
#######################################################
#                                                     #
#                        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:    50      24_A - 73_A        4.96    26.55
  LCS_AVERAGE:     24.46

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    27      48_A - 74_A        1.93    24.12
  LCS_AVERAGE:     12.20

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    23      50_A - 72_A        0.96    25.30
  LONGEST_CONTINUOUS_SEGMENT:    23      51_A - 73_A        0.55    25.35
  LCS_AVERAGE:      9.75

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   17   42      3    4   10   12   18   21   27   29   31   34   37   37   39   41   45   48   51   53   59   65 
LCS_GDT     S     2_A     S     2_A     11   17   42      9   10   11   12   18   21   27   29   31   34   37   37   39   41   45   48   51   53   59   65 
LCS_GDT     D     3_A     D     3_A     11   17   42      9   10   11   12   18   21   27   29   31   32   37   37   39   41   45   48   51   53   59   65 
LCS_GDT     R     4_A     R     4_A     11   17   42      9   10   11   12   18   21   27   29   31   32   35   36   38   41   45   48   51   53   59   65 
LCS_GDT     E     5_A     E     5_A     11   18   42      9   10   11   13   18   21   27   29   31   34   37   37   39   41   45   48   51   53   59   65 
LCS_GDT     L     6_A     L     6_A     11   20   42      9   10   11   13   18   21   27   29   31   34   37   37   39   41   45   48   51   53   59   65 
LCS_GDT     E     7_A     E     7_A     11   20   42      9   10   11   13   18   21   27   29   31   34   37   37   39   41   45   48   51   55   59   65 
LCS_GDT     A     8_A     A     8_A     11   20   42      9   10   11   13   18   21   27   29   31   34   37   38   41   44   46   49   51   55   59   62 
LCS_GDT     S     9_A     S     9_A     11   20   42      8   10   11   12   18   21   27   29   31   34   37   38   41   44   46   49   51   55   59   62 
LCS_GDT     L    10_A     L    10_A     16   20   42      9   12   15   16   18   21   27   29   31   34   37   38   41   44   46   49   51   55   59   65 
LCS_GDT     Q    11_A     Q    11_A     16   20   42      9   12   15   16   18   21   24   29   31   34   37   38   41   44   46   49   51   55   59   62 
LCS_GDT     A    12_A     A    12_A     16   20   42      9   12   15   16   18   21   27   29   31   34   37   38   41   44   46   49   51   55   59   62 
LCS_GDT     F    13_A     F    13_A     16   20   42      9   12   15   16   18   21   27   29   31   34   37   38   41   44   46   49   51   55   59   65 
LCS_GDT     F    14_A     F    14_A     16   20   42      9   12   15   16   18   21   27   29   31   34   37   38   41   44   46   49   51   55   59   65 
LCS_GDT     E    15_A     E    15_A     16   20   42      9   12   15   16   18   21   27   29   31   34   37   38   41   44   46   49   51   55   59   62 
LCS_GDT     V    16_A     V    16_A     16   20   42      9   12   15   16   18   21   27   29   31   34   37   38   41   44   46   49   51   55   59   62 
LCS_GDT     H    17_A     H    17_A     16   20   42      9   12   15   16   18   21   27   29   31   34   37   38   45   51   52   54   56   56   60   65 
LCS_GDT     T    18_A     T    18_A     16   20   42      7   12   15   16   18   21   27   29   31   34   37   38   41   44   51   53   56   56   60   65 
LCS_GDT     R    19_A     R    19_A     16   20   42      9   12   15   16   18   21   27   29   31   34   37   38   41   44   46   49   51   55   59   65 
LCS_GDT     L    20_A     L    20_A     16   20   42      6   12   15   16   18   21   27   29   31   34   37   38   43   51   52   54   56   56   60   65 
LCS_GDT     V    21_A     V    21_A     16   20   42      5   12   15   16   17   21   27   29   31   35   38   42   46   51   52   54   56   56   60   65 
LCS_GDT     H    22_A     H    22_A     16   20   42      5   10   15   16   17   21   27   29   31   34   37   38   45   51   52   54   56   56   60   65 
LCS_GDT     R    23_A     R    23_A     16   20   42      5   11   15   16   17   21   27   29   31   34   37   42   46   51   52   54   56   56   60   65 
LCS_GDT     L    24_A     L    24_A     16   20   50      5   11   15   16   17   21   27   29   32   35   38   42   46   51   52   54   56   56   60   65 
LCS_GDT     A    25_A     A    25_A     16   20   50      4    9   15   16   17   21   23   29   31   34   38   42   46   51   52   54   56   56   60   65 
LCS_GDT     G    26_A     G    26_A      8   19   50      4    4    8   12   17   17   21   26   30   35   38   42   46   51   52   54   56   56   60   65 
LCS_GDT     I    27_A     I    27_A      5    7   50      3    4    6    8    9   14   20   26   30   35   38   42   46   51   52   54   56   56   60   65 
LCS_GDT     E    28_A     E    28_A      5   20   50      3    4   13   16   18   19   20   20   23   32   38   42   46   51   52   54   56   56   60   65 
LCS_GDT     P    29_A     P    29_A      5   20   50      3    4    6    8   18   19   20   20   23   26   32   42   46   51   52   54   56   56   60   65 
LCS_GDT     D    30_A     D    30_A     18   20   50      4   16   18   18   18   19   20   20   25   29   32   35   38   44   51   54   56   56   56   58 
