
#######################################################
#                                                     #
#                        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:    51      23_A - 73_A        4.99    26.69
  LCS_AVERAGE:     24.61

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    27      48_A - 74_A        1.93    24.47
  LCS_AVERAGE:     12.12

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    23      50_A - 72_A        0.94    25.51
  LONGEST_CONTINUOUS_SEGMENT:    23      51_A - 73_A        0.61    25.57
  LCS_AVERAGE:      9.57

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     11   16   42      3    4    9   13   16   22   26   28   31   35   36   37   38   41   45   49   51   54   58   66 
LCS_GDT     S     2_A     S     2_A     11   16   42      6   10   12   13   16   20   26   28   31   35   36   37   38   41   45   49   51   54   58   66 
LCS_GDT     D     3_A     D     3_A     11   16   42      8   10   12   13   16   20   26   28   31   35   36   37   38   41   45   49   51   54   58   66 
LCS_GDT     R     4_A     R     4_A     11   16   42      8   10   12   13   15   20   24   28   30   32   35   36   37   41   50   50   55   58   58   66 
LCS_GDT     E     5_A     E     5_A     11   17   42      8   10   12   13   16   21   26   28   31   35   36   37   38   43   50   50   55   58   58   66 
LCS_GDT     L     6_A     L     6_A     11   20   42      8   10   12   13   16   22   26   28   31   35   36   37   38   43   50   50   55   58   58   66 
LCS_GDT     E     7_A     E     7_A     11   20   42      8   10   12   13   16   21   26   28   31   35   36   37   38   43   50   50   55   58   58   66 
LCS_GDT     A     8_A     A     8_A     11   20   42      8   10   12   13   16   22   26   28   31   35   36   37   38   43   50   50   55   58   58   63 
LCS_GDT     S     9_A     S     9_A     11   20   42      8   10   12   13   16   22   26   28   31   35   36   37   38   43   50   50   55   58   58   63 
LCS_GDT     L    10_A     L    10_A     16   20   42      9   12   16   16   17   22   24   28   31   35   36   37   38   43   50   50   55   58   58   66 
LCS_GDT     Q    11_A     Q    11_A     16   20   42      9   12   16   16   17   22   23   28   31   35   36   37   38   43   50   50   55   58   58   63 
LCS_GDT     A    12_A     A    12_A     16   20   42      9   12   16   16   17   22   26   28   31   35   36   37   38   43   50   50   55   58   58   63 
LCS_GDT     F    13_A     F    13_A     16   20   42      9   12   16   16   17   22   26   28   31   35   36   37   38   43   50   50   55   58   58   66 
LCS_GDT     F    14_A     F    14_A     16   20   42      9   12   16   16   17   22   26   28   31   35   36   37   38   43   50   50   55   58   60   66 
LCS_GDT     E    15_A     E    15_A     16   20   42      9   12   16   16   17   22   26   28   31   35   36   37   38   43   50   50   55   58   58   63 
LCS_GDT     V    16_A     V    16_A     16   20   42      9   12   16   16   17   22   26   28   31   35   36   37   38   43   50   50   55   58   58   63 
LCS_GDT     H    17_A     H    17_A     16   20   42      9   12   16   16   17   22   26   28   31   35   36   38   45   51   53   54   56   58   60   66 
LCS_GDT     T    18_A     T    18_A     16   20   42      6   12   16   16   17   22   26   28   31   35   36   37   39   44   51   53   56   58   60   66 
LCS_GDT     R    19_A     R    19_A     16   20   42      9   12   16   16   17   22   26   28   31   35   36   37   38   43   50   50   55   58   58   66 
LCS_GDT     L    20_A     L    20_A     16   20   42      6   12   16   16   17   22   26   28   31   35   36   38   44   51   52   54   56   58   60   66 
LCS_GDT     V    21_A     V    21_A     16   20   42      4   12   16   16   17   22   26   28   32   35   39   43   45   51   53   54   56   58   60   66 
LCS_GDT     H    22_A     H    22_A     16   20   42      4   12   16   16   17   22   26   28   31   35   36   38   45   51   53   54   56   58   60   66 
LCS_GDT     R    23_A     R    23_A     16   20   51      4   12   16   16   17   22   26   28   31   35   36   42   45   51   53   54   56   58   60   66 
LCS_GDT     L    24_A     L    24_A     16   20   51      4   12   16   16   17   22   26   29   32   35   39   43   45   51   53   54   56   58   60   66 
LCS_GDT     A    25_A     A    25_A     16   20   51      4   12   16   16   17   22   24   28   31   35   39   43   45   51   53   54   56   58   60   66 
LCS_GDT     G    26_A     G    26_A      9   19   51      4    6    8   15   17   17   22   25   32   35   39   43   45   51   53   54   56   58   60   66 
LCS_GDT     I    27_A     I    27_A      4    7   51      3    4    6    8    9   14   19   25   32   34   39   43   45   51   53   54   56   58   60   66 
LCS_GDT     E    28_A     E    28_A      4   20   51      3    4    8   15   17   19   20   20   22   32   39   43   45   51   53   54   56   56   60   66 
LCS_GDT     P    29_A     P    29_A      4   20   51      3    4    5    8   12   19   20   20   22   26   32   41   45   51   53   54   56   56   60   66 
LCS_GDT     D    30_A     D    30_A     18   20   51      5   17   18   18   18   19   20   20   23   27   32   35   40   50   53   54   56   56   58   58 
