
#######################################################
#                                                     #
#                        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  151 ( 1270),  selected  151 , name one
# Molecule2: number of CA atoms  173 ( 1441),  selected  151 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:B  -ch2:A  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    60      12_A - 71_A        4.15    12.24
  LCS_AVERAGE:     26.91

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    38      30_A - 67_A        1.94    12.99
  LCS_AVERAGE:     11.39

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    22      44_A - 65_A        0.99    14.30
  LONGEST_CONTINUOUS_SEGMENT:    22      45_A - 66_A        0.99    14.28
  LCS_AVERAGE:      6.81

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  151
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     G    12_B     G    12_A      3   11   60      0   14   26   34   52   67   73   78   81   86   90   94   97  101  105  107  110  114  116  118 
LCS_GDT     D    13_B     D    13_A      7   11   60      7   18   31   50   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     R    14_B     R    14_A      7   11   60     11   24   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     A    15_B     A    15_A      7   11   60     11   24   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     I    16_B     I    16_A      7   11   60     12   24   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     K    17_B     K    17_A      7   11   60     12   24   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     Q    18_B     Q    18_A      7   11   60     12   24   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     F    19_B     F    19_A      7   11   60      3   23   35   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     F    20_B     F    20_A      5   11   60      4    4   14   36   60   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     P    21_B     P    21_A      4   11   60      4    4   27   45   61   68   72   78   81   86   90   93   96  101  104  107  109  113  116  118 
LCS_GDT     A    22_B     A    22_A      4   11   60      4    4   34   49   61   68   73   78   81   86   90   93   97  101  105  107  110  114  116  118 
LCS_GDT     Y    23_B     Y    23_A      4   11   60      4    5   16   48   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     R    24_B     R    24_A      4    5   60      3    4    4   26   31   50   63   73   78   83   86   92   95  101  104  107  111  114  116  118 
LCS_GDT     Y    25_B     Y    25_A      4   36   60      3   17   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     N    26_B     N    26_A     18   36   60      8   15   19   32   43   66   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     F    27_B     F    27_A     18   36   60      8   15   19   32   53   66   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     W    28_B     W    28_A     18   36   60      8   15   19   32   53   66   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     K    29_B     K    29_A     18   36   60      8   15   19   32   41   66   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     E    30_B     E    30_A     18   38   60      8   15   19   32   53   66   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     A    31_B     A    31_A     18   38   60      8   15   26   49   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     G    32_B     G    32_A     18   38   60      8   15   19   44   60   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     F    33_B     F    33_A     18   38   60      7   15   23   49   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     L    34_B     L    34_A     18   38   60      8   15   26   50   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     S    35_B     S    35_A     18   38   60      8   16   31   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     L    36_B     L    36_A     18   38   60      7   16   35   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     L    37_B     L    37_A     18   38   60      7   15   29   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     Q    38_B     Q    38_A     18   38   60      7   15   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     E    39_B     E    39_A     18   38   60      7   15   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     F    40_B     F    40_A     18   38   60      5   15   27   41   60   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     D    41_B     D    41_A     18   38   60      4   13   28   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     F    42_B     F    42_A     18   38   60      4   15   28   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     V    43_B     V    43_A     18   38   