LCS_GDT     P    31_A     P    31_A     18   20   50     10   16   18   18   18   19   20   20   23   26   32   42   46   51   52   54   56   56   60   64 
LCS_GDT     R    32_A     R    32_A     18   20   50      9   16   18   18   18   19   20   20   21   22   25   35   36   41   44   50   56   56   60   64 
LCS_GDT     F    33_A     F    33_A     18   20   50     13   16   18   18   18   19   20   24   27   34   37   37   39   47   52   54   56   56   60   63 
LCS_GDT     E    34_A     E    34_A     18   20   50     13   16   18   18   18   19   22   27   32   35   38   42   46   51   52   54   56   56   60   64 
LCS_GDT     I    35_A     I    35_A     18   20   50     13   16   18   18   18   19   20   20   25   32   38   42   46   51   52   54   56   56   60   64 
LCS_GDT     L    36_A     L    36_A     18   20   50     13   16   18   18   18   19   20   22   28   34   37   37   39   51   52   54   56   56   60   64 
LCS_GDT     D    37_A     D    37_A     18   20   50     13   16   18   18   18   19   20   28   32   35   38   42   46   51   52   54   56   56   60   64 
LCS_GDT     K    38_A     K    38_A     18   20   50     13   16   18   18   18   20   26   30   32   35   38   42   46   51   52   54   56   56   60   65 
LCS_GDT     Y    39_A     Y    39_A     18   20   50     13   16   18   18   18   19   20   26   30   35   38   42   46   51   52   54   56   56   60   65 
LCS_GDT     I    40_A     I    40_A     18   20   50     13   16   18   18   18   21   26   29   31   34   37   42   46   51   52   54   56   56   60   65 
LCS_GDT     F    41_A     F    41_A     18   20   50     13   16   18   18   18   24   28   30   32   35   38   42   46   51   52   54   56   56   60   65 
LCS_GDT     R    42_A     R    42_A     18   20   50     13   16   18   18   18   20   27   30   32   35   38   42   46   51   52   54   56   56   60   65 
LCS_GDT     Q    43_A     Q    43_A     18   20   50     13   16   18   18   18   19   26   30   32   35   38   42   46   51   52   54   56   56   60   65 
LCS_GDT     I    44_A     I    44_A     18   20   50     13   16   18   18   18   21   27   29   31   32   35   38   43   51   52   54   56   56   60   65 
LCS_GDT     V    45_A     V    45_A     18   20   50     13   16   18   18   18   21   27   29   31   32   37   37   39   51   52   54   56   56   60   65 
LCS_GDT     A    46_A     A    46_A     18   20   50     12   16   18   18   18   23   28   30   32   35   38   42   46   51   52   54   56   56   60   65 
LCS_GDT     D    47_A     D    47_A     18   26   50     10   16   18   18   18   21   27   28   31   32   38   42   46   51   52   54   56   56   60   65 
LCS_GDT     N    48_A     N    48_A      6   27   50      5    6    6   11   16   24   28   30   32   35   38   42   46   51   52   54   56   56   60   65 
LCS_GDT     P    49_A     P    49_A      6   27   50      5    6    9   14   22   24   28   30   32   35   38   42   46   51   52   54   56   56   60   65 
LCS_GDT     E    50_A     E    50_A     23   27   50      5    6    6   10   16   23   28   30   32   34   38   42   46   51   52   54   56   56   60   65 
LCS_GDT     E    51_A     E    51_A     23   27   50     19   22   23   23   23   24   28   30   32   34   36   42   46   51   52   54   56   56   60   65 
LCS_GDT     R    52_A     R    52_A     23   27   50     19   22   23   23   23   24   28   30   32   35   38   42   46   51   52   54   56   56   60   65 
LCS_GDT     E    53_A     E    53_A     23   27   50     19   22   23   23   23   24   28   30   32   35   38   42   46   51   52   54   56   56   60   65 
LCS_GDT     K    54_A     K    54_A     23   27   50     19   22   23   23   23   24   28   30   32   34   38   42   46   51   52   54   56   56   59   64 
LCS_GDT     I    55_A     I    55_A     23   27   50     19   22   23   23   23   24   28   30   32   35   38   42   46   51   52   54   56   56   60   65 
LCS_GDT     R    56_A     R    56_A     23   27   50     19   22   23   23   23   24   28   30   32   35   38   42   46   51   52   54   56   56   60   65 
LCS_GDT     L    57_A     L    57_A     23   27   50     19   22   23   23   23   24   28   30   32   35   38   42   46   51   52   54   56   56   60   64 
LCS_GDT     D    58_A     D    58_A     23   27   50     19   22   23   23   23   24   28   30   32   35   38   42   46   51   52   54   56   56   60   65 
LCS_GDT     Y    59_A     Y    59_A     23   27   50     19   22   23   23   23   24   28   30   32   35   38   42   46   51   52   54   56   56   60   65 
LCS_GDT     G    60_A     G    60_A     23   27   50     19   22   23   23   23   24   28   30   32   35   38   42   46   51   52   54   56   56   60   64 
LCS_GDT     R    61_A     R    61_A     23   27   50     19   22   23   23   23   24   28   30   32   35   38   42   46   51   52   54   56   56   60   64 
LCS_GDT     A    62_A     A    62_A     23   27   50     19   22   23   23   23   24   28   30   32   35   38   42   46   51   52   54   56   56   60   65 
LCS_GDT     A    63_A     A    63_A     23   27   50     16   22   23   23   23   24   28   30   32   35   38   42   46   51   52   54   56   56   60   65 
LCS_GDT     E    64_A     E    64_A     23   27   50     15   22   23   23   23   24   28   30   32   35   38   42   46   51   52   54   56   56   60   64 