LCS_GDT     P    31_A     P    31_A     18   20   51      7   17   18   18   18   19   20   20   22   26   35   42   45   51   53   54   56   56   60   63 
LCS_GDT     R    32_A     R    32_A     18   20   51     13   17   18   18   18   19   20   20   21   23   32   35   37   40   44   52   56   56   60   63 
LCS_GDT     F    33_A     F    33_A     18   20   51     14   17   18   18   18   19   20   22   28   35   36   37   38   47   53   54   56   56   60   63 
LCS_GDT     E    34_A     E    34_A     18   20   51     14   17   18   18   18   19   21   28   32   34   39   43   45   51   53   54   56   56   60   63 
LCS_GDT     I    35_A     I    35_A     18   20   51     14   17   18   18   18   19   20   20   24   33   39   43   45   51   53   54   56   56   60   63 
LCS_GDT     L    36_A     L    36_A     18   20   51     14   17   18   18   18   19   20   22   31   35   36   37   40   50   53   54   56   56   60   63 
LCS_GDT     D    37_A     D    37_A     18   20   51     14   17   18   18   18   19   20   29   32   35   39   43   45   51   53   54   56   56   60   63 
LCS_GDT     K    38_A     K    38_A     18   20   51     14   17   18   18   18   20   27   30   32   34   39   43   45   51   53   54   56   56   60   66 
LCS_GDT     Y    39_A     Y    39_A     18   20   51     14   17   18   18   18   19   20   25   32   34   39   43   45   51   53   54   56   56   60   66 
LCS_GDT     I    40_A     I    40_A     18   20   51     14   17   18   18   18   22   26   28   31   35   36   43   45   51   53   54   56   56   60   66 
LCS_GDT     F    41_A     F    41_A     18   20   51     14   17   18   18   20   25   27   30   32   35   39   43   45   51   53   54   56   56   60   66 
LCS_GDT     R    42_A     R    42_A     18   20   51     14   17   18   18   18   23   27   30   32   35   39   43   45   51   53   54   56   56   60   66 
LCS_GDT     Q    43_A     Q    43_A     18   20   51     14   17   18   18   18   19   27   30   32   35   39   43   45   51   53   54   56   56   60   66 
LCS_GDT     I    44_A     I    44_A     18   20   51     14   17   18   18   18   21   26   28   30   32   35   38   43   51   53   54   56   56   60   66 
LCS_GDT     V    45_A     V    45_A     18   20   51     14   17   18   18   18   22   26   28   30   35   36   37   43   51   53   54   56   56   60   66 
LCS_GDT     A    46_A     A    46_A     18   20   51     14   17   18   18   18   24   27   30   32   35   39   43   45   51   53   54   56   56   60   66 
LCS_GDT     D    47_A     D    47_A     18   26   51     12   17   18   18   18   20   24   27   30   34   39   43   45   51   53   54   56   56   60   66 
LCS_GDT     N    48_A     N    48_A      6   27   51      5    6    6   11   17   25   27   30   32   34   39   43   45   51   53   54   56   56   60   66 
LCS_GDT     P    49_A     P    49_A      6   27   51      5    6    8   16   22   25   27   30   32   34   39   43   45   51   53   54   56   58   60   66 
LCS_GDT     E    50_A     E    50_A     23   27   51      5    6    6   10   16   25   27   30   32   34   38   43   45   51   53   54   56   58   60   66 
LCS_GDT     E    51_A     E    51_A     23   27   51     16   22   23   23   23   25   27   30   32   34   36   43   45   51   53   54   56   58   60   66 
LCS_GDT     R    52_A     R    52_A     23   27   51     17   22   23   23   23   25   27   30   32   34   39   43   45   51   53   54   56   58   60   66 
LCS_GDT     E    53_A     E    53_A     23   27   51     17   22   23   23   23   25   27   30   32   34   39   43   45   51   53   54   56   58   60   66 
LCS_GDT     K    54_A     K    54_A     23   27   51     17   22   23   23   23   25   27   30   32   34   38   43   45   51   53   54   56   58   60   63 
LCS_GDT     I    55_A     I    55_A     23   27   51     17   22   23   23   23   25   27   30   32   34   39   43   45   51   53   54   56   58   60   66 
LCS_GDT     R    56_A     R    56_A     23   27   51     17   22   23   23   23   25   27   30   32   34   39   43   45   51   53   54   56   58   60   66 
LCS_GDT     L    57_A     L    57_A     23   27   51     17   22   23   23   23   25   27   30   32   34   39   43   45   51   53   54   56   58   60   63 
LCS_GDT     D    58_A     D    58_A     23   27   51     17   22   23   23   23   25   27   30   32   34   39   43   45   51   53   54   56   58   60   65 
LCS_GDT     Y    59_A     Y    59_A     23   27   51     17   22   23   23   23   25   27   30   32   34   39   43   45   51   53   54   56   58   60   66 
LCS_GDT     G    60_A     G    60_A     23   27   51     17   22   23   23   23   25   27   30   32   34   39   43   45   51   53   54   56   56   60   63 
LCS_GDT     R    61_A     R    61_A     23   27   51     17   22   23   23   23   25   27   30   32   34   39   43   45   51   53   54   56   56   60   63 
LCS_GDT     A    62_A     A    62_A     23   27   51     17   22   23   23   23   25   27   30   32   34   39   43   45   51   53   54   56   58   60   66 
LCS_GDT     A    63_A     A    63_A     23   27   51     17   22   23   23   23   25   27   30   32   34   39   43   45   51   53   54   56   56   60   66 
LCS_GDT     E    64_A     E    64_A     23   27   51     17   22   23   23   23   25   27   30   32   34   39   43   45   51   53   54   56   56   60   63 
