
#######################################################
#                                                     #
#                        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:    44      12_A - 55_A        4.97    28.73
  LCS_AVERAGE:     22.15

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    25      83_A - 107_A       1.90    18.27
  LONGEST_CONTINUOUS_SEGMENT:    25      84_A - 108_A       1.95    17.98
  LCS_AVERAGE:     11.20

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    20      30_A - 49_A        0.80    27.09
  LONGEST_CONTINUOUS_SEGMENT:    20      88_A - 107_A       0.96    18.46
  LCS_AVERAGE:      8.66

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   13   20      0    6    8   11   11   14   16   18   21   23   24   25   28   30   32   36   38   44   48   51 
LCS_GDT     S     2_A     S     2_A     10   15   20     10   10   10   10   14   16   18   20   21   23   24   25   27   30   32   36   38   44   48   51 
LCS_GDT     D     3_A     D     3_A     10   15   20     10   10   10   11   14   16   18   20   21   23   24   25   28   30   32   36   38   44   48   51 
LCS_GDT     R     4_A     R     4_A     10   15   20     10   10   10   11   14   16   18   20   21   23   24   25   28   30   32   36   38   44   48   51 
LCS_GDT     E     5_A     E     5_A     10   15   20     10   10   10   11   14   16   18   20   21   23   24   25   28   30   32   36   38   44   48   51 
LCS_GDT     L     6_A     L     6_A     10   15   20     10   10   10   11   14   16   18   20   21   23   24   25   28   30   32   36   38   44   48   51 
LCS_GDT     E     7_A     E     7_A     10   15   20     10   10   10   11   14   16   18   20   21   23   24   25   28   30   32   36   38   44   48   51 
LCS_GDT     A     8_A     A     8_A     10   15   20     10   10   10   11   14   16   18   20   21   23   24   25   28   30   32   36   38   44   48   51 
LCS_GDT     S     9_A     S     9_A     10   15   20     10   10   10   11   14   16   18   20   21   23   24   25   28   30   32   36   38   44   48   51 
LCS_GDT     L    10_A     L    10_A     10   15   43     10   10   10   11   14   16   18   20   21   23   25   29   33   38   42   43   44   47   50   52 
LCS_GDT     Q    11_A     Q    11_A     10   15   43     10   10   10   11   14   16   18   20   21   23   25   29   31   33   37   41   44   47   50   52 
LCS_GDT     A    12_A     A    12_A      7   15   44      7    7    7    9   14   16   18   20   21   25   30   34   39   40   42   43   44   47   50   52 
LCS_GDT     F    13_A     F    13_A      7   15   44      7    7    7   10   14   16   22   27   30   32   34   36   39   40   42   43   44   47   50   52 
LCS_GDT     F    14_A     F    14_A      7   15   44      7    7    7   10   14   16   18   20   21   28   32   36   39   40   42   43   44   47   50   52 
LCS_GDT     E    15_A     E    15_A      7   15   44      7    7    7   10   14   16   18   20   21   23   31   35   38   40   42   43   44   47   50   52 
LCS_GDT     V    16_A     V    16_A      7   15   44      7    7    7    8   11   15   21   27   30   32   34   36   39   40   42   43   44   47   50   52 
LCS_GDT     H    17_A     H    17_A     12   17   44      5   10   12   14   17   20   23   26   30   32   34   34   38   40   42   43   44   45   48   51 
LCS_GDT     T    18_A     T    18_A     12   17   44      5   10   12   14   17   20   23   27   30   32   34   36   39   40   42   43   44   45   46   46 
LCS_GDT     R    19_A     R    19_A     12   17   44      5   10   12   14   15   20   23   27   30   32   34   36   39   40   42   43   44   45   46   46 
LCS_GDT     L    20_A     L    20_A     12   17   44      5   10   12   14   15   20   23   27   30   32   34   36   39   40   42   43   44   45   46   46 
LCS_GDT     V    21_A     V    21_A     12   17   44      5   10   12   14   15   16   21   27   30   32   34   36   39   40   42   43   44   45   46   46 
LCS_GDT     H    22_A     H    22_A     12   17   44      5   10   12   14   15   16   22   27   30   32   34   36   39   40   42   43   44   45   46   46 
LCS_GDT     R    23_A     R    23_A     12   17   44      5   10   12   14   15   16   21   25   29   32   34   36   39   40   42   43   44   45   46   46 
LCS_GDT     L    24_A     L    24_A     12   17   44      5   10   12   14   15   16   18   22   25   30   34   36   39   40   42   43   44   45   46   46 
LCS_GDT     A    25_A     A    25_A     12   17   44      5   10   12   14   15   16   18   21   23   28   32   36   39   40   42   43   44   45   46   46 
LCS_GDT     G    26_A     G    26_A     12   17   44      4   10   12   14   15   16   18   21   23   28   32   36   39   40   42   43   44   45   46   46 
LCS_GDT     I    27_A     I    27_A     12   17   44      3   10   12   14   15   16   18   20   23   25   32   36   39   40   42   43   44   45   46   46 
LCS_GDT     E    28_A     E    28_A     12   17   44      3    5   12   14   15   16   18   20   22   28   32   36   39   40   42   43   44   45   46   46 
LCS_GDT     P    29_A     P    29_A     11   21   44      5    9   11   14   15   17   22   27   30   32   34   36   39   40   42   43   44   45   46   46 