LCS_GDT     I    65_A     I    65_A     23   27   50     19   22   23   23   23   24   28   30   32   35   38   42   46   51   52   54   56   56   60   64 
LCS_GDT     F    66_A     F    66_A     23   27   50     19   22   23   23   23   24   28   30   32   35   38   42   46   51   52   54   56   56   60   65 
LCS_GDT     R    67_A     R    67_A     23   27   50     19   22   23   23   23   24   28   30   32   35   38   42   46   51   52   54   56   56   60   64 
LCS_GDT     D    68_A     D    68_A     23   27   50     19   22   23   23   23   24   28   30   32   35   38   42   46   51   52   54   56   56   60   64 
LCS_GDT     A    69_A     A    69_A     23   27   50     19   22   23   23   23   24   28   30   32   35   38   42   46   51   52   54   56   56   60   65 
LCS_GDT     L    70_A     L    70_A     23   27   50     19   22   23   23   23   24   28   30   32   35   38   42   46   51   52   54   56   56   60   65 
LCS_GDT     A    71_A     A    71_A     23   27   50     19   22   23   23   23   24   28   30   32   35   38   42   46   51   52   54   56   56   60   64 
LCS_GDT     R    72_A     R    72_A     23   27   50     10   22   23   23   23   23   28   30   32   35   38   42   46   51   52   54   56   56   60   64 
LCS_GDT     D    73_A     D    73_A     23   27   50      5   16   23   23   23   23   28   30   32   35   38   42   46   50   52   54   56   56   60   65 
LCS_GDT     I    74_A     I    74_A      4   27   44      3    4    4    7   20   22   24   28   31   34   35   37   41   43   46   50   52   55   60   65 
LCS_GDT     T    75_A     T    75_A     14   25   44      5    8   13   14   15   19   22   25   27   32   34   35   37   41   45   48   52   55   60   65 
LCS_GDT     T    76_A     T    76_A     14   17   43      5   11   13   14   16   19   21   25   27   32   34   35   41   44   46   49   51   55   59   65 
LCS_GDT     P    77_A     P    77_A     14   17   41      6   11   13   14   16   19   21   25   27   32   34   35   41   44   46   49   51   55   59   62 
LCS_GDT     E    78_A     E    78_A     14   17   41      8   11   13   14   15   19   21   25   27   32   34   38   41   44   46   49   51   55   59   62 
LCS_GDT     A    79_A     A    79_A     14   17   41      8   11   13   14   16   19   21   25   27   32   34   38   41   44   46   49   51   55   59   65 
LCS_GDT     F    80_A     F    80_A     14   17   41      8   11   13   14   16   19   21   25   27   32   34   38   41   44   46   49   51   55   60   65 
LCS_GDT     N    81_A     N    81_A     14   17   41      8   11   13   14   16   19   21   25   27   30   34   38   41   44   46   49   51   55   59   65 
LCS_GDT     A    82_A     A    82_A     14   17   41      8   11   13   14   16   19   21   25   27   30   34   38   41   44   46   49   51   55   59   62 
LCS_GDT     Y    83_A     Y    83_A     14   17   41      9   11   13   14   16   19   21   25   27   30   34   38   41   44   46   49   51   55   59   65 
LCS_GDT     L    84_A     L    84_A     14   17   41      8   11   13   14   16   19   21   25   27   30   34   38   41   44   46   49   51   55   59   65 
LCS_GDT     E    85_A     E    85_A     14   17   41      8   11   13   14   16   19   21   25   27   30   34   38   41   44   46   49   51   55   59   62 
LCS_GDT     A    86_A     A    86_A     14   17   41      8   11   13   14   16   19   21   25   27   30   33   35   37   41   45   48   50   53   54   62 
LCS_GDT     L    87_A     L    87_A     14   17   41      8   11   13   14   15   19   21   25   27   30   33   35   41   44   46   49   51   55   59   65 
LCS_GDT     G    88_A     G    88_A     14   17   41      3    6   13   14   16   19   21   25   27   30   34   38   41   44   46   49   51   55   59   65 
LCS_GDT     P    89_A     P    89_A      6   19   41      4    6    6    8   16   19   21   25   27   30   34   38   41   44   46   49   51   55   59   65 
LCS_GDT     D    90_A     D    90_A      6   19   41      4    6    6   10   16   19   21   25   27   30   34   38   41   44   46   49   51   55   59   65 
LCS_GDT     A    91_A     A    91_A     17   19   41      5   13   17   17   18   19   21   25   27   30   34   38   41   44   46   49   51   55   60   65 
LCS_GDT     V    92_A     V    92_A     17   19   41      8   13   17   17   18   18   21   22   25   29   34   38   41   44   46   49   51   55   59   65 
LCS_GDT     R    93_A     R    93_A     17   19   41      9   14   17   17   18   19   21   25   27   30   34   38   41   44   46   49   51   55   60   65 
LCS_GDT     T    94_A     T    94_A     17   19   41      9   14   17   17   18   19   21   25   27   30   33   38   41   44   46   49   52   55   60   65 
LCS_GDT     V    95_A     V    95_A     17   19   41      9   14   17   17   18   18   20   23   27   30   33   35   41   44   46   49   51   55   59   65 
LCS_GDT     Q    96_A     Q    96_A     17   19   41      9   14   17   17   18   19   21   25   27   30   33   35   39   41   46   49   51   55   59   65 
LCS_GDT     D    97_A     D    97_A     17   19   41      9   14   17   17   18   18   20   22   25   30   33   35   39   41   45   49   50   55   59   62 
LCS_GDT     L    98_A     L    98_A     17   19   41      9   14   17   17   18   18   20   22   23   26   30   35   39   40   45   48   50   51   54   61 