LCS_GDT     I    65_A     I    65_A     23   27   51     17   22   23   23   23   25   27   30   32   34   39   43   45   51   53   54   56   56   60   63 
LCS_GDT     F    66_A     F    66_A     23   27   51     17   22   23   23   23   25   27   30   32   34   39   43   45   51   53   54   56   58   60   66 
LCS_GDT     R    67_A     R    67_A     23   27   51     17   22   23   23   23   25   27   30   32   34   39   43   45   51   53   54   56   56   60   63 
LCS_GDT     D    68_A     D    68_A     23   27   51     17   22   23   23   23   25   27   30   32   34   39   43   45   51   53   54   56   56   60   63 
LCS_GDT     A    69_A     A    69_A     23   27   51     17   22   23   23   23   25   27   30   32   34   39   43   45   51   53   54   56   56   60   66 
LCS_GDT     L    70_A     L    70_A     23   27   51     17   22   23   23   23   25   27   30   32   34   39   43   45   51   53   54   56   56   60   66 
LCS_GDT     A    71_A     A    71_A     23   27   51     17   22   23   23   23   25   27   30   32   34   39   43   45   51   53   54   56   56   60   63 
LCS_GDT     R    72_A     R    72_A     23   27   51      6   22   23   23   23   24   27   30   32   34   39   43   45   51   53   54   56   56   60   63 
LCS_GDT     D    73_A     D    73_A     23   27   51      4    6   23   23   23   23   27   30   32   34   39   43   45   51   53   54   56   56   60   66 
LCS_GDT     I    74_A     I    74_A      3   27   45      3    3    5    6    8   20   24   25   30   33   35   37   40   43   46   49   51   55   60   66 
LCS_GDT     T    75_A     T    75_A     14   25   44      3    7   12   14   14   20   22   24   27   31   33   36   37   42   45   48   55   58   60   66 
LCS_GDT     T    76_A     T    76_A     14   16   44      4   11   13   14   16   20   21   25   27   31   33   35   37   43   50   50   55   58   58   66 
LCS_GDT     P    77_A     P    77_A     14   16   42      9   11   13   14   16   20   20   24   27   31   33   35   37   41   43   47   55   58   58   63 
LCS_GDT     E    78_A     E    78_A     14   16   41      9   11   13   14   15   20   20   24   27   31   33   35   37   41   50   50   55   58   58   63 
LCS_GDT     A    79_A     A    79_A     14   16   41      9   11   13   14   16   20   20   24   27   29   33   35   38   43   50   50   55   58   58   66 
LCS_GDT     F    80_A     F    80_A     14   16   41      9   11   13   14   16   20   20   24   27   31   33   35   38   43   50   50   55   58   60   66 
LCS_GDT     N    81_A     N    81_A     14   16   40      9   11   13   14   16   20   20   24   27   29   32   35   38   43   50   50   55   58   58   66 
LCS_GDT     A    82_A     A    82_A     14   16   40      9   11   13   14   16   20   20   24   27   29   32   35   38   43   50   50   55   58   58   63 
LCS_GDT     Y    83_A     Y    83_A     14   16   40      9   11   13   14   16   20   20   24   27   29   32   35   38   43   50   50   55   58   58   66 
LCS_GDT     L    84_A     L    84_A     14   16   40      9   11   13   14   16   20   20   24   27   29   32   35   38   43   50   50   55   58   58   66 
LCS_GDT     E    85_A     E    85_A     14   16   40      8   11   13   14   16   20   20   24   27   29   32   35   38   43   50   50   55   58   58   63 
LCS_GDT     A    86_A     A    86_A     14   16   40      9   11   13   14   16   20   20   24   27   29   32   35   36   41   43   46   54   58   58   62 
LCS_GDT     L    87_A     L    87_A     14   16   40      6   11   13   14   15   20   20   24   27   29   32   35   36   43   50   50   54   58   58   66 
LCS_GDT     G    88_A     G    88_A     14   16   40      3    6   13   14   16   20   20   24   27   29   32   35   38   43   50   50   55   58   58   66 
LCS_GDT     P    89_A     P    89_A      6   19   40      4    6    6    8   16   20   21   24   27   29   32   35   38   43   50   50   55   58   58   66 
LCS_GDT     D    90_A     D    90_A      7   19   40      4    6    6   14   17   20   21   24   27   29   32   35   38   43   50   50   55   58   60   66 
LCS_GDT     A    91_A     A    91_A     17   19   40      5   13   14   17   17   20   21   24   27   29   32   35   38   43   50   50   55   58   60   66 
LCS_GDT     V    92_A     V    92_A     17   19   40      6   13   16   17   17   18   21   22   26   29   32   35   38   43   50   50   55   58   58   66 
LCS_GDT     R    93_A     R    93_A     17   19   40      6   13   16   17   17   20   21   24   27   29   32   35   38   43   50   50   55   58   60   66 
LCS_GDT     T    94_A     T    94_A     17   19   40      9   13   16   17   17   20   21   24   27   29   32   35   37   41   50   50   55   58   60   66 
LCS_GDT     V    95_A     V    95_A     17   19   40      9   13   16   17   17   18   21   24   27   29   32   35   37   41   43   47   55   58   58   66 
LCS_GDT     Q    96_A     Q    96_A     17   19   40      9   13   16   17   17   20   21   24   27   29   32   35   37   41   43   47   55   57   58   66 
LCS_GDT     D    97_A     D    97_A     17   19   40      9   13   16   17   17   18   21   23   26   29   32   35   37   41   43   46   50   52   56   62 
LCS_GDT     L    98_A     L    98_A     17   19   40      9   13   16   17   17   18   21   22   23   27   30   33   37   39   43   46   50   50   55   60 