LCS_GDT     D    30_A     D    30_A     20   21   44      4   14   19   20   20   20   23   27   30   32   34   36   39   40   42   43   44   45   46   46 
LCS_GDT     P    31_A     P    31_A     20   21   44      4    9   19   20   20   20   23   27   30   32   34   36   39   40   42   43   44   45   46   46 
LCS_GDT     R    32_A     R    32_A     20   21   44      8   17   19   20   20   20   23   27   30   32   34   36   39   40   42   43   44   45   46   46 
LCS_GDT     F    33_A     F    33_A     20   21   44      4   17   19   20   20   20   23   27   30   32   34   36   39   40   42   43   44   45   46   46 
LCS_GDT     E    34_A     E    34_A     20   21   44      4   17   19   20   20   20   22   26   30   32   34   36   39   40   42   43   44   45   46   46 
LCS_GDT     I    35_A     I    35_A     20   21   44     10   17   19   20   20   20   23   27   30   32   34   36   39   40   42   43   44   45   46   46 
LCS_GDT     L    36_A     L    36_A     20   21   44     11   17   19   20   20   20   23   27   30   32   34   36   39   40   42   43   44   45   46   46 
LCS_GDT     D    37_A     D    37_A     20   21   44     11   17   19   20   20   20   23   27   30   32   34   36   39   40   42   43   44   45   46   46 
LCS_GDT     K    38_A     K    38_A     20   21   44     11   17   19   20   20   20   23   27   30   32   34   36   39   40   42   43   44   45   46   46 
LCS_GDT     Y    39_A     Y    39_A     20   21   44     11   17   19   20   20   20   23   27   30   32   34   36   39   40   42   43   44   45   46   46 
LCS_GDT     I    40_A     I    40_A     20   21   44     11   17   19   20   20   20   23   27   30   32   34   36   39   40   42   43   44   45   46   46 
LCS_GDT     F    41_A     F    41_A     20   21   44     11   17   19   20   20   20   23   27   30   32   34   36   39   40   42   43   44   45   48   51 
LCS_GDT     R    42_A     R    42_A     20   21   44     10   17   19   20   20   20   23   27   30   32   34   36   39   40   42   43   44   45   46   51 
LCS_GDT     Q    43_A     Q    43_A     20   21   44     11   17   19   20   20   20   23   27   30   32   34   36   39   40   42   43   44   46   49   51 
LCS_GDT     I    44_A     I    44_A     20   21   44     11   17   19   20   20   20   23   26   30   32   34   36   39   40   45   45   47   49   53   56 
LCS_GDT     V    45_A     V    45_A     20   21   44     11   17   19   20   20   20   23   27   30   32   34   36   39   40   45   45   47   49   53   56 
LCS_GDT     A    46_A     A    46_A     20   21   44      4   17   19   20   20   20   23   27   30   32   34   36   39   40   45   45   47   49   53   56 
LCS_GDT     D    47_A     D    47_A     20   21   44     11   17   19   20   20   20   23   26   29   32   34   36   39   40   45   45   47   49   53   56 
LCS_GDT     N    48_A     N    48_A     20   21   44     11   17   19   20   20   20   23   26   30   32   34   36   39   40   45   45   47   49   53   56 
LCS_GDT     P    49_A     P    49_A     20   21   44      5   17   19   20   20   20   23   27   30   32   34   36   39   40   45   45   47   49   53   56 
LCS_GDT     E    50_A     E    50_A      5   21   44      4    5    5    9   12   19   20   27   30   32   34   36   39   40   45   45   47   49   53   56 
LCS_GDT     E    51_A     E    51_A      9   21   44      8    9    9   10   13   19   22   27   30   32   34   36   39   40   45   45   47   49   53   56 
LCS_GDT     R    52_A     R    52_A      9   12   44      8    9    9    9   12   14   21   27   29   32   34   36   39   40   45   45   47   49   53   57 
LCS_GDT     E    53_A     E    53_A      9   12   44      8    9    9    9   12   12   16   23   26   28   32   35   37   40   45   45   47   52   56   59 
LCS_GDT     K    54_A     K    54_A      9   12   44      8    9    9    9   12   12   16   23   26   28   32   35   37   40   45   45   47   51   56   59 
LCS_GDT     I    55_A     I    55_A      9   12   44      8    9    9    9   12   13   16   23   26   28   32   33   36   39   45   45   47   50   56   59 
LCS_GDT     R    56_A     R    56_A      9   12   27      8    9    9    9   12   13   16   23   26   28   32   33   36   39   45   45   47   52   56   59 
LCS_GDT     L    57_A     L    57_A      9   12   25      8    9    9    9   12   12   12   17   26   28   32   33   36   39   45   45   47   51   56   59 
LCS_GDT     D    58_A     D    58_A      9   12   25      8    9    9    9   12   12   12   15   16   22   24   31   36   39   45   45   47   49   53   56 
LCS_GDT     Y    59_A     Y    59_A      9   12   25      7    9    9    9   12   12   12   15   17   22   24   31   36   38   45   45   47   51   56   59 
LCS_GDT     G    60_A     G    60_A      3   14   25      3    3    4    5    8    9   12   19   24   28   32   33   36   39   45   45   47   49   54   59 
LCS_GDT     R    61_A     R    61_A     13   14   25     11   13   13   13   13   13   16   23   26   28   32   33   36   39   45   45   47   47   53   56 
LCS_GDT     A    62_A     A    62_A     13   14   25     11   13   13   13   13   13   13   22   26   28   32   33   36   39   45   45   47   49   53   56 
LCS_GDT     A    63_A     A    63_A     13   14   25     11   13   13   13   13   13   16   23   26   28   32   33   36   39   45   45   47   49   53   56 