LCS_GDT     T    99_A     T    99_A     17   19   41      9   14   17   17   18   18   20   22   25   30   32   35   39   41   45   48   50   51   54   57 
LCS_GDT     R   100_A     R   100_A     17   19   41      9   14   17   17   18   18   20   22   25   30   32   35   39   40   41   44   47   51   53   55 
LCS_GDT     R   101_A     R   101_A     17   19   39      8   14   17   17   18   18   20   22   23   26   28   35   39   40   41   44   46   48   50   52 
LCS_GDT     F   102_A     F   102_A     17   19   39      9   14   17   17   18   18   20   22   23   26   30   35   39   40   41   44   46   48   50   52 
LCS_GDT     V   103_A     V   103_A     17   19   36      8   13   17   17   18   18   20   22   23   27   30   32   39   40   41   44   46   48   52   55 
LCS_GDT     D   104_A     D   104_A     17   19   31      5   14   17   17   18   18   20   22   23   26   28   32   33   37   39   44   46   48   50   52 
LCS_GDT     V   105_A     V   105_A     17   19   27      5   14   17   17   18   18   20   22   23   26   28   32   39   40   41   44   46   48   50   52 
LCS_GDT     I   106_A     I   106_A     17   19   27      5   14   17   17   18   18   20   22   23   26   28   32   33   36   41   44   46   48   50   52 
LCS_GDT     R   107_A     R   107_A     17   19   27      5   14   17   17   18   18   20   22   23   26   28   32   33   36   37   41   45   47   50   52 
LCS_GDT     A   108_A     A   108_A     11   19   26      4    6   10   11   12   15   19   22   23   26   28   32   33   36   37   39   43   44   46   48 
LCS_GDT     D   109_A     D   109_A     11   14   26      6    9   10   11   12   15   19   22   23   26   28   32   33   36   37   39   43   44   47   52 
LCS_GDT     P   110_A     P   110_A     11   14   26      6    9   10   11   12   14   18   21   23   26   28   30   32   36   37   39   43   44   47   52 
LCS_GDT     E   111_A     E   111_A     11   14   26      6    9   10   11   12   13   14   16   19   22   26   29   31   35   37   38   42   42   47   52 
LCS_GDT     A   112_A     A   112_A     11   14   26      6    9   10   11   12   13   14   16   19   22   26   29   31   35   37   41   42   43   47   52 
LCS_GDT     I   113_A     I   113_A     11   14   26      6    9   10   11   12   13   14   16   19   22   27   29   32   36   37   41   43   46   48   52 
LCS_GDT     A   114_A     A   114_A     11   14   26      6    9   10   11   12   13   14   16   19   20   25   28   30   35   37   38   42   42   47   52 
LCS_GDT     K   115_A     K   115_A     11   14   25      6    9   10   11   12   13   14   15   17   17   19   22   24   25   32   35   37   41   46   52 
LCS_GDT     L   116_A     L   116_A     11   14   23      6    9   10   11   12   13   14   15   17   17   19   22   24   24   25   29   37   40   47   52 
LCS_GDT     L   117_A     L   117_A     11   14   23      6    9   10   11   12   13   14   15   17   17   19   22   24   25   32   35   37   41   47   52 
LCS_GDT     N   118_A     N   118_A     11   14   23      3    8   10   11   12   13   14   15   17   17   19   22   25   31   36   41   45   47   48   51 
LCS_GDT     I   119_A     I   119_A      3   13   23      3    6    8    9   12   12   13   15   23   27   31   35   38   41   45   48   51   51   52   52 
LCS_GDT     S   120_A     S   120_A     11   13   23      7    9   11   11   12   12   13   24   27   29   37   37   39   41   45   48   51   51   52   52 
LCS_GDT     K   121_A     K   121_A     11   13   23      7    9   11   11   12   12   13   15   17   17   19   34   39   41   45   48   51   51   52   52 
LCS_GDT     E   122_A     E   122_A     11   13   23      7    9   11   11   12   12   14   20   28   34   37   37   39   41   45   48   51   51   52   52 
LCS_GDT     D   123_A     D   123_A     11   13   23      7    9   11   11   12   12   13   15   17   17   19   20   35   40   43   47   51   51   52   53 
LCS_GDT     V   124_A     V   124_A     11   13   23      7    9   11   11   12   14   17   21   26   32   34   35   37   39   41   42   45   48   50   53 
LCS_GDT     Q   125_A     Q   125_A     11   13   23      7    9   11   11   12   14   17   21   26   32   34   35   37   39   41   43   45   48   50   53 
LCS_GDT     G   126_A     G   126_A     11   13   23      7    9   11   11   12   12   15   16   19   24   27   31   36   39   41   43   44   47   50   53 
LCS_GDT     L   127_A     L   127_A     11   13   23      4    9   11   11   12   12   13   17   20   26   32   34   37   39   41   43   44   50   55   58 
LCS_GDT     A   128_A     A   128_A     11   13   23      4    9   11   11   12   12   13   16   20   27   32   35   36   38   41   43   45   50   55   58 
LCS_GDT     R   129_A     R   129_A     11   13   23      3    8   11   11   12   12   13   15   17   17   25   27   31   35   39   43   44   50   55   58 
LCS_GDT     A   130_A     A   130_A     11   13   23      3    8   11   11   12   12   13   15   17   17   19   20   28   31   35   42   44   49   55   58 
LCS_GDT     G   131_A     G   131_A      8   13   23      6    8    8   10   12   12   13   15   17   17   19   20   32   33   37   43   48   50   55   61 