LCS_GDT     T    99_A     T    99_A     17   19   40      9   13   16   17   17   18   21   22   24   29   31   35   37   41   43   46   50   50   52   58 
LCS_GDT     R   100_A     R   100_A     17   19   40      9   13   16   17   17   18   21   23   26   29   31   35   37   39   41   43   46   49   52   55 
LCS_GDT     R   101_A     R   101_A     17   19   39      9   13   16   17   17   18   21   22   23   26   29   33   37   38   41   43   45   46   49   51 
LCS_GDT     F   102_A     F   102_A     17   19   39      9   13   16   17   17   18   21   22   23   26   29   33   37   38   41   43   45   46   49   51 
LCS_GDT     V   103_A     V   103_A     17   19   31      9   13   16   17   17   18   21   22   23   27   30   32   35   38   41   43   45   46   49   53 
LCS_GDT     D   104_A     D   104_A     17   19   31      5   13   16   17   17   18   21   22   23   26   28   31   33   35   38   43   45   46   49   51 
LCS_GDT     V   105_A     V   105_A     17   19   27      6   13   16   17   17   18   21   22   23   26   28   31   33   35   41   43   45   46   49   51 
LCS_GDT     I   106_A     I   106_A     17   19   27      5   13   16   17   17   18   21   22   23   26   28   31   33   35   38   40   44   46   49   51 
LCS_GDT     R   107_A     R   107_A     17   19   27      5   13   16   17   17   18   21   22   23   26   28   31   33   35   38   40   42   44   49   51 
LCS_GDT     A   108_A     A   108_A     10   19   26      3    5   10   10   12   14   18   22   23   26   28   31   33   34   37   39   40   44   45   47 
LCS_GDT     D   109_A     D   109_A     10   14   26      9    9   10   10   12   14   18   22   23   26   28   31   33   34   37   39   40   42   47   50 
LCS_GDT     P   110_A     P   110_A     10   14   26      9    9   10   10   12   14   16   21   23   26   28   29   32   34   37   39   41   44   47   51 
LCS_GDT     E   111_A     E   111_A     10   14   26      9    9   10   10   12   13   14   16   19   23   26   29   31   34   36   38   40   42   47   51 
LCS_GDT     A   112_A     A   112_A     10   14   26      9    9   10   10   12   13   14   16   19   23   26   29   31   35   38   40   42   44   47   51 
LCS_GDT     I   113_A     I   113_A     10   14   26      9    9   10   10   12   13   14   16   19   23   26   29   32   35   38   40   42   44   47   51 
LCS_GDT     A   114_A     A   114_A     10   14   26      9    9   10   10   12   13   14   16   19   21   25   29   31   33   35   38   40   42   47   51 
LCS_GDT     K   115_A     K   115_A     10   14   25      9    9   10   10   12   13   14   15   17   17   19   21   23   24   28   31   36   40   47   50 
LCS_GDT     L   116_A     L   116_A     10   14   23      9    9   10   10   12   13   14   15   17   17   19   21   23   24   25   28   36   40   47   50 
LCS_GDT     L   117_A     L   117_A     10   14   23      9    9   10   10   12   13   14   15   17   17   19   21   23   25   29   32   36   40   47   50 
LCS_GDT     N   118_A     N   118_A     10   14   23      4    9   10   10   11   13   14   15   17   17   19   21   26   33   37   41   43   46   47   50 
LCS_GDT     I   119_A     I   119_A      3   13   23      3    5    8    9   12   12   13   15   25   28   31   35   38   41   45   49   51   51   52   53 
LCS_GDT     S   120_A     S   120_A     11   13   23      7    9   11   11   12   12   13   13   25   29   32   37   38   41   45   49   51   51   52   53 
LCS_GDT     K   121_A     K   121_A     11   13   23      7    9   11   11   12   12   13   15   17   17   18   31   37   39   45   49   51   51   52   53 
LCS_GDT     E   122_A     E   122_A     11   13   23      7    9   11   11   12   12   14   25   31   35   36   37   38   41   45   49   51   51   52   53 
LCS_GDT     D   123_A     D   123_A     11   13   23      7    9   11   11   12   12   13   15   17   17   18   20   24   41   42   46   51   51   52   53 
LCS_GDT     V   124_A     V   124_A     11   13   23      7    9   11   11   12   14   17   20   24   31   33   35   37   39   41   42   45   47   50   52 
LCS_GDT     Q   125_A     Q   125_A     11   13   23      7    9   11   11   12   14   17   20   24   31   33   35   37   39   41   42   45   48   50   53 
LCS_GDT     G   126_A     G   126_A     11   13   23      7    9   11   11   12   12   13   16   19   24   27   33   36   39   41   42   45   48   49   53 
LCS_GDT     L   127_A     L   127_A     11   13   23      6    9   11   11   12   12   13   17   19   27   32   34   36   39   41   42   45   48   52   55 
LCS_GDT     A   128_A     A   128_A     11   13   23      5    9   11   11   12   12   13   15   18   27   32   34   36   39   41   42   45   48   52   55 
LCS_GDT     R   129_A     R   129_A     11   13   23      3    7   11   11   12   12   13   15   17   21   22   28   31   35   40   42   45   48   52   55 
LCS_GDT     A   130_A     A   130_A     11   13   23      3    7   11   11   12   12   13   15   17   17   18   20   20   31   33   40   44   48   52   55 
LCS_GDT     G   131_A     G   131_A      8   13   23      4    8    8   11   12   12   13   15   17   17   18   20   20   21   24   38   48   50   52   55 
LCS_GDT     E   132_A     E   132_A      8    9   23      7    8    8    8    8   10   13   15   17   17   18   20   28   35   38   43   49   54   56   60 