LCS_GDT     E    64_A     E    64_A     13   14   25     11   13   13   13   13   13   13   15   16   25   28   33   36   39   45   45   47   47   53   56 
LCS_GDT     I    65_A     I    65_A     13   14   25     11   13   13   13   13   13   13   15   16   18   21   29   35   37   45   45   47   47   49   55 
LCS_GDT     F    66_A     F    66_A     13   14   27     11   13   13   13   13   13   13   15   16   18   28   32   35   39   45   45   47   51   56   59 
LCS_GDT     R    67_A     R    67_A     13   14   27     11   13   13   13   13   13   13   15   16   18   20   25   27   30   35   39   43   51   56   59 
LCS_GDT     D    68_A     D    68_A     13   14   28     11   13   13   13   13   13   13   15   16   18   20   25   27   30   33   38   43   51   56   59 
LCS_GDT     A    69_A     A    69_A     13   14   28     11   13   13   13   13   13   13   15   16   19   21   25   28   35   40   44   48   52   56   59 
LCS_GDT     L    70_A     L    70_A     13   14   30     11   13   13   13   13   13   14   16   18   19   21   25   29   36   40   45   49   52   56   59 
LCS_GDT     A    71_A     A    71_A     13   14   40     11   13   13   13   13   13   13   15   16   18   21   25   27   35   40   42   48   52   56   59 
LCS_GDT     R    72_A     R    72_A     13   14   40      5   13   13   13   13   13   13   16   18   19   21   26   33   36   42   45   49   52   56   59 
LCS_GDT     D    73_A     D    73_A     13   14   40      5   13   13   13   13   13   15   16   18   20   24   31   36   40   44   46   49   52   56   59 
LCS_GDT     I    74_A     I    74_A      4   14   40      3    4    4    6    9   13   20   24   30   32   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     T    75_A     T    75_A      4   14   40      3    4    6   12   19   27   29   32   32   34   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     T    76_A     T    76_A     13   14   40      3   11   13   15   23   29   33   33   33   34   35   35   39   41   44   46   49   52   56   59 
LCS_GDT     P    77_A     P    77_A     13   14   40      4   11   13   14   22   29   33   33   33   34   35   36   40   41   44   46   49   52   56   59 
LCS_GDT     E    78_A     E    78_A     13   14   40      5   11   13   14   15   25   33   33   33   34   35   35   36   39   43   45   47   50   56   59 
LCS_GDT     A    79_A     A    79_A     13   17   40      5   11   13   14   21   29   33   33   33   34   35   35   39   41   44   46   49   52   56   59 
LCS_GDT     F    80_A     F    80_A     13   20   40      5   11   13   16   23   29   33   33   33   34   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     N    81_A     N    81_A     13   20   40      4   11   13   15   23   29   33   33   33   34   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     A    82_A     A    82_A     13   20   40      5   11   13   15   23   29   33   33   33   34   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     Y    83_A     Y    83_A     13   25   40      5   11   13   14   23   29   33   33   33   34   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     L    84_A     L    84_A     13   25   40      5   11   14   22   23   29   33   33   33   34   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     E    85_A     E    85_A     13   25   40      5   11   13   15   23   29   33   33   33   34   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     A    86_A     A    86_A     13   25   40      5   10   13   18   23   29   33   33   33   34   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     L    87_A     L    87_A     13   25   40      3   10   13   22   23   29   33   33   33   34   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     G    88_A     G    88_A     20   25   40      3   12   20   22   23   29   33   33   33   34   36   38   40   41   44   46   49   52   56   58 
LCS_GDT     P    89_A     P    89_A     20   25   40      3   12   20   22   23   29   33   33   33   34   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     D    90_A     D    90_A     20   25   40      5   15   20   22   23   29   33   33   33   34   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     A    91_A     A    91_A     20   25   40      5   15   20   22   23   29   33   33   33   34   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     V    92_A     V    92_A     20   25   40      5   15   20   22   23   29   33   33   33   34   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     R    93_A     R    93_A     20   25   40     11   15   20   22   23   29   33   33   33   34   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     T    94_A     T    94_A     20   25   40      5   15   20   22   23   29   33   33   33   34   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     V    95_A     V    95_A     20   25   40      5   15   20   22   23   29   33   33   33   34   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     Q    96_A     Q    96_A     20   25   40     11   15   20   22   23   29   33   33   33   34   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     D    97_A     D    97_A     20   25   40     11   15   20   22   23   29   33   33   33   34   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     