     0    0.530   0.530    32.127    0.000    0.000
LGA    P    89_A      P    89_A    29.067     0    0.083   0.085    33.271    0.000    0.000
LGA    D    90_A      D    90_A    28.030     0    0.067   0.204    33.751    0.000    0.000
LGA    A    91_A      A    91_A    24.709     0    0.056   0.058    26.551    0.000    0.000
LGA    V    92_A      V    92_A    21.208     0    0.053   0.076    23.886    0.000    0.000
LGA    R    93_A      R    93_A    19.460     0    0.045   1.691    26.237    0.000    0.000
LGA    T    94_A      T    94_A    18.615     0    0.042   0.083    22.379    0.000    0.000
LGA    V    95_A      V    95_A    14.326     0    0.025   0.040    17.050    0.000    0.000
LGA    Q    96_A      Q    96_A    11.018     0    0.050   1.126    13.031    1.310    0.582
LGA    D    97_A      D    97_A    11.576     0    0.032   1.391    14.044    0.119    0.060
LGA    L    98_A      L    98_A     9.712     0    0.069   1.090    13.681    6.905    3.452
LGA    T    99_A      T    99_A     4.952     0    0.041   0.164     7.314   34.524   27.959
LGA    R   100_A      R   100_A     4.541     0    0.031   1.818     8.481   25.357   17.446
LGA    R   101_A      R   101_A     8.370     0    0.020   0.880    16.389    7.024    2.597
LGA    F   102_A      F   102_A     5.085     0    0.104   0.605     7.172   19.762   29.134
LGA    V   103_A      V   103_A     7.138     0    0.061   0.274    10.485    8.571    9.388
LGA    D   104_A      D   104_A    10.777     0    0.043   1.189    13.829    0.714    0.952
LGA    V   105_A      V   105_A    12.572     0    0.036   0.044    14.829    0.000    0.000
LGA    I   106_A      I   106_A    12.936     0    0.083   0.180    16.334    0.000    0.238
LGA    R   107_A      R   107_A    16.343     0    0.483   1.375    22.286    0.000    0.000
LGA    A   108_A      A   108_A    13.027     0    0.679   0.641    15.938    0.000    0.000
LGA    D   109_A      D   109_A    14.952     0    0.388   0.819    16.787    0.000    0.000
LGA    P   110_A      P   110_A    14.145     0    0.056   0.100    15.181    0.000    0.000
LGA    E   111_A      E   111_A    15.731     0    0.064   1.201    16.534    0.000    0.000
LGA    A   112_A      A   112_A    15.050     0    0.063   0.060    15.431    0.000    0.000
LGA    I   113_A      I   113_A    12.427     0    0.021   0.136    13.284    0.000    0.000
LGA    A   114_A      A   114_A    13.753     0    0.056   0.051    14.402    0.000    0.000
LGA    K   115_A      K   115_A    15.439     0    0.052   0.242    19.965    0.000    0.000
LGA    L   116_A      L   116_A    12.947     0    0.070   0.960    13.829    0.000    0.000
LGA    L   117_A      L   117_A    12.538     0    0.194   1.137    13.165    0.000    0.060
LGA    N   118_A      N   118_A    14.478     0    0.467   0.941    20.881    0.000    0.000
LGA    I   119_A      I   119_A    14.771     0    0.584   1.318    17.543    0.000    0.000
LGA    S   120_A      S   120_A    11.975     0    0.540   0.573    13.433    0.833    0.556
LGA    K   121_A      K   121_A     6.429     0    0.067   0.624     8.606   10.833   25.926
LGA    E   122_A      E   122_A    11.278     0    0.074   0.202    18.461    0.357    0.159
LGA    D   123_A      D   123_A    12.554     0    0.212   1.284    15.675    0.000    0.000
LGA    V   124_A      V   124_A     7.227     0    0.070   0.077     9.981    4.524   17.755
LGA    Q   125_A      Q   125_A    11.449     0    0.096   1.015    15.682    0.357    0.159
LGA    G   126_A      G   126_A    16.478     0    0.035   0.035    18.384    0.000    0.000
LGA    L   127_A      L   127_A    14.072     0    0.170   0.191    16.365    0.000    0.357