60      4   24   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     P    44_B     P    44_A     22   38   60      4   24   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     R    45_B     R    45_A     22   38   60     12   24   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     L    46_B     L    46_A     22   38   60     12   24   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     Y    47_B     Y    47_A     22   38   60     12   24   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     S    48_B     S    48_A     22   38   60     12   24   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     I    49_B     I    49_A     22   38   60      7   23   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     N    50_B     N    50_A     22   38   60      7   23   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     P    51_B     P    51_A     22   38   60      5   23   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     E    52_B     E    52_A     22   38   60      5   23   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     K    53_B     K    53_A     22   38   60      5   23   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     L    54_B     L    54_A     22   38   60      5   23   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     E    55_B     E    55_A     22   38   60     11   24   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     I    56_B     I    56_A     22   38   60     12   24   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     E    57_B     E    57_A     22   38   60     12   24   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     M    58_B     M    58_A     22   38   60     11   24   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     E    59_B     E    59_A     22   38   60      9   23   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     F    60_B     F    60_A     22   38   60      7   21   31   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     I    61_B     I    61_A     22   38   60      7   16   22   39   57   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     E    62_B     E    62_A     22   38   60      7   23   33   50   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     G    63_B     G    63_A     22   38   60      5   23   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     R    64_B     R    64_A     22   38   60      9   19   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     P    65_B     P    65_A     22   38   60      9   16   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     I    66_B     I    66_A     22   38   60      5   18   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     K    67_B     K    67_A      8   38   60      3    4   29   50   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     D    68_B     D    68_A      4   26   60      3    4    5    5    7   14   45   62   79   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     V    69_B     V    69_A      3    5   60      3    4    4    5    9   10   20   33   40   54   69   84   92   97  102  105  111  114  116  118 
LCS_GDT     I    70_B     I    70_A      3    5   60      3    3    3    8   12   18   22   26   32   37   41   61   70   73   89  101  110  114  116  118 
LCS_GDT     N    71_B     N    71_A      5    6   60      4    4    7   12   15   21   25   27   30   34   37   39   44   54   59   69   75   85   90  104 
LCS_GDT     E    72_B     E    72_A      5    6   19      4    4    5    8   11   21   23   27   29   31   33   36   39   40   43   44   46   52   58   62 
LCS_GDT     L    73_B     L    73_A      5    6   19      4    4    5    8   19   21   24   26   29   31   31   34   36   40   41   42   44   45   46   50 
LCS_GDT     N    74_B     N    74_A      5    6   19      4    4   14   15   16   19   22   22   25   29   30   34   35   38   39   40   42   44   45   48 
LCS_GDT     S    75_B     S    75_A      5    6   19      3    4    5    8    9   10   11   19   20   22   24   28   30   36   37   40   42   44   45   48 
LCS_GDT     E    76_B     E    76_A      5    6   19      3    4    5    8    9   10   11   12   20   22   24   28   30   36   37   40   42   44   45   48 
LCS_GDT     T    77_B     T    77_A      3    4   19      3    3    3    3    6    6    9   10   13   15   18   25   27   36   36   40   42   43   45   48 
LCS_GDT     I    78_B     I    78_A      3    4   19      3    3    3    4    5    8   11   13   15   17   19   21   25   27   28   30   34   38   44   46 
LCS_GDT     G    79_B     G    79_A      3    4   19      3    3    3    3    5    6    9   12   14   17   19   21   25   27   28   30   34   38   39   42 
LCS_GDT     R    80_B     R    80_A      3    4   19      3    3    3    4    5    6    8   11   13   15   18   21   22   25   28   30   34   38   39   44 