LCS_GDT     A   133_A     A   133_A      8    9   25      7    8    8    8    8    8   10   11   19   23   26   29   32   35   39   43   49   54   57   61 
LCS_GDT     A   134_A     A   134_A      8    9   25      7    8    8    8    8    8   10   11   19   23   26   29   32   35   39   43   49   54   57   60 
LCS_GDT     I   135_A     I   135_A      8    9   25      7    8    8    8    8    8   10   15   17   20   24   25   29   35   39   43   49   54   57   60 
LCS_GDT     E   136_A     E   136_A      8    9   25      7    8    8    8    8    8   10   12   17   20   24   28   33   36   39   43   49   54   57   61 
LCS_GDT     R   137_A     R   137_A      8    9   25      7    8    8    8    8    9   20   20   21   24   27   33   37   38   41   43   49   54   57   61 
LCS_GDT     G   138_A     G   138_A      8    9   25      7    8    8    8    8   19   20   22   23   24   29   33   37   38   41   43   49   54   57   61 
LCS_GDT     E   139_A     E   139_A      3   19   25      3    3    5    9   13   16   18   22   23   26   29   33   37   38   41   43   45   47   52   55 
LCS_GDT     G   140_A     G   140_A     17   19   25      3   14   17   17   18   18   18   19   21   26   28   33   37   38   41   43   45   49   52   54 
LCS_GDT     A   141_A     A   141_A     17   19   25     12   14   17   17   18   18   18   19   22   26   30   33   37   41   43   46   50   50   52   55 
LCS_GDT     S   142_A     S   142_A     17   19   25     12   14   17   17   18   18   18   19   22   26   28   31   37   38   43   46   50   50   52   54 
LCS_GDT     L   143_A     L   143_A     17   19   25     12   14   17   17   18   18   18   19   19   26   28   31   37   38   41   43   45   47   52   54 
LCS_GDT     G   144_A     G   144_A     17   19   25     12   14   17   17   18   18   18   19   19   26   29   33   37   38   41   43   50   50   52   54 
LCS_GDT     V   145_A     V   145_A     17   19   25     12   14   17   17   18   18   18   19   21   28   30   33   37   41   43   46   50   50   52   54 
LCS_GDT     L   146_A     L   146_A     17   19   25     12   14   17   17   18   18   18   19   19   23   29   33   37   38   41   46   50   50   52   54 
LCS_GDT     R   147_A     R   147_A     17   19   25     12   14   17   17   18   18   18   19   19   25   29   33   37   38   41   43   50   50   52   54 
LCS_GDT     E   148_A     E   148_A     17   19   25     12   14   17   17   18   18   18   19   22   28   30   33   37   41   43   46   50   50   52   54 
LCS_GDT     L   149_A     L   149_A     17   19   25     12   14   17   17   18   18   18   19   20   23   29   33   37   41   43   46   50   50   52   54 
LCS_GDT     R   150_A     R   150_A     17   19   25     12   14   17   17   18   18   18   19   21   23   29   33   37   41   43   46   50   50   52   54 
LCS_GDT     K   151_A     K   151_A     17   19   25     12   14   17   17   18   18   18   19   22   28   30   33   37   41   43   46   50   50   52   54 
LCS_GDT     I   152_A     I   152_A     17   19   25     12   14   17   17   18   18   18   19   19   22   29   33   37   41   43   46   50   50   52   54 
LCS_GDT     E   153_A     E   153_A     17   19   25      4   14   17   17   18   18   18   19   19   22   29   33   37   38   41   43   46   49   52   54 
LCS_GDT     K   154_A     K   154_A     17   19   25      4   12   17   17   18   18   18   19   19   22   29   33   37   41   43   46   50   50   52   54 
LCS_GDT     K   155_A     K   155_A     17   19   25      4    6   17   17   18   18   18   19   19   22   29   33   37   41   43   46   50   50   52   54 
LCS_GDT     R   156_A     R   156_A     17   19   25      4    5   17   17   18   18   18   19   19   22   29   33   37   38   41   43   46   47   50   54 
LCS_GDT     N   157_A     N   157_A      5   19   25      3    3    8   15   18   18   18   19   19   22   29   33   37   38   41   43   45   47   49   54 
LCS_AVERAGE  LCS_A:  15.44  (   9.57   12.12   24.61 )

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     17     22     23     23     23     25     27     30     32     35     39     43     45     51     53     54     56     58     60     66 
GDT PERCENT_AT  10.83  14.01  14.65  14.65  14.65  15.92  17.20  19.11  20.38  22.29  24.84  27.39  28.66  32.48  33.76  34.39  35.67  36.94  38.22  42.04
GDT RMS_LOCAL    0.31   0.47   0.61   0.61   0.61   1.69   1.76   2.27   2.54   3.31   3.84   4.07   4.28   4.79   5.00   5.07   5.28   7.14   6.41   7.63
GDT RMS_ALL_AT  25.15  25.37  25.57  25.57  25.57  24.73  25.82  25.52  25.78  20.39  26.92  26.88  26.86  27.19  26.88  26.97  27.02  23.66  26.51  23.87

# Checking swapping
#   possible swapping detected:  D     3_A      D     3_A
#   possible swapping detected:  E     5_A      E     5_A
#   possible swapping detected:  E     7_A      E     7_A
#   possible swapping detected:  F    14_A      F    14_A
#   possible swapping detected:  E    34_A      E    34_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:  E    53_A      E    53_A
#   possible swapping detected:  Y    59_A      Y    59_A
#   possible swapping detected:  E    64_A      E    64_A
#   possible swapping detected:  D    73_A      D    73_A
#   possible swapping detected:  E    78_A      E    78_A
#   possible swapping detected:  F    80_A      F    80_A
#   possible swapping detected:  D    90_A      D    90_A
#   possible swapping detected:  D    97_A      D    97_A
#   possible swapping detected:  F   102_A      F   102_A
#   possible swapping detected:  D   109_A      D   109_A
#   possible swapping detected:  E   111_A      E   111_A
#   possible swapping detected:  D   123_A      D   123_A
#   possible swapping detected:  E   132_A      E   132_A
#   possible swapping detected:  E   148_A      E   148_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    L     1_A      L     1_A    23.474     0    0.215   0.666    28.154    0.000    0.000
LGA    S     2_A      S     2_A    22.061     0    0.129   0.513    25.101    0.000    0.000