LCS_GDT     E   132_A     E   132_A      8    9   23      7    8    8    8    8   11   13   15   17   17   19   20   32   35   40   44   48   53   56   61 
LCS_GDT     A   133_A     A   133_A      8    9   25      7    8    8    8    8    8   10   18   19   23   27   29   32   35   40   44   48   53   58   61 
LCS_GDT     A   134_A     A   134_A      8    9   25      7    8    8    8    8    8   10   18   18   23   27   29   32   35   40   44   48   53   58   61 
LCS_GDT     I   135_A     I   135_A      8    9   25      7    8    8    8    8    8   10   15   18   20   21   23   32   36   40   44   48   53   58   61 
LCS_GDT     E   136_A     E   136_A      8    9   25      7    8    8    8    8    8   10   12   18   21   25   28   33   37   40   44   48   53   58   61 
LCS_GDT     R   137_A     R   137_A      8    9   25      7    8    8    8    8    9   20   20   22   25   27   35   39   40   41   44   48   53   58   61 
LCS_GDT     G   138_A     G   138_A      8    9   25      7    8    8    8    8   19   20   22   23   25   30   35   39   40   41   44   48   53   58   61 
LCS_GDT     E   139_A     E   139_A      3   19   25      3    3    5   11   14   17   19   22   23   26   30   35   39   40   41   44   46   50   55   58 
LCS_GDT     G   140_A     G   140_A     18   19   25      3   14   16   18   18   18   18   19   22   26   30   35   39   40   41   44   46   50   54   55 
LCS_GDT     A   141_A     A   141_A     18   19   25     13   14   16   18   18   18   18   20   23   26   31   35   39   41   45   48   50   51   54   55 
LCS_GDT     S   142_A     S   142_A     18   19   25     13   14   16   18   18   18   18   20   23   26   30   35   39   40   45   48   50   51   54   55 
LCS_GDT     L   143_A     L   143_A     18   19   25     13   14   16   18   18   18   18   19   20   26   28   35   39   40   41   44   46   50   54   55 
LCS_GDT     G   144_A     G   144_A     18   19   25     13   14   16   18   18   18   18   19   21   26   30   35   39   40   43   48   50   51   54   55 
LCS_GDT     V   145_A     V   145_A     18   19   25     13   14   16   18   18   18   18   19   22   29   31   35   39   41   45   48   50   51   54   55 
LCS_GDT     L   146_A     L   146_A     18   19   25     13   14   16   18   18   18   18   19   20   23   30   35   39   40   41   47   50   51   53   55 
LCS_GDT     R   147_A     R   147_A     18   19   25     13   14   16   18   18   18   18   19   20   23   30   35   39   40   41   48   50   51   54   55 
LCS_GDT     E   148_A     E   148_A     18   19   25     13   14   16   18   18   18   18   19   22   29   31   35   39   41   45   48   50   51   54   55 
LCS_GDT     L   149_A     L   149_A     18   19   25     13   14   16   18   18   18   18   19   21   23   30   35   39   41   45   48   50   51   53   55 
LCS_GDT     R   150_A     R   150_A     18   19   25     13   14   16   18   18   18   18   19   21   23   30   35   39   41   45   48   50   51   53   55 
LCS_GDT     K   151_A     K   151_A     18   19   25     13   14   16   18   18   18   18   19   21   29   31   35   39   41   45   48   50   51   54   55 
LCS_GDT     I   152_A     I   152_A     18   19   25     13   14   16   18   18   18   18   19   20   23   30   35   39   41   45   48   50   51   53   55 
LCS_GDT     E   153_A     E   153_A     18   19   25     13   14   16   18   18   18   18   19   20   23   30   35   39   40   41   44   48   51   53   55 
LCS_GDT     K   154_A     K   154_A     18   19   25     11   14   16   18   18   18   18   19   20   25   31   35   39   41   45   48   50   51   53   55 
LCS_GDT     K   155_A     K   155_A     18   19   25      3   14   16   18   18   18   18   19   20   23   30   35   39   40   45   47   50   51   53   55 
LCS_GDT     R   156_A     R   156_A     18   19   25      3    4    4   18   18   18   18   19   20   23   30   35   39   40   41   44   47   50   52   55 
LCS_GDT     N   157_A     N   157_A     18   19   25      3    3    5   18   18   18   18   19   20   23   30   35   39   40   41   44   47   50   53   55 
LCS_AVERAGE  LCS_A:  15.47  (   9.75   12.20   24.46 )

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     19     22     23     23     23     24     28     30     32     35     38     42     46     51     52     54     56     56     60     65 
GDT PERCENT_AT  12.10  14.01  14.65  14.65  14.65  15.29  17.83  19.11  20.38  22.29  24.20  26.75  29.30  32.48  33.12  34.39  35.67  35.67  38.22  41.40
GDT RMS_LOCAL    0.30   0.42   0.55   0.55   0.55   1.67   1.99   2.33   2.60   3.48   3.82   4.05   4.39   4.90   4.89   5.11   5.32   5.32   6.50   7.55
GDT RMS_ALL_AT  25.01  25.15  25.35  25.35  25.35  24.43  24.78  25.28  25.59  26.98  26.88  26.86  26.96  27.17  27.13  26.95  27.01  27.01  26.45  24.07

# Checking swapping
#   possible swapping detected:  D     3_A      D     3_A
#   possible swapping detected:  E     7_A      E     7_A
#   possible swapping detected:  F    14_A      F    14_A
#   possible swapping detected:  F    33_A      F    33_A
#   possible swapping detected:  E    34_A      E    34_A
#   possible swapping detected:  Y    39_A      Y    39_A
#   possible swapping detected:  F    41_A      F    41_A
#   possible swapping detected:  D    47_A      D    47_A
#   possible swapping detected:  E    51_A      E    51_A
#   possible swapping detected:  F    66_A      F    66_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:  Y    83_A      Y    83_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   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   139_A      E   139_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    L     1_A      L     1_A    23.194     0    0.132   1.314    27.749    0.000    0.000
LGA    S     2_A      S     2_A    21.769     0    0.107   0.514    24.842    0.000    0.000