LCS_GDT     I    81_B     I    81_A      3    4   19      3    3    3    4    5    6    9   11   13   15   17   20   22   24   27   29   30   35   39   42 
LCS_GDT     L    82_B     L    82_A      6    7   19      6    6    6    6    7    7    9   10   12   15   16   19   21   24   26   30   32   33   34   41 
LCS_GDT     D    83_B     D    83_A      6    7   19      6    6    6    6    7    7    7    9   11   15   16   20   21   24   26   30   32   38   39   42 
LCS_GDT     I    84_B     I    84_A      6    7   19      6    6    6    6    7    7    8   10   13   16   18   22   23   27   28   30   33   38   39   42 
LCS_GDT     C    85_B     C    85_A      6    7   19      6    6    6    8    9   10   11   12   15   16   18   22   26   29   31   32   35   43   44   46 
LCS_GDT     R    86_B     R    86_A      6    7   19      6    6    6    7    7    7    9   11   13   15   18   21   26   27   28   30   34   38   39   47 
LCS_GDT     K    87_B     K    87_A      6    7   19      6    6    6    8    9   10   11   12   15   17   19   22   26   29   31   32   35   38   39   42 
LCS_GDT     L    88_B     L    88_A      3    7   19      0    3    3    6    7    8   11   13   16   18   23   24   30   33   37   40   42   43   45   48 
LCS_GDT     D    89_B     D    89_A      3    5   19      3    3    3    5    6    7   11   13   16   18   20   24   30   32   35   40   42   43   44   48 
LCS_GDT     V    90_B     V    90_A      4    5   19      3    4    4    5    7   10   13   17   18   19   24   26   30   33   37   40   42   47   54   63 
LCS_GDT     L    91_B     L    91_A      4    7   19      3    4    4    6   10   11   13   17   18   23   29   31   32   36   37   40   42   46   50   57 
LCS_GDT     G    92_B     G    92_A      4    7   19      3    4    5    8   10   14   19   26   29   30   33   35   39   40   45   58   70   78   87  101 
LCS_GDT     I    93_B     I    93_A      4    7   19      3    4    9   13   19   21   25   27   29   34   36   38   39   40   49   58   73   81   99  107 
LCS_GDT     Q    94_B     Q    94_A      4    7   19      3   10   15   17   18   21   24   27   29   34   36   38   40   50   58   77   92  104  108  115 
LCS_GDT     K    95_B     K    95_A      4    7   19      0    4    5    8   10   11   13   26   28   29   31   35   40   42   48   51   65   84  108  113 
LCS_GDT     E    96_B     E    96_A      3    7   27      1    3    5    8   10   11   20   20   23   29   39   47   50   80   84   91   95  104  108  113 
LCS_GDT     E    97_B     E    97_A      3    7   27      0    3    5    8   10   13   17   21   21   27   39   45   61   73   79   83   88   92  102  110 
LCS_GDT     M    98_B     M    98_A      3    6   46      1    3    3    4    6   16   26   29   39   51   59   70   74   81   86   89   94   99  104  113 
LCS_GDT     N    99_B     N    99_A      3    6   46      3    3    5    8   10   15   21   29   43   56   62   74   82   84   88   90   98  104  110  115 
LCS_GDT     H   100_B     H   100_A      3    5   46      3    3    5    5    8   12   19   29   36   51   62   74   82   84   88   93  101  112  114  117 
LCS_GDT     P   101_B     P   101_A      3    5   47      3    3    5    7   10   18   22   39   49   62   72   86   92   97  102  107  110  114  116  118 
LCS_GDT     D   102_B     D   102_A      3    5   47      3    3    5    6   10   13   18   27   36   63   72   86   92   98  102  107  111  114  116  118 
LCS_GDT     R   103_B     R   103_A      3   19   47      0    3    9   32   39   55   62   73   79   86   89   93   97  101  105  107  111  114  116  118 
LCS_GDT     H   104_B     H   104_A     12   19   47      4   24   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     I   105_B     I   105_A     16   19   47      9   24   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     I   106_B     I   106_A     16   19   47      9   24   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     I   107_B     I   107_A     16   19   47      6   16   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     S   108_B     S   108_A     16   19   47      6   12   26   37   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     D   109_B     D   109_A     16   19   47      6   14   31   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     R   110_B     R   110_A     16   19   47      6   24   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     I   111_B     I   111_A     16   19   47     12   24   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     V   112_B     V   112_A     16   19   47     12   24   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     F   113_B     F   113_A     16   19   47     12   24   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     I   114_B     I   114_A     16   19   47      9   24   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     D   115_B     D   