LGA    D     3_A      D     3_A    17.568     0    0.039   1.092    19.318    0.000    0.000
LGA    R     4_A      R     4_A    23.525     0    0.050   1.572    33.327    0.000    0.000
LGA    E     5_A      E     5_A    25.469     0    0.053   1.050    31.230    0.000    0.000
LGA    L     6_A      L     6_A    19.255     0    0.039   1.410    21.168    0.000    0.000
LGA    E     7_A      E     7_A    19.127     0    0.030   0.958    24.164    0.000    0.000
LGA    A     8_A      A     8_A    25.310     0    0.030   0.036    27.732    0.000    0.000
LGA    S     9_A      S     9_A    24.095     0    0.116   0.742    24.124    0.000    0.000
LGA    L    10_A      L    10_A    18.084     0    0.303   0.347    20.071    0.000    0.000
LGA    Q    11_A      Q    11_A    21.708     0    0.048   1.539    25.683    0.000    0.000
LGA    A    12_A      A    12_A    23.277     0    0.069   0.068    24.884    0.000    0.000
LGA    F    13_A      F    13_A    16.534     0    0.066   1.414    18.913    0.000    0.000
LGA    F    14_A      F    14_A    15.227     0    0.066   1.226    16.903    0.000    0.000
LGA    E    15_A      E    15_A    20.766     0    0.039   0.631    28.703    0.000    0.000
LGA    V    16_A      V    16_A    18.017     0    0.070   1.093    19.531    0.000    0.000
LGA    H    17_A      H    17_A    11.226     0    0.047   0.603    13.697    0.000    1.810
LGA    T    18_A      T    18_A    15.798     0    0.037   1.039    19.754    0.000    0.000
LGA    R    19_A      R    19_A    18.663     0    0.053   1.103    27.878    0.000    0.000
LGA    L    20_A      L    20_A    12.326     0    0.065   0.160    14.408    0.000    0.774
LGA    V    21_A      V    21_A    10.532     0    0.048   0.931    13.568    0.000    0.068
LGA    H    22_A      H    22_A    16.410     0    0.115   1.101    23.146    0.000    0.000
LGA    R    23_A      R    23_A    14.220     0    0.053   0.602    21.608    0.000    0.000
LGA    L    24_A      L    24_A     7.713     0    0.106   1.107     9.851    4.405   13.690
LGA    A    25_A      A    25_A    12.369     0    0.134   0.133    14.770    0.000    0.000
LGA    G    26_A      G    26_A    13.764     0    0.335   0.335    14.085    0.000    0.000
LGA    I    27_A      I    27_A    13.308     0    0.223   1.119    13.325    0.000    0.000
LGA    E    28_A      E    28_A    13.320     0    0.099   0.667    14.430    0.000    0.000
LGA    P    29_A      P    29_A    13.545     0    0.152   0.193    15.591    0.000    0.000
LGA    D    30_A      D    30_A    12.411     0    0.533   0.486    12.688    0.000    0.000
LGA    P    31_A      P    31_A    12.416     0    0.030   0.334    15.792    0.000    0.000
LGA    R    32_A      R    32_A    14.941     0    0.123   1.314    23.399    0.000    0.000
LGA    F    33_A      F    33_A    11.224     0    0.081   1.289    12.347    1.071    6.926
LGA    E    34_A      E    34_A     6.788     0    0.051   0.845     8.661    9.643   10.212
LGA    I    35_A      I    35_A    10.869     0    0.048   1.322    18.107    0.238    0.119
LGA    L    36_A      L    36_A    10.789     0    0.053   0.865    14.004    1.905    0.952
LGA    D    37_A      D    37_A     5.524     0    0.053   0.219     7.159   27.976   27.798
LGA    K    38_A      K    38_A     5.055     0    0.053   0.611    11.267   28.810   14.709
LGA    Y    39_A      Y    39_A     7.769     0    0.033   1.553    11.171   12.738    4.524
LGA    I    40_A      I    40_A     6.932     0    0.033   0.988    13.015   18.571   11.131
LGA    F    41_A      F    41_A     3.884     0    0.034   1.401     9.787   43.452   25.325
LGA    R    42_A      R    42_A     4.022     0    0.038   1.311    12.582   46.786   19.654
LGA    Q    43_A      Q    43_A     5.154     0    0.051   0.822     9.558   28.929   16.138
LGA    I    44_A      I    44_A     6.979     0    0.038   0.121    10.285   15.000    8.333
LGA    V    45_A      V    45_A     6.571     0    0.067   1.138    10.380   19.524   15.034
LGA    A    46_A      A    46_A     3.277     0    0.039   0.050     3.937   46.667   46.000
LGA    D    47_A      D    47_A     6.700     0    0.279   1.392    12.505   17.976    9.167
LGA    N    48_A      N    48_A     4.112     0    0.240   1.048     4.643   49.643   42.679
LGA    P    49_A      P    49_A     3.139     0    0.034   0.056     5.184   53.571   43.333
LGA    E    50_A      E    50_A     2.927     0    0.206   1.089     5.676   53.690   43.757
LGA    E    51_A      E    51_A     2.384     0    0.224   0.600     5.253   64.881   51.164
LGA    R    52_A      R    52_A     1.783     0    0.076   1.159     4.398   72.976   59.610
LGA    E    53_A      E    53_A     1.621     0    0.039   1.349     6.665   72.857   54.497