L    98_A     L    98_A     20   25   40     10   15   20   22   23   29   33   33   33   34   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     T    99_A     T    99_A     20   25   40     11   15   20   22   23   28   33   33   33   34   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     R   100_A     R   100_A     20   25   40     11   15   20   22   23   29   33   33   33   34   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     R   101_A     R   101_A     20   25   40     11   15   20   22   23   29   33   33   33   34   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     F   102_A     F   102_A     20   25   40     11   15   20   22   23   29   33   33   33   34   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     V   103_A     V   103_A     20   25   40     11   15   20   22   23   29   33   33   33   34   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     D   104_A     D   104_A     20   25   40     11   15   20   22   23   29   33   33   33   34   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     V   105_A     V   105_A     20   25   40     11   15   20   22   23   29   33   33   33   34   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     I   106_A     I   106_A     20   25   40     11   15   20   22   23   29   33   33   33   34   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     R   107_A     R   107_A     20   25   40     11   15   20   22   23   29   33   33   33   34   35   38   40   41   44   46   49   52   56   58 
LCS_GDT     A   108_A     A   108_A      7   25   40      3    3    7   15   22   26   33   33   33   34   35   35   38   41   43   46   47   52   56   58 
LCS_GDT     D   109_A     D   109_A     10   13   40      5   10   11   12   20   22   26   28   31   34   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     P   110_A     P   110_A     10   13   40      9   10   11   12   13   13   13   15   21   27   32   36   40   41   44   46   49   52   56   59 
LCS_GDT     E   111_A     E   111_A     10   13   40      9   10   11   12   13   13   13   14   14   16   19   21   29   35   38   41   46   50   56   59 
LCS_GDT     A   112_A     A   112_A     10   13   40      9   10   11   12   13   13   13   14   15   17   19   25   31   38   38   42   46   50   56   59 
LCS_GDT     I   113_A     I   113_A     10   13   40      9   10   11   12   13   13   13   14   19   23   26   32   34   38   41   45   46   50   56   59 
LCS_GDT     A   114_A     A   114_A     10   13   28      9   10   11   18   19   19   19   20   21   22   23   27   29   33   36   40   44   49   53   56 
LCS_GDT     K   115_A     K   115_A     10   13   26      9   10   11   12   13   13   14   19   20   21   23   25   29   33   36   40   44   49   53   56 
LCS_GDT     L   116_A     L   116_A     10   13   26      9   10   11   12   13   13   14   15   18   21   23   24   29   33   36   40   43   48   53   56 
LCS_GDT     L   117_A     L   117_A     10   13   26      9   10   11   12   13   13   14   16   20   21   23   26   29   33   36   40   44   49   53   56 
LCS_GDT     N   118_A     N   118_A     10   13   26      9   10   11   12   13   13   14   16   18   20   23   26   29   33   36   40   44   49   53   56 
LCS_GDT     I   119_A     I   119_A      3   14   26      3    3    6   10   11   13   14   16   18   21   23   26   29   33   36   40   44   49   53   56 
LCS_GDT     S   120_A     S   120_A     12   14   26      4   12   12   12   12   13   13   16   17   21   23   24   26   33   36   40   43   48   51   56 
LCS_GDT     K   121_A     K   121_A     12   14   26      7   12   12   12   12   13   14   16   18   21   23   26   29   33   36   40   44   49   53   56 
LCS_GDT     E   122_A     E   122_A     12   14   26      7   12   12   12   12   13   14   16   18   21   23   26   29   33   36   40   44   49   53   56 
LCS_GDT     D   123_A     D   123_A     12   14   26      7   12   12   12   12   13   14   16   18   21   24   28   31   38   45   45   47   49   53   56 
LCS_GDT     V   124_A     V   124_A     12   14   26      7   12   12   12   12   13   14   16   18   21   24   28   30   37   45   45   47   49   53   56 
LCS_GDT     Q   125_A     Q   125_A     12   14   26      7   12   12   12   12   13   14   16   24   27   32   32   36   39   45   45   47   49   53   56 
LCS_GDT     G   126_A     G   126_A     12   14   26      7   12   12   12   12   13   14   18   24   28   32   33   36   39   45   45   47   49   53   56 
LCS_GDT     L   127_A     L   127_A     12   14   26      7   12   12   12   12   13   16   18   26   28   32   33   36   39   45   45   47   49   53   56 
LCS_GDT     A   128_A     A   128_A     12   14   26      7   12   12   12   12   13   16   23   26   28   32   33   36   39   45   45   47   49   53   56 
LCS_GDT     R   129_A     R   129_A     12   14   26      7   12   12   12   12   13   15   23   26   28   32   33   36   39   45   45   47   47   51   56 
LCS_GDT     A   130_A     A   130_A     12   14   26      6   12   12   12   12   13   15   23   26   28   30   33   36   39   45   45   47   47   49   55 
LCS_GDT     G   131_A     G   131_A     12   14   26      5   12   12   12   12   13   13   16   17   23   28   32   35   37   42   42   47   47   49   55 