115_A     16   19   47      9   16   35   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     F   116_B     F   116_A     16   19   47      9   24   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     E   117_B     E   117_A     16   19   47      9   24   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     R   118_B     R   118_A     16   19   47      5   16   34   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     G   119_B     G   119_A     16   19   47      5   24   36   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     V   120_B     V   120_A     16   19   47      8   19   33   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     I   121_B     I   121_A     13   19   47      5   14   32   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     K   122_B     K   122_A      5   19   47      3    8   15   25   42   56   65   77   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     C   123_B     C   123_A      5    7   47      3    6    7    8   10   11   14   16   53   58   70   80   92  101  103  104  107  111  115  117 
LCS_GDT     R   124_B     R   124_A      5   14   47      3    6    7    8   10   11   42   50   61   77   87   92   97  101  103  106  110  114  116  118 
LCS_GDT     P   125_B     P   125_A      5   16   47      3    5    6   11   24   45   58   73   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     S   126_B     S   126_A     14   16   47      3    5   19   31   46   61   70   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     N   127_B     N   127_A     14   16   47      3   10   12   22   46   59   70   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     L   128_B     L   128_A     14   16   47      6   11   12   17   24   45   58   69   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     T   129_B     T   129_A     14   16   47      6   11   12   19   31   45   59   73   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     Q   130_B     Q   130_A     14   16   47      6   11   12   26   49   65   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     F   131_B     F   131_A     14   16   47      6   12   21   37   52   64   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     A   132_B     A   132_A     14   16   47      6   11   14   19   27   45   58   73   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     V   133_B     V   133_A     14   16   47      5   11   12   14   14   30   45   64   77   85   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     Y   134_B     Y   134_A     14   16   47      5   11   12   15   44   65   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     L   135_B     L   135_A     14   16   47      5   13   19   26   42   55   70   77   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     N   136_B     N   136_A     14   16   47      6   11   12   14   19   27   46   60   76   85   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     S   137_B     S   137_A     14   16   47      5   11   12   14   14   15   21   54   62   72   85   94   97  101  105  107  111  114  116  118 
LCS_GDT     R   138_B     R   138_A     14   16   47      5   11   12   14   30   45   61   77   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     L   139_B     L   139_A     14   18   47      4    8   12   16   26   31   48   60   76   85   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     R   140_B     R   140_A      3   18   47      3    3    7   14   19   34   46   54   66   83   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     L   141_B     L   141_A      3   18   47      3    3    5   14   19   21   25   27   52   61   83   92   97  101  105  107  111  114  116  118 
LCS_GDT     M   142_B     M   142_A     14   18   47      4   12   15   17   19   21   25   27   39   59   80   92   97  101  105  107  111  114  116  118 
LCS_GDT     K   143_B     K   143_A     14   18   47     10   13   15   17   19   31   42   50   74   82   88   94   97  101  105  107  111  114  116  118 
LCS_GDT     N   144_B     N   144_A     14   18   47     10   13   23   51   61   68   73   78   80   86   90   93   97  101  105  107  111  114  116  118 
LCS_GDT     E   145_B     E   145_A     14   18   47     10   13   15   17   19   21   25   70   80   82   84   87   90   93  105  107  111  114  116  118 
LCS_GDT     E   146_B     E   146_A     14   18   47     10   13   15   17   19   21   25   27   34   37   44   66   95  101  105  107  111  114  116  118 
LCS_GDT     L   147_B     L   147_A     14   18   47      9   13   15   17   22   62   73   77   80   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     K   148_B     K   148_A     14   18   46     10   13   27   37   56   64   71   77   80   83   85   88   95  101  105  107  111  114  116  118 
LCS_GDT     K   149_B     K   149_A     14   18   39     10   13   15   17   19   21   25   27   32   37   62   78   89   91  100  105  111  114  116  118 