LGA    A   128_A      A   128_A    16.846     0    0.090   0.088    21.513    0.000    0.000
LGA    R   129_A      R   129_A    22.682     0    0.044   1.029    30.899    0.000    0.000
LGA    A   130_A      A   130_A    23.021     0    0.055   0.055    24.493    0.000    0.000
LGA    G   131_A      G   131_A    21.363     0    0.090   0.090    25.449    0.000    0.000
LGA    E   132_A      E   132_A    27.751     0    0.072   1.237    31.566    0.000    0.000
LGA    A   133_A      A   133_A    31.616     0    0.091   0.083    33.733    0.000    0.000
LGA    A   134_A      A   134_A    29.066     0    0.121   0.124    30.846    0.000    0.000
LGA    I   135_A      I   135_A    30.602     0    0.205   1.321    34.834    0.000    0.000
LGA    E   136_A      E   136_A    36.650     0    0.560   1.467    43.321    0.000    0.000
LGA    R   137_A      R   137_A    37.765     0    0.175   0.636    40.104    0.000    0.000
LGA    G   138_A      G   138_A    33.658     0    0.262   0.262    34.941    0.000    0.000
LGA    E   139_A      E   139_A    29.452     0    0.192   0.897    30.871    0.000    0.000
LGA    G   140_A      G   140_A    29.740     0    0.610   0.610    30.043    0.000    0.000
LGA    A   141_A      A   141_A    26.223     0    0.105   0.097    27.261    0.000    0.000
LGA    S   142_A      S   142_A    20.619     0    0.052   0.057    22.629    0.000    0.000
LGA    L   143_A      L   143_A    25.501     0    0.049   1.398    28.542    0.000    0.000
LGA    G   144_A      G   144_A    27.786     0    0.094   0.094    27.786    0.000    0.000
LGA    V   145_A      V   145_A    21.253     0    0.037   0.118    23.429    0.000    0.000
LGA    L   146_A      L   146_A    22.083     0    0.058   1.419    24.472    0.000    0.000
LGA    R   147_A      R   147_A    28.621     0    0.055   1.382    38.278    0.000    0.000
LGA    E   148_A      E   148_A    25.640     0    0.085   0.661    29.934    0.000    0.000
LGA    L   149_A      L   149_A    20.768     0    0.079   0.955    22.873    0.000    0.000
LGA    R   150_A      R   150_A    27.421     0    0.056   1.402    29.868    0.000    0.000
LGA    K   151_A      K   151_A    28.600     0    0.069   0.636    35.922    0.000    0.000
LGA    I   152_A      I   152_A    21.850     0    0.049   0.154    23.976    0.000    0.000
LGA    E   153_A      E   153_A    23.677     0    0.118   1.279    26.504    0.000    0.000
LGA    K   154_A      K   154_A    30.043     0    0.087   0.997    38.764    0.000    0.000
LGA    K   155_A      K   155_A    26.242     0    0.164   0.761    27.235    0.000    0.000
LGA    R   156_A      R   156_A    23.829     0    0.062   0.909    26.220    0.000    0.000
LGA    N   157_A      N   157_A    30.777     0    0.226   0.613    32.624    0.000    0.000

# 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):    14.263         14.202                 14.934           15.663   12.916

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  158  157    4.0     33    2.33    19.745    18.242     1.358

LGA_LOCAL      RMSD:   2.330  Number of atoms:   33  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  19.635  Number of assigned atoms:  157 
Std_ASGN_ATOMS RMSD:  14.263  Standard rmsd on all 157 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.452489 * X  +  -0.611746 * Y  +   0.648861 * Z  +  -1.756864
  Y_new =  -0.891409 * X  +  -0.289557 * Y  +   0.348637 * Z  +  14.099657
  Z_new =  -0.025395 * X  +  -0.736155 * Y  +  -0.676336 * Z  + -17.734003 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -1.101079  0.025398 -2.313870   [DEG:  -63.0872    1.4552 -132.5750 ]
ZXZ:  2.063842  2.313574 -3.107109   [DEG:  118.2494  132.5580 -178.0242 ]
 
# END of job