LCS_GDT     E   132_A     E   132_A      8   14   26      3    9    9   11   11   13   16   23   26   28   32   33   36   39   45   45   47   49   53   56 
LCS_GDT     A   133_A     A   133_A      8   10   26      5    9    9   11   15   15   16   23   26   28   32   33   36   39   45   45   47   49   53   56 
LCS_GDT     A   134_A     A   134_A      8   10   26      5   11   13   14   15   15   15   23   25   28   32   33   36   39   45   45   47   47   51   56 
LCS_GDT     I   135_A     I   135_A      8   10   26      5    9    9   11   11   13   16   23   26   28   32   33   36   39   45   45   47   49   53   56 
LCS_GDT     E   136_A     E   136_A      8   10   26      5    9    9   11   11   13   16   23   26   28   32   33   36   39   45   45   47   49   53   56 
LCS_GDT     R   137_A     R   137_A      8   10   26      5    9    9   11   11   15   18   23   25   28   32   33   36   39   45   45   47   49   53   56 
LCS_GDT     G   138_A     G   138_A      8   10   26      5    9    9   11   11   12   12   13   20   25   28   32   35   39   45   45   47   47   53   56 
LCS_GDT     E   139_A     E   139_A      3   19   26      3    4    7   12   14   17   19   23   26   28   32   33   36   39   45   45   47   49   53   56 
LCS_GDT     G   140_A     G   140_A     17   19   26      3    8   13   18   19   19   19   23   26   28   32   33   36   39   45   45   47   49   53   56 
LCS_GDT     A   141_A     A   141_A     17   19   26      5   14   16   18   19   19   19   19   21   28   32   32   36   39   45   45   47   49   53   56 
LCS_GDT     S   142_A     S   142_A     17   19   26      8   14   16   18   19   19   19   21   26   28   32   33   36   39   45   45   47   52   56   59 
LCS_GDT     L   143_A     L   143_A     17   19   26      8   14   16   18   19   19   19   20   24   25   32   32   36   39   45   45   49   52   56   59 
LCS_GDT     G   144_A     G   144_A     17   19   26     11   14   16   18   19   19   19   20   21   22   24   30   33   38   45   46   49   52   56   59 
LCS_GDT     V   145_A     V   145_A     17   19   26     11   14   16   18   19   19   19   26   29   32   36   38   40   41   45   46   49   52   56   59 
LCS_GDT     L   146_A     L   146_A     17   19   26     11   14   16   18   19   25   26   28   30   32   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     R   147_A     R   147_A     17   19   26     11   14   16   18   19   19   19   24   30   32   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     E   148_A     E   148_A     17   19   26     11   14   16   21   23   25   26   28   30   32   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     L   149_A     L   149_A     17   19   26     11   14   18   21   22   25   26   28   30   32   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     R   150_A     R   150_A     17   19   26     11   14   16   18   19   20   25   28   30   32   35   38   40   41   44   46   49   52   56   59 
LCS_GDT     K   151_A     K   151_A     17   19   26     11   14   16   18   22   25   26   28   30   32   36   38   40   41   44   46   49   52   56   59 
LCS_GDT     I   152_A     I   152_A     17   19   26     11   14   16   18   19   19   22   28   30   31   33   36   40   41   44   46   49   52   56   59 
LCS_GDT     E   153_A     E   153_A     17   19   26     11   14   16   18   19   19   19   20   21   22   24   33   38   40   44   45   49   52   56   58 
LCS_GDT     K   154_A     K   154_A     17   19   26     11   14   16   18   19   19   19   20   21   24   32   33   38   40   44   45   49   52   54   58 
LCS_GDT     K   155_A     K   155_A     17   19   26      3    9   16   18   19   19   19   20   21   22   30   31   38   40   44   45   49   52   56   58 
LCS_GDT     R   156_A     R   156_A     17   19   26      3    4   16   18   19   19   19   20   21   22   23   27   29   33   35   40   43   46   50   55 
LCS_GDT     N   157_A     N   157_A     17   19   26      3    3   10   18   19   19   19   19   21   22   23   27   28   29   35   38   42   44   47   50 
LCS_AVERAGE  LCS_A:  14.00  (   8.66   11.20   22.15 )

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     11     17     20     22     23     29     33     33     33     34     36     38     40     41     45     46     49     52     56     59 
GDT PERCENT_AT   7.01  10.83  12.74  14.01  14.65  18.47  21.02  21.02  21.02  21.66  22.93  24.20  25.48  26.11  28.66  29.30  31.21  33.12  35.67  37.58
GDT RMS_LOCAL    0.22   0.50   0.96   1.30   1.41   2.13   2.42   2.42   2.42   2.59   3.60   3.74   3.93   4.06   5.10   4.65   5.08   5.45   6.27   6.91
GDT RMS_ALL_AT  20.42  27.16  18.46  17.99  18.20  19.11  19.44  19.44  19.44  19.19  18.67  18.69  18.72  18.71  23.79  18.83  19.24  19.41  19.36  20.09

# Checking swapping
#   possible swapping detected:  D     3_A      D     3_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    34_A      E    34_A
#   possible swapping detected:  D    37_A      D    37_A
#   possible swapping detected:  Y    39_A      Y    39_A
#   possible swapping detected:  D    47_A      D    47_A
#   possible swapping detected:  E    53_A      E    53_A
#   possible swapping detected:  Y    59_A      Y    59_A
#   possible swapping detected:  F    66_A      F    66_A
#   possible swapping detected:  E    85_A      E    85_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   104_A      D   104_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    32.068     0    0.140   1.177    37.534    0.000    0.000
LGA    S     2_A      S     2_A    31.071     0    0.562   0.551    31.071    0.000    0.000