LGA    D     3_A      D     3_A    17.445     0    0.047   1.088    19.051    0.000    0.000
LGA    R     4_A      R     4_A    23.063     0    0.030   1.544    30.962    0.000    0.000
LGA    E     5_A      E     5_A    25.334     0    0.047   0.880    29.027    0.000    0.000
LGA    L     6_A      L     6_A    19.220     0    0.038   1.399    21.072    0.000    0.000
LGA    E     7_A      E     7_A    19.046     0    0.028   0.659    22.858    0.000    0.000
LGA    A     8_A      A     8_A    25.345     0    0.036   0.040    27.731    0.000    0.000
LGA    S     9_A      S     9_A    24.193     0    0.102   0.745    24.273    0.000    0.000
LGA    L    10_A      L    10_A    18.198     0    0.289   0.928    20.166    0.000    0.000
LGA    Q    11_A      Q    11_A    21.779     0    0.036   0.877    28.122    0.000    0.000
LGA    A    12_A      A    12_A    23.518     0    0.074   0.074    25.077    0.000    0.000
LGA    F    13_A      F    13_A    16.745     0    0.076   1.441    19.122    0.000    0.000
LGA    F    14_A      F    14_A    15.454     0    0.068   1.355    17.125    0.000    0.000
LGA    E    15_A      E    15_A    21.036     0    0.037   0.431    29.006    0.000    0.000
LGA    V    16_A      V    16_A    18.368     0    0.076   1.077    19.955    0.000    0.000
LGA    H    17_A      H    17_A    11.573     0    0.054   1.247    14.038    0.000    1.952
LGA    T    18_A      T    18_A    16.075     0    0.048   1.028    19.965    0.000    0.000
LGA    R    19_A      R    19_A    19.001     0    0.048   1.199    28.902    0.000    0.000
LGA    L    20_A      L    20_A    12.720     0    0.084   1.423    14.788    0.000    0.000
LGA    V    21_A      V    21_A    10.973     0    0.047   0.113    12.778    0.000    0.000
LGA    H    22_A      H    22_A    16.843     0    0.102   1.044    23.822    0.000    0.000
LGA    R    23_A      R    23_A    14.364     0    0.101   1.578    24.485    0.000    0.000
LGA    L    24_A      L    24_A     8.149     0    0.091   1.099    10.171    2.738    9.226
LGA    A    25_A      A    25_A    12.625     0    0.143   0.144    15.052    0.000    0.000
LGA    G    26_A      G    26_A    13.982     0    0.338   0.338    14.237    0.000    0.000
LGA    I    27_A      I    27_A    13.546     0    0.193   1.159    13.565    0.000    0.000
LGA    E    28_A      E    28_A    13.374     0    0.085   1.032    13.766    0.000    0.000
LGA    P    29_A      P    29_A    13.607     0    0.162   0.306    14.906    0.000    0.000
LGA    D    30_A      D    30_A    13.011     0    0.629   0.523    13.712    0.000    0.000
LGA    P    31_A      P    31_A    12.853     0    0.026   0.175    14.463    0.000    0.000
LGA    R    32_A      R    32_A    15.291     0    0.111   1.436    21.406    0.000    0.000
LGA    F    33_A      F    33_A    11.160     0    0.061   1.375    12.531    1.071    2.944
LGA    E    34_A      E    34_A     7.004     0    0.049   0.813     9.647    8.214    7.884
LGA    I    35_A      I    35_A    11.192     0    0.051   1.270    18.440    0.119    0.060
LGA    L    36_A      L    36_A    10.856     0    0.058   0.858    14.021    1.905    0.952
LGA    D    37_A      D    37_A     5.520     0    0.063   0.232     7.157   27.976   27.143
LGA    K    38_A      K    38_A     5.279     0    0.037   0.639    12.760   26.310   12.963
LGA    Y    39_A      Y    39_A     7.919     0    0.042   0.986    11.168   11.905    4.048
LGA    I    40_A      I    40_A     6.901     0    0.039   0.959    12.993   18.571   11.131
LGA    F    41_A      F    41_A     3.827     0    0.031   1.445    10.081   43.452   23.810
LGA    R    42_A      R    42_A     4.237     0    0.033   1.195    11.339   43.452   17.922
LGA    Q    43_A      Q    43_A     5.230     0    0.040   0.655     8.236   28.929   16.878
LGA    I    44_A      I    44_A     6.990     0    0.033   0.149    10.344   15.000    8.333
LGA    V    45_A      V    45_A     6.717     0    0.071   1.198     8.891   18.333   12.585
LGA    A    46_A      A    46_A     3.449     0    0.040   0.054     4.071   43.452   42.190
LGA    D    47_A      D    47_A     7.013     0    0.345   1.123    11.712   15.833    7.976
LGA    N    48_A      N    48_A     4.191     0    0.259   0.950     6.293   45.833   36.250
LGA    P    49_A      P    49_A     3.272     0    0.033   0.365     5.270   53.571   43.333
LGA    E    50_A      E    50_A     2.996     0    0.199   1.371     7.712   53.690   37.354
LGA    E    51_A      E    51_A     2.322     0    0.247   1.232     3.662   67.024   62.593
LGA    R    52_A      R    52_A     1.859     0    0.068   1.369     3.752   70.833   66.190
LGA    E    53_A      E    53_A     1.719     0    0.031   0.958     4.231   72.857   64.603