LGA    K    54_A      K    54_A     1.895     0    0.041   1.535     8.177   72.857   54.709
LGA    I    55_A      I    55_A     1.682     0    0.026   1.442     5.308   75.000   65.476
LGA    R    56_A      R    56_A     1.571     0    0.043   1.559     8.430   77.143   49.481
LGA    L    57_A      L    57_A     1.400     0    0.075   0.990     2.585   79.286   72.143
LGA    D    58_A      D    58_A     1.459     0    0.039   0.154     1.850   81.429   77.143
LGA    Y    59_A      Y    59_A     1.119     0    0.053   1.241     7.394   81.429   57.460
LGA    G    60_A      G    60_A     1.106     0    0.031   0.031     1.257   81.429   81.429
LGA    R    61_A      R    61_A     0.996     0    0.041   1.441     7.420   88.214   54.113
LGA    A    62_A      A    62_A     0.941     0    0.052   0.054     1.186   88.214   86.857
LGA    A    63_A      A    63_A     0.993     0    0.037   0.042     1.257   90.476   88.667
LGA    E    64_A      E    64_A     0.539     0    0.029   0.687     2.176   92.857   82.804
LGA    I    65_A      I    65_A     0.651     0    0.042   1.408     4.142   92.857   77.619
LGA    F    66_A      F    66_A     0.798     0    0.034   1.090     6.455   90.476   58.874
LGA    R    67_A      R    67_A     0.989     0    0.057   1.150     2.929   90.476   80.260
LGA    D    68_A      D    68_A     0.690     0    0.077   1.224     4.963   90.476   72.976
LGA    A    69_A      A    69_A     0.976     0    0.049   0.057     1.153   88.214   86.857
LGA    L    70_A      L    70_A     0.865     0    0.049   0.977     4.442   90.476   76.429
LGA    A    71_A      A    71_A     0.743     0    0.135   0.133     1.042   88.214   88.667
LGA    R    72_A      R    72_A     2.325     0    0.248   1.406     4.618   61.190   69.177
LGA    D    73_A      D    73_A     3.309     0    0.593   1.568     7.226   44.167   33.512
LGA    I    74_A      I    74_A     6.298     0    0.053   1.333    10.517   22.262   12.976
LGA    T    75_A      T    75_A     9.961     0    0.551   1.401    12.899    0.833    0.476
LGA    T    76_A      T    76_A    13.589     0    0.188   1.115    14.999    0.000    0.000
LGA    P    77_A      P    77_A    18.300     0    0.086   0.418    20.872    0.000    0.000
LGA    E    78_A      E    78_A    20.229     0    0.027   1.413    25.365    0.000    0.000
LGA    A    79_A      A    79_A    15.353     0    0.037   0.047    16.613    0.000    0.000
LGA    F    80_A      F    80_A    14.607     0    0.068   1.477    16.710    0.000    0.000
LGA    N    81_A      N    81_A    20.976     0    0.038   0.890    25.272    0.000    0.000
LGA    A    82_A      A    82_A    21.351     0    0.039   0.041    21.441    0.000    0.000
LGA    Y    83_A      Y    83_A    16.879     0    0.111   0.809    18.245    0.000    0.040
LGA    L    84_A      L    84_A    19.303     0    0.066   1.399    21.749    0.000    0.000
LGA    E    85_A      E    85_A    24.770     0    0.029   0.807    32.585    0.000    0.000
LGA    A    86_A      A    86_A    23.304     0    0.099   0.097    24.056    0.000    0.000
LGA    L    87_A      L    87_A    20.552     0    0.630   1.235    23.348    0.000    0.000
LGA    G    88_A      G    88_A    25.766     0    0.253   0.253    25.766    0.000    0.000
LGA    P    89_A      P    89_A    27.182     0    0.229   0.349    29.021    0.000    0.000
LGA    D    90_A      D    90_A    20.942     0    0.071   1.413    23.066    0.000    0.000
LGA    A    91_A      A    91_A    17.698     0    0.165   0.180    19.246    0.000    0.000
LGA    V    92_A      V    92_A    23.731     0    0.067   0.996    28.097    0.000    0.000
LGA    R    93_A      R    93_A    22.923     0    0.057   1.066    23.540    0.000    0.000
LGA    T    94_A      T    94_A    16.525     0    0.027   0.065    18.508    0.000    0.000
LGA    V    95_A      V    95_A    18.613     0    0.037   0.998    21.172    0.000    0.000
LGA    Q    96_A      Q    96_A    25.381     0    0.040   0.655    32.105    0.000    0.000
LGA    D    97_A      D    97_A    23.713     0    0.045   1.108    24.212    0.000    0.000
LGA    L    98_A      L    98_A    19.520     0    0.024   0.878    22.080    0.000    0.000
LGA    T    99_A      T    99_A    24.306     0    0.050   0.853    27.680    0.000    0.000
LGA    R   100_A      R   100_A    30.079     0    0.029   1.316    38.866    0.000    0.000
LGA    R   101_A      R   101_A    28.307     0    0.040   1.415    29.557    0.000    0.000
LGA    F   102_A      F   102_A    26.027     0    0.095   1.434    29.463    0.000    0.000
LGA    V   103_A      V   103_A    32.706     0    0.067   0.374    37.070    0.000    0.000
LGA    D   104_A      D   104_A    36.309     0    0.076   0.227    38.272    0.000    0.000
LGA    V   105_A      V   105_A    33.528     0    0.055   0.062    35.891    0.000    0.000
LGA    I   106_A      I   106_A    34.059     0    0.419   1.266    37.841    0.000    0.000
LGA    R   107_A      R   107_A    41.048     0    0.079   1.433    46.269    0.000    0.000
LGA    A   108_A      A   108_A    43.171     0    0.140   0.140    45.390    0.000    0.000
LGA    D   109_A      D   109_A    41.251     0    0.346   1.264    41.251    0.000    0.000
LGA    P   110_A      P   110_A    40.584     0    0.098   0.342    45.060    0.000    0.000