LGA    D     3_A      D     3_A    27.715     0    0.026   0.268    29.188    0.000    0.000
LGA    R     4_A      R     4_A    28.804     0    0.013   1.454    33.574    0.000    0.000
LGA    E     5_A      E     5_A    29.386     0    0.057   1.161    33.622    0.000    0.000
LGA    L     6_A      L     6_A    25.100     0    0.081   0.184    26.813    0.000    0.000
LGA    E     7_A      E     7_A    23.145     0    0.093   0.973    24.960    0.000    0.000
LGA    A     8_A      A     8_A    25.931     0    0.049   0.052    27.809    0.000    0.000
LGA    S     9_A      S     9_A    25.047     0    0.118   0.763    25.498    0.000    0.000
LGA    L    10_A      L    10_A    20.064     0    0.347   0.341    21.896    0.000    0.000
LGA    Q    11_A      Q    11_A    21.165     0    0.051   1.373    22.195    0.000    0.000
LGA    A    12_A      A    12_A    20.638     0    0.062   0.089    20.929    0.000    0.000
LGA    F    13_A      F    13_A    18.591     0    0.048   1.377    19.443    0.000    0.000
LGA    F    14_A      F    14_A    18.453     0    0.061   0.398    18.839    0.000    0.000
LGA    E    15_A      E    15_A    20.032     0    0.053   0.266    21.718    0.000    0.000
LGA    V    16_A      V    16_A    19.238     0    0.302   1.181    22.382    0.000    0.000
LGA    H    17_A      H    17_A    20.774     0    0.527   1.511    25.621    0.000    0.000
LGA    T    18_A      T    18_A    22.038     0    0.030   1.178    25.784    0.000    0.000
LGA    R    19_A      R    19_A    21.952     0    0.055   1.021    25.742    0.000    0.000
LGA    L    20_A      L    20_A    17.178     0    0.085   0.111    18.839    0.000    0.000
LGA    V    21_A      V    21_A    18.154     0    0.058   0.062    20.039    0.000    0.000
LGA    H    22_A      H    22_A    21.985     0    0.073   1.053    27.849    0.000    0.000
LGA    R    23_A      R    23_A    18.376     0    0.022   1.265    19.427    0.000    0.000
LGA    L    24_A      L    24_A    17.379     0    0.060   0.124    19.544    0.000    0.000
LGA    A    25_A      A    25_A    21.894     0    0.130   0.154    24.167    0.000    0.000
LGA    G    26_A      G    26_A    23.443     0    0.146   0.146    26.930    0.000    0.000
LGA    I    27_A      I    27_A    27.284     0    0.033   1.216    29.277    0.000    0.000
LGA    E    28_A      E    28_A    30.499     0    0.093   0.987    34.022    0.000    0.000
LGA    P    29_A      P    29_A    31.391     0    0.670   0.642    34.172    0.000    0.000
LGA    D    30_A      D    30_A    36.747     0    0.205   1.149    40.206    0.000    0.000
LGA    P    31_A      P    31_A    35.841     0    0.277   0.636    39.403    0.000    0.000
LGA    R    32_A      R    32_A    35.026     0    0.082   1.356    38.515    0.000    0.000
LGA    F    33_A      F    33_A    30.542     0    0.056   0.131    32.379    0.000    0.000
LGA    E    34_A      E    34_A    29.062     0    0.073   0.137    31.034    0.000    0.000
LGA    I    35_A      I    35_A    30.447     0    0.043   0.060    35.383    0.000    0.000
LGA    L    36_A      L    36_A    28.970     0    0.068   0.098    30.292    0.000    0.000
LGA    D    37_A      D    37_A    24.219     0    0.043   1.000    25.978    0.000    0.000
LGA    K    38_A      K    38_A    24.092     0    0.031   0.137    28.836    0.000    0.000
LGA    Y    39_A      Y    39_A    25.623     0    0.033   0.167    30.358    0.000    0.000
LGA    I    40_A      I    40_A    23.496     0    0.056   0.658    25.468    0.000    0.000
LGA    F    41_A      F    41_A    19.978     0    0.042   1.605    24.529    0.000    0.000
LGA    R    42_A      R    42_A    20.820     0    0.074   1.437    25.233    0.000    0.000
LGA    Q    43_A      Q    43_A    22.581     0    0.057   0.838    29.076    0.000    0.000
LGA    I    44_A      I    44_A    20.406     0    0.085   0.125    20.989    0.000    0.000
LGA    V    45_A      V    45_A    18.109     0    0.067   1.186    18.872    0.000    0.000
LGA    A    46_A      A    46_A    20.551     0    0.672   0.648    23.680    0.000    0.000
LGA    D    47_A      D    47_A    22.345     0    0.143   1.001    24.722    0.000    0.000
LGA    N    48_A      N    48_A    21.178     0    0.474   0.599    22.875    0.000    0.000
LGA    P    49_A      P    49_A    18.751     0    0.028   0.105    21.310    0.000    0.000
LGA    E    50_A      E    50_A    21.897     0    0.173   1.335    24.237    0.000    0.000
LGA    E    51_A      E    51_A    22.103     0    0.279   1.083    24.713    0.000    0.000
LGA    R    52_A      R    52_A    18.296     0    0.085   1.211    23.612    0.000    0.000
LGA    E    53_A      E    53_A    17.736     0    0.049   1.124    18.742    0.000    0.000
LGA    K    54_A      K    54_A    20.550     0    0.044   1.410    23.281    0.000    0.000