LGA    K    54_A      K    54_A     1.867     0    0.034   1.383     6.617   72.857   59.048
LGA    I    55_A      I    55_A     1.742     0    0.026   1.395     5.175   72.857   64.405
LGA    R    56_A      R    56_A     1.605     0    0.028   1.277     6.373   77.143   62.468
LGA    L    57_A      L    57_A     1.430     0    0.076   1.025     2.995   79.286   72.143
LGA    D    58_A      D    58_A     1.444     0    0.034   0.103     1.642   81.429   77.143
LGA    Y    59_A      Y    59_A     1.316     0    0.034   1.150     8.944   81.429   53.532
LGA    G    60_A      G    60_A     1.293     0    0.038   0.038     1.358   81.429   81.429
LGA    R    61_A      R    61_A     1.014     0    0.037   1.556     7.503   85.952   57.662
LGA    A    62_A      A    62_A     0.959     0    0.047   0.050     1.160   88.214   86.857
LGA    A    63_A      A    63_A     1.119     0    0.069   0.067     1.359   85.952   85.048
LGA    E    64_A      E    64_A     0.538     0    0.027   0.943     2.939   95.238   84.974
LGA    I    65_A      I    65_A     0.440     0    0.044   0.122     1.326   95.238   90.595
LGA    F    66_A      F    66_A     0.965     0    0.019   1.134     7.157   88.214   54.113
LGA    R    67_A      R    67_A     1.087     0    0.045   0.900     2.353   83.690   75.368
LGA    D    68_A      D    68_A     0.775     0    0.048   0.252     1.247   90.476   89.345
LGA    A    69_A      A    69_A     1.147     0    0.042   0.052     1.335   83.690   83.238
LGA    L    70_A      L    70_A     1.208     0    0.043   1.011     5.116   81.429   67.560
LGA    A    71_A      A    71_A     1.029     0    0.149   0.145     1.259   83.690   83.238
LGA    R    72_A      R    72_A     2.410     0    0.211   1.350     9.984   61.190   39.481
LGA    D    73_A      D    73_A     3.085     0    0.600   1.474     6.976   47.143   35.833
LGA    I    74_A      I    74_A     6.045     0    0.053   0.127     9.853   23.810   14.286
LGA    T    75_A      T    75_A    10.425     0    0.456   1.367    13.767    0.714    0.408
LGA    T    76_A      T    76_A    14.070     0    0.167   1.125    15.549    0.000    0.000
LGA    P    77_A      P    77_A    18.559     0    0.107   0.409    21.164    0.000    0.000
LGA    E    78_A      E    78_A    20.065     0    0.038   1.326    23.753    0.000    0.000
LGA    A    79_A      A    79_A    15.100     0    0.030   0.033    16.431    0.000    0.000
LGA    F    80_A      F    80_A    14.817     0    0.023   1.102    16.847    0.000    0.000
LGA    N    81_A      N    81_A    20.936     0    0.045   1.193    23.312    0.000    0.000
LGA    A    82_A      A    82_A    20.933     0    0.040   0.040    20.936    0.000    0.000
LGA    Y    83_A      Y    83_A    16.599     0    0.051   0.736    18.110    0.000    0.119
LGA    L    84_A      L    84_A    19.420     0    0.045   1.347    21.796    0.000    0.000
LGA    E    85_A      E    85_A    24.626     0    0.035   0.971    30.370    0.000    0.000
LGA    A    86_A      A    86_A    22.933     0    0.082   0.080    23.608    0.000    0.000
LGA    L    87_A      L    87_A    20.530     0    0.603   1.437    23.316    0.000    0.000
LGA    G    88_A      G    88_A    25.724     0    0.189   0.189    25.724    0.000    0.000
LGA    P    89_A      P    89_A    27.467     0    0.160   0.208    30.983    0.000    0.000
LGA    D    90_A      D    90_A    21.141     0    0.077   1.096    23.335    0.000    0.000
LGA    A    91_A      A    91_A    17.698     0    0.473   0.465    19.392    0.000    0.000
LGA    V    92_A      V    92_A    23.819     0    0.086   0.953    28.249    0.000    0.000
LGA    R    93_A      R    93_A    23.029     0    0.060   1.629    23.904    0.000    0.000
LGA    T    94_A      T    94_A    16.479     0    0.035   0.120    18.538    0.000    0.000
LGA    V    95_A      V    95_A    18.420     0    0.035   0.994    20.938    0.000    0.000
LGA    Q    96_A      Q    96_A    25.254     0    0.050   0.788    31.925    0.000    0.000
LGA    D    97_A      D    97_A    23.651     0    0.041   1.100    24.148    0.000    0.000
LGA    L    98_A      L    98_A    19.606     0    0.060   1.344    22.301    0.000    0.000
LGA    T    99_A      T    99_A    24.200     0    0.043   1.274    27.597    0.000    0.000
LGA    R   100_A      R   100_A    30.065     0    0.024   1.005    35.981    0.000    0.000
LGA    R   101_A      R   101_A    28.064     0    0.038   1.703    29.439    0.000    0.000
LGA    F   102_A      F   102_A    26.052     0    0.091   1.388    29.568    0.000    0.000
LGA    V   103_A      V   103_A    32.744     0    0.080   0.362    37.122    0.000    0.000
LGA    D   104_A      D   104_A    36.443     0    0.066   0.239    38.748    0.000    0.000
LGA    V   105_A      V   105_A    33.547     0    0.066   0.084    35.994    0.000    0.000
LGA    I   106_A      I   106_A    34.239     0    0.447   1.287    37.888    0.000    0.000
LGA    R   107_A      R   107_A    41.188     0    0.073   1.437    46.398    0.000    0.000
LGA    A   108_A      A   108_A    43.568     0    0.133   0.132    45.432    0.000    0.000
LGA    D   109_A      D   109_A    40.911     0    0.281   1.311    41.871    0.000    0.000
LGA    P   110_A      P   110_A    40.502     0    0.064   0.153    44.577    0.000    0.000