LGA    E   111_A      E   111_A    38.588     0    0.040   1.517    40.061    0.000    0.000
LGA    A   112_A      A   112_A    34.283     0    0.023   0.039    36.151    0.000    0.000
LGA    I   113_A      I   113_A    33.787     0    0.035   1.386    36.801    0.000    0.000
LGA    A   114_A      A   114_A    34.772     0    0.040   0.048    36.163    0.000    0.000
LGA    K   115_A      K   115_A    30.877     0    0.042   1.416    32.450    0.000    0.000
LGA    L   116_A      L   116_A    28.818     0    0.045   0.746    29.872    0.000    0.000
LGA    L   117_A      L   117_A    30.191     0    0.191   1.448    31.865    0.000    0.000
LGA    N   118_A      N   118_A    30.070     0    0.458   0.999    31.588    0.000    0.000
LGA    I   119_A      I   119_A    31.053     0    0.589   0.718    33.233    0.000    0.000
LGA    S   120_A      S   120_A    37.704     0    0.592   0.940    40.300    0.000    0.000
LGA    K   121_A      K   121_A    38.582     0    0.035   0.789    46.139    0.000    0.000
LGA    E   122_A      E   122_A    37.244     0    0.039   1.410    39.304    0.000    0.000
LGA    D   123_A      D   123_A    35.503     0    0.047   1.100    38.520    0.000    0.000
LGA    V   124_A      V   124_A    36.353     0    0.048   0.083    37.151    0.000    0.000
LGA    Q   125_A      Q   125_A    38.114     0    0.058   1.070    42.008    0.000    0.000
LGA    G   126_A      G   126_A    36.333     0    0.061   0.061    36.717    0.000    0.000
LGA    L   127_A      L   127_A    35.316     0    0.129   1.075    37.051    0.000    0.000
LGA    A   128_A      A   128_A    38.337     0    0.041   0.050    40.373    0.000    0.000
LGA    R   129_A      R   129_A    40.540     0    0.059   0.896    41.618    0.000    0.000
LGA    A   130_A      A   130_A    39.194     0    0.573   0.568    40.698    0.000    0.000
LGA    G   131_A      G   131_A    38.650     0    0.579   0.579    39.586    0.000    0.000
LGA    E   132_A      E   132_A    43.104     0    0.042   1.095    48.255    0.000    0.000
LGA    A   133_A      A   133_A    44.576     0    0.063   0.062    45.219    0.000    0.000
LGA    A   134_A      A   134_A    38.504     0    0.050   0.062    40.432    0.000    0.000
LGA    I   135_A      I   135_A    39.559     0    0.036   0.639    41.468    0.000    0.000
LGA    E   136_A      E   136_A    45.213     0    0.029   0.980    51.532    0.000    0.000
LGA    R   137_A      R   137_A    42.071     0    0.264   1.596    42.922    0.000    0.000
LGA    G   138_A      G   138_A    37.689     0    0.274   0.274    39.244    0.000    0.000
LGA    E   139_A      E   139_A    38.479     0    0.176   0.745    45.909    0.000    0.000
LGA    G   140_A      G   140_A    36.545     0    0.599   0.599    37.347    0.000    0.000
LGA    A   141_A      A   141_A    33.767     0    0.074   0.073    34.232    0.000    0.000
LGA    S   142_A      S   142_A    31.205     0    0.056   0.689    32.746    0.000    0.000
LGA    L   143_A      L   143_A    35.885     0    0.054   1.193    39.470    0.000    0.000
LGA    G   144_A      G   144_A    38.187     0    0.031   0.031    38.187    0.000    0.000
LGA    V   145_A      V   145_A    34.226     0    0.031   0.115    35.290    0.000    0.000
LGA    L   146_A      L   146_A    33.854     0    0.055   0.873    35.834    0.000    0.000
LGA    R   147_A      R   147_A    38.992     0    0.043   1.443    42.641    0.000    0.000
LGA    E   148_A      E   148_A    39.259     0    0.063   1.037    43.761    0.000    0.000
LGA    L   149_A      L   149_A    35.408     0    0.040   0.773    36.533    0.000    0.000
LGA    R   150_A      R   150_A    37.865     0    0.042   1.313    40.496    0.000    0.000
LGA    K   151_A      K   151_A    42.451     0    0.063   0.882    44.757    0.000    0.000
LGA    I   152_A      I   152_A    40.754     0    0.030   1.291    40.892    0.000    0.000
LGA    E   153_A      E   153_A    37.445     0    0.119   1.164    39.066    0.000    0.000
LGA    K   154_A      K   154_A    42.339     0    0.084   0.800    44.735    0.000    0.000
LGA    K   155_A      K   155_A    45.941     0    0.228   1.550    53.115    0.000    0.000
LGA    R   156_A      R   156_A    41.362     0    0.027   0.697    42.806    0.000    0.000
LGA    N   157_A      N   157_A    41.961     0    0.449   0.906    43.891    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):    15.847         15.760                 16.619           15.027   12.456

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  158  157    4.0     30    2.27    20.541    18.127     1.264

LGA_LOCAL      RMSD:   2.274  Number of atoms:   30  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  25.523  Number of assigned atoms:  157 
Std_ASGN_ATOMS RMSD:  15.847  Standard rmsd on all 157 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.064632 * X  +   0.224120 * Y  +  -0.972416 * Z  +  13.597134
  Y_new =  -0.528765 * X  +  -0.818720 * Y  +  -0.223841 * Z  +   6.269835
  Z_new =  -0.846304 * X  +   0.528647 * Y  +   0.065592 * Z  +  -5.002738 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -1.449168  1.009008  1.447353   [DEG:  -83.0312   57.8119   82.9272 ]
ZXZ: -1.344547  1.505157 -1.012446   [DEG:  -77.0368   86.2392  -58.0089 ]
 
# END of job