LGA    I    55_A      I    55_A    18.927     0    0.070   0.182    20.422    0.000    0.000
LGA    R    56_A      R    56_A    18.122     0    0.103   1.914    22.416    0.000    0.000
LGA    L    57_A      L    57_A    20.786     0    0.164   0.937    22.518    0.000    0.000
LGA    D    58_A      D    58_A    22.433     0    0.174   1.195    24.291    0.000    0.000
LGA    Y    59_A      Y    59_A    20.563     0    0.413   1.247    23.669    0.000    0.000
LGA    G    60_A      G    60_A    25.070     0    0.609   0.609    25.579    0.000    0.000
LGA    R    61_A      R    61_A    27.618     0    0.614   1.209    34.816    0.000    0.000
LGA    A    62_A      A    62_A    22.313     0    0.044   0.052    24.442    0.000    0.000
LGA    A    63_A      A    63_A    25.061     0    0.032   0.030    27.296    0.000    0.000
LGA    E    64_A      E    64_A    26.819     0    0.039   1.029    33.410    0.000    0.000
LGA    I    65_A      I    65_A    21.674     0    0.061   0.221    23.484    0.000    0.000
LGA    F    66_A      F    66_A    19.362     0    0.049   0.572    20.221    0.000    0.000
LGA    R    67_A      R    67_A    23.297     0    0.092   1.590    33.224    0.000    0.000
LGA    D    68_A      D    68_A    21.621     0    0.046   1.386    22.552    0.000    0.000
LGA    A    69_A      A    69_A    16.452     0    0.043   0.046    18.314    0.000    0.000
LGA    L    70_A      L    70_A    18.584     0    0.043   0.226    22.018    0.000    0.000
LGA    A    71_A      A    71_A    21.013     0    0.082   0.089    22.920    0.000    0.000
LGA    R    72_A      R    72_A    16.417     0    0.153   1.181    21.708    0.000    0.000
LGA    D    73_A      D    73_A    13.810     0    0.462   1.422    16.812    0.000    0.000
LGA    I    74_A      I    74_A    11.503     0    0.152   1.354    16.436    1.071    0.536
LGA    T    75_A      T    75_A     6.397     0    0.098   0.972     8.442   34.524   23.741
LGA    T    76_A      T    76_A     0.829     0    0.426   0.448     5.296   75.952   57.823
LGA    P    77_A      P    77_A     2.995     0    0.052   0.543     4.791   59.048   50.884
LGA    E    78_A      E    78_A     4.064     0    0.577   1.054     7.051   40.476   28.307
LGA    A    79_A      A    79_A     3.262     0    0.081   0.082     3.841   57.381   54.571
LGA    F    80_A      F    80_A     1.387     0    0.252   1.340     4.470   72.024   59.827
LGA    N    81_A      N    81_A     2.230     0    0.062   0.110     5.391   72.976   54.583
LGA    A    82_A      A    82_A     2.171     0    0.030   0.034     3.486   70.833   66.667
LGA    Y    83_A      Y    83_A     2.530     0    0.068   0.671    10.147   62.857   33.611
LGA    L    84_A      L    84_A     2.540     0    0.073   0.226     5.854   62.976   47.619
LGA    E    85_A      E    85_A     2.111     0    0.060   0.871     5.294   75.119   58.571
LGA    A    86_A      A    86_A     0.408     0    0.170   0.166     1.047   92.976   92.476
LGA    L    87_A      L    87_A     1.514     0    0.060   0.901     3.410   77.262   67.262
LGA    G    88_A      G    88_A     1.962     0    0.472   0.472     3.013   67.143   67.143
LGA    P    89_A      P    89_A     1.608     0    0.403   0.577     3.547   79.405   70.340
LGA    D    90_A      D    90_A     1.867     0    0.099   1.167     6.087   72.857   52.321
LGA    A    91_A      A    91_A     2.201     0    0.090   0.090     3.069   72.976   68.381
LGA    V    92_A      V    92_A     1.716     0    0.101   0.109     3.165   72.976   66.259
LGA    R    93_A      R    93_A     1.972     0    0.067   1.457     5.074   79.286   61.429
LGA    T    94_A      T    94_A     1.214     0    0.051   0.077     2.779   83.690   73.401
LGA    V    95_A      V    95_A     2.273     0    0.061   0.109     4.506   67.024   56.122
LGA    Q    96_A      Q    96_A     2.991     0    0.055   1.036     8.082   62.857   40.317
LGA    D    97_A      D    97_A     1.956     0    0.037   0.162     4.397   77.143   60.417
LGA    L    98_A      L    98_A     2.105     0    0.054   1.112     5.905   70.952   57.917
LGA    T    99_A      T    99_A     3.281     0    0.032   0.179     5.429   55.476   43.673
LGA    R   100_A      R   100_A     3.145     0    0.065   0.864    10.670   59.167   28.701
LGA    R   101_A      R   101_A     2.453     0    0.100   1.357     6.729   72.976   43.247
LGA    F   102_A      F   102_A     2.420     0    0.087   0.722     7.512   70.952   42.468
LGA    V   103_A      V   103_A     3.014     0    0.072   0.219     5.423   59.167   46.599
LGA    D   104_A      D   104_A     2.984     0    0.066   0.149     6.028   60.952   43.810
LGA    V   105_A      V   105_A     2.556     0    0.301   1.221     4.733   56.071   52.857
LGA    I   106_A      I   106_A     1.583     0    0.616   0.798     4.018   63.929   57.917
LGA    R   107_A      R   107_A     2.814     0    0.230   1.088    13.160   75.476   31.169
LGA    A   108_A      A   108_A     3.561     0    0.594   0.539     6.492   41.190   36.381
LGA    D   109_A      D   109_A     7.643     0    0.030   1.266    11.348    9.048    4.583
LGA    P   110_A      P   110_A    10.453     0    0.070   0.378    14.678    0.714    2.245