LGA    E   111_A      E   111_A    38.530     0    0.038   1.213    40.431    0.000    0.000
LGA    A   112_A      A   112_A    34.221     0    0.032   0.035    36.110    0.000    0.000
LGA    I   113_A      I   113_A    33.454     0    0.033   1.304    36.746    0.000    0.000
LGA    A   114_A      A   114_A    34.254     0    0.031   0.043    35.708    0.000    0.000
LGA    K   115_A      K   115_A    30.339     0    0.045   0.972    33.195    0.000    0.000
LGA    L   116_A      L   116_A    28.086     0    0.055   0.791    29.244    0.000    0.000
LGA    L   117_A      L   117_A    29.250     0    0.193   1.058    30.193    0.000    0.000
LGA    N   118_A      N   118_A    29.047     0    0.452   0.821    30.980    0.000    0.000
LGA    I   119_A      I   119_A    30.051     0    0.600   0.810    32.228    0.000    0.000
LGA    S   120_A      S   120_A    36.709     0    0.588   0.720    40.374    0.000    0.000
LGA    K   121_A      K   121_A    37.357     0    0.038   0.970    43.582    0.000    0.000
LGA    E   122_A      E   122_A    35.901     0    0.046   1.364    37.857    0.000    0.000
LGA    D   123_A      D   123_A    34.409     0    0.048   1.097    37.463    0.000    0.000
LGA    V   124_A      V   124_A    35.145     0    0.048   0.081    35.860    0.000    0.000
LGA    Q   125_A      Q   125_A    36.658     0    0.061   1.066    40.177    0.000    0.000
LGA    G   126_A      G   126_A    35.033     0    0.049   0.049    35.523    0.000    0.000
LGA    L   127_A      L   127_A    34.207     0    0.118   1.052    36.042    0.000    0.000
LGA    A   128_A      A   128_A    37.291     0    0.047   0.052    39.404    0.000    0.000
LGA    R   129_A      R   129_A    39.423     0    0.045   0.934    44.187    0.000    0.000
LGA    A   130_A      A   130_A    38.059     0    0.565   0.562    39.659    0.000    0.000
LGA    G   131_A      G   131_A    37.489     0    0.585   0.585    38.603    0.000    0.000
LGA    E   132_A      E   132_A    42.296     0    0.042   0.146    45.096    0.000    0.000
LGA    A   133_A      A   133_A    43.960     0    0.065   0.063    44.557    0.000    0.000
LGA    A   134_A      A   134_A    37.958     0    0.029   0.051    39.834    0.000    0.000
LGA    I   135_A      I   135_A    38.829     0    0.026   1.367    40.911    0.000    0.000
LGA    E   136_A      E   136_A    44.971     0    0.029   0.791    51.674    0.000    0.000
LGA    R   137_A      R   137_A    42.167     0    0.253   1.685    43.120    0.000    0.000
LGA    G   138_A      G   138_A    37.508     0    0.270   0.270    39.129    0.000    0.000
LGA    E   139_A      E   139_A    38.131     0    0.172   0.968    44.755    0.000    0.000
LGA    G   140_A      G   140_A    36.381     0    0.598   0.598    37.143    0.000    0.000
LGA    A   141_A      A   141_A    33.477     0    0.077   0.076    33.973    0.000    0.000
LGA    S   142_A      S   142_A    30.586     0    0.031   0.705    32.190    0.000    0.000
LGA    L   143_A      L   143_A    35.414     0    0.058   1.191    39.071    0.000    0.000
LGA    G   144_A      G   144_A    38.032     0    0.033   0.033    38.032    0.000    0.000
LGA    V   145_A      V   145_A    33.845     0    0.027   0.113    34.938    0.000    0.000
LGA    L   146_A      L   146_A    32.934     0    0.051   1.143    34.952    0.000    0.000
LGA    R   147_A      R   147_A    38.495     0    0.036   1.372    42.635    0.000    0.000
LGA    E   148_A      E   148_A    39.138     0    0.042   1.154    45.464    0.000    0.000
LGA    L   149_A      L   149_A    34.773     0    0.038   0.763    36.039    0.000    0.000
LGA    R   150_A      R   150_A    37.058     0    0.053   1.327    39.348    0.000    0.000
LGA    K   151_A      K   151_A    42.110     0    0.029   0.640    46.156    0.000    0.000
LGA    I   152_A      I   152_A    40.184     0    0.032   0.676    40.393    0.000    0.000
LGA    E   153_A      E   153_A    37.303     0    0.107   0.815    38.983    0.000    0.000
LGA    K   154_A      K   154_A    42.262     0    0.090   1.062    44.179    0.000    0.000
LGA    K   155_A      K   155_A    45.438     0    0.214   1.449    50.432    0.000    0.000
LGA    R   156_A      R   156_A    41.039     0    0.041   0.797    42.913    0.000    0.000
LGA    N   157_A      N   157_A    42.590     0    0.519   1.331    45.045    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):    15.815         15.723                 16.701           14.727   12.335

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  158  157    4.0     30    2.33    20.541    18.090     1.234

LGA_LOCAL      RMSD:   2.332  Number of atoms:   30  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  25.279  Number of assigned atoms:  157 
Std_ASGN_ATOMS RMSD:  15.815  Standard rmsd on all 157 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.094600 * X  +   0.203700 * Y  +  -0.974452 * Z  +  13.733453
  Y_new =  -0.446926 * X  +  -0.865966 * Y  +  -0.224410 * Z  +   5.362921
  Z_new =  -0.889555 * X  +   0.456737 * Y  +   0.009119 * Z  +  -3.940402 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -1.362208  1.096370  1.550834   [DEG:  -78.0488   62.8174   88.8562 ]
ZXZ: -1.344450  1.561677 -1.096451   [DEG:  -77.0313   89.4775  -62.8220 ]
 
# END of job