LGA    E   111_A      E   111_A    17.073     0    0.057   1.402    19.766    0.000    0.000
LGA    A   112_A      A   112_A    17.867     0    0.036   0.034    19.760    0.000    0.000
LGA    I   113_A      I   113_A    15.224     0    0.064   0.715    18.019    0.000    0.000
LGA    A   114_A      A   114_A    19.437     0    0.088   0.081    23.153    0.000    0.000
LGA    K   115_A      K   115_A    25.031     0    0.044   0.237    28.990    0.000    0.000
LGA    L   116_A      L   116_A    23.958     0    0.031   0.176    25.525    0.000    0.000
LGA    L   117_A      L   117_A    21.805     0    0.217   0.236    24.472    0.000    0.000
LGA    N   118_A      N   118_A    27.556     0    0.398   0.933    30.528    0.000    0.000
LGA    I   119_A      I   119_A    26.706     0    0.704   1.636    27.194    0.000    0.000
LGA    S   120_A      S   120_A    25.081     0    0.294   0.714    25.081    0.000    0.000
LGA    K   121_A      K   121_A    24.206     0    0.036   1.086    24.830    0.000    0.000
LGA    E   122_A      E   122_A    26.172     0    0.053   0.258    32.103    0.000    0.000
LGA    D   123_A      D   123_A    24.331     0    0.055   0.185    27.407    0.000    0.000
LGA    V   124_A      V   124_A    21.337     0    0.051   0.062    22.426    0.000    0.000
LGA    Q   125_A      Q   125_A    23.011     0    0.046   0.879    26.926    0.000    0.000
LGA    G   126_A      G   126_A    23.197     0    0.098   0.098    23.269    0.000    0.000
LGA    L   127_A      L   127_A    20.783     0    0.067   0.132    22.092    0.000    0.000
LGA    A   128_A      A   128_A    20.347     0    0.035   0.032    20.813    0.000    0.000
LGA    R   129_A      R   129_A    22.018     0    0.118   1.383    27.128    0.000    0.000
LGA    A   130_A      A   130_A    20.866     0    0.056   0.053    21.234    0.000    0.000
LGA    G   131_A      G   131_A    19.946     0    0.108   0.108    20.270    0.000    0.000
LGA    E   132_A      E   132_A    20.416     0    0.090   0.765    27.845    0.000    0.000
LGA    A   133_A      A   133_A    16.857     0    0.054   0.055    18.729    0.000    0.000
LGA    A   134_A      A   134_A    12.264     0    0.082   0.094    14.425    0.000    0.000
LGA    I   135_A      I   135_A    13.435     0    0.038   0.121    18.583    0.000    0.000
LGA    E   136_A      E   136_A    14.586     0    0.049   1.085    20.641    0.000    0.000
LGA    R   137_A      R   137_A     9.271     0    0.205   0.824    13.992    1.786    1.255
LGA    G   138_A      G   138_A     9.337     0    0.264   0.264    10.684    0.714    0.714
LGA    E   139_A      E   139_A    10.941     0    0.195   0.945    12.939    0.000    0.159
LGA    G   140_A      G   140_A    15.859     0    0.572   0.572    15.859    0.000    0.000
LGA    A   141_A      A   141_A    14.355     0    0.067   0.070    15.028    0.000    0.000
LGA    S   142_A      S   142_A    13.500     0    0.059   0.663    15.218    0.000    0.000
LGA    L   143_A      L   143_A    13.559     0    0.036   1.391    14.667    0.000    0.000
LGA    G   144_A      G   144_A    12.649     0    0.034   0.034    13.062    0.000    0.000
LGA    V   145_A      V   145_A    12.486     0    0.073   0.076    13.271    0.000    0.000
LGA    L   146_A      L   146_A    13.682     0    0.138   1.392    14.637    0.000    0.000
LGA    R   147_A      R   147_A    14.991     0    0.039   1.353    17.671    0.000    0.000
LGA    E   148_A      E   148_A    14.680     0    0.045   1.173    15.960    0.000    0.000
LGA    L   149_A      L   149_A    15.188     0    0.011   1.328    16.933    0.000    0.000
LGA    R   150_A      R   150_A    17.152     0    0.025   1.257    18.908    0.000    0.000
LGA    K   151_A      K   151_A    18.290     0    0.043   0.639    19.962    0.000    0.000
LGA    I   152_A      I   152_A    18.831     0    0.029   0.154    20.829    0.000    0.000
LGA    E   153_A      E   153_A    20.121     0    0.096   0.866    22.600    0.000    0.000
LGA    K   154_A      K   154_A    22.105     0    0.083   0.940    24.548    0.000    0.000
LGA    K   155_A      K   155_A    24.181     0    0.178   0.759    26.331    0.000    0.000
LGA    R   156_A      R   156_A    26.846     0    0.034   1.122    33.182    0.000    0.000
LGA    N   157_A      N   157_A    27.523     0    0.259   0.622    28.683    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):    16.556         16.479                 17.364           14.582   11.505

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  158  157    4.0     33    2.42    18.790    17.179     1.308

LGA_LOCAL      RMSD:   2.423  Number of atoms:   33  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  19.440  Number of assigned atoms:  157 
Std_ASGN_ATOMS RMSD:  16.556  Standard rmsd on all 157 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.791103 * X  +   0.521405 * Y  +   0.319834 * Z  +  -6.513649
  Y_new =   0.016810 * X  +  -0.541209 * Y  +   0.840720 * Z  +  30.907679
  Z_new =   0.611452 * X  +  -0.659720 * Y  +  -0.436916 * Z  + -30.030115 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  0.021245 -0.657895 -2.155753   [DEG:    1.2173  -37.6946 -123.5155 ]
ZXZ:  2.778071  2.022964  2.394147   [DEG:  159.1718  115.9073  137.1745 ]
 
# END of job