LCS_GDT     L   150_B     L   150_A     14   18   39     10   13   15   17   19   21   25   27   34   54   70   87   95  101  105  107  111  114  116  118 
LCS_GDT     L   151_B     L   151_A     14   18   39     10   13   15   41   58   67   73   77   80   83   88   92   97  101  105  107  111  114  116  118 
LCS_GDT     R   152_B     R   152_A     14   18   39     10   13   15   17   25   27   36   52   66   77   83   85   89   93  100  103  111  114  116  118 
LCS_GDT     E   153_B     E   153_A     14   18   39     10   13   15   17   19   21   25   27   34   37   39   68   75   93  100  103  111  114  116  118 
LCS_GDT     Y   154_B     Y   154_A     14   18   39      9   13   15   17   19   21   26   37   80   83   85   91   96  101  105  107  111  114  116  118 
LCS_GDT     K   155_B     K   155_A     14   18   39      4   13   15   31   42   56   70   75   80   83   85   89   95  101  105  107  111  114  116  118 
LCS_GDT     K   156_B     K   156_A      3   18   39      3    3    5   13   19   36   47   65   78   83   84   89   92   99  105  107  111  114  116  118 
LCS_GDT     G   157_B     G   157_A      3   16   39      3   10   36   51   63   68   73   78   80   86   88   94   97  101  105  107  111  114  116  118 
LCS_GDT     F   158_B     F   158_A      3    5   39      3   24   35   51   63   68   73   78   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     D   159_B     D   159_A      3    5   39      3    3    4    6   10   14   47   73   81   86   90   94   97  101  105  107  111  114  116  118 
LCS_GDT     D   160_B     D   160_A      3    5   37      3    6    8   15   27   34   42   52   67   83   87   93   97  101  103  106  110  113  116  118 
LCS_GDT     E   161_B     E   161_A      3    5   37      1    3    3    6    6    7    8    9   61   69   75   86   95  100  103  105  108  110  113  117 
LCS_GDT     S   162_B     S   162_A      3    3   25      0    3    3   10   14   32   34   50   61   69   81   91   95  101  103  105  108  110  113  117 
LCS_AVERAGE  LCS_A:  15.04  (   6.81   11.39   26.91 )

GLOBAL_DISTANCE_TEST (summary information about detected largest sets of residues (represented by selected AToms) that can fit under specified thresholds)
GDT DIST_CUTOFF  0.50   1.00   1.50   2.00   2.50   3.00   3.50   4.00   4.50   5.00   5.50   6.00   6.50   7.00   7.50   8.00   8.50   9.00   9.50  10.00
GDT NUMBER_AT     12     24     36     51     63     68     73     78     81     86     90     94     97    101    105    107    111    114    116    118 
GDT PERCENT_AT   6.94  13.87  20.81  29.48  36.42  39.31  42.20  45.09  46.82  49.71  52.02  54.34  56.07  58.38  60.69  61.85  64.16  65.90  67.05  68.21
GDT RMS_LOCAL    0.35   0.69   1.11   1.38   1.65   1.77   1.96   2.19   2.45   2.64   3.13   3.34   3.47   3.67   4.01   4.05   4.62   4.69   4.77   4.95
GDT RMS_ALL_AT  13.23  13.17  13.41  13.25  13.09  13.10  13.02  12.90  12.62  12.62  12.10  12.15  12.22  12.15  12.38  12.43  12.60  12.58  12.55  12.47

# Checking swapping
#   possible swapping detected:  F    20_B      F    20_A
#   possible swapping detected:  E    39_B      E    39_A
#   possible swapping detected:  E    55_B      E    55_A
#   possible swapping detected:  E    72_B      E    72_A
#   possible swapping detected:  E    76_B      E    76_A
#   possible swapping detected:  D    83_B      D    83_A
#   possible swapping detected:  D    89_B      D    89_A
#   possible swapping detected:  D   102_B      D   102_A
#   possible swapping detected:  F   113_B      F   113_A
#   possible swapping detected:  E   117_B      E   117_A
#   possible swapping detected:  E   153_B      E   153_A
#   possible swapping detected:  F   158_B      F   158_A
#   possible swapping detected:  D   159_B      D   159_A
#   possible swapping detected:  D   160_B      D   160_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    G    12_B      G    12_A     3.446     0    0.317   0.317     5.243   42.619   42.619
LGA    D    13_B      D    13_A     2.543     0    0.626   1.238     6.736   67.024   44.940
LGA    R    14_B      R    14_A     1.510     0    0.042   1.271     5.084   77.143   63.766
LGA    A    15_B      A    15_A     1.346     0    0.023   0.021     1.528   81.429   79.714
LGA    I    16_B      I    16_A     1.775     0    0.094   0.107     2.329   70.833   70.833
LGA    K    17_B      K    17_A     1.697     0    0.032   0.119     2.116   72.857   70.159
LGA    Q    18_B      Q    18_A     1.651     0    0.086   0.449     3.247   72.857   66.825
LGA    F    19_B      F    19_A     2.396     0    0.624   1.186     4.384   55.952   64.892
LGA    F    20_B      F    20_A     2.533     0    0.649   1.252     8.256   77.857   38.485
LGA    P    21_B      P    21_A     3.581     0    0.090   0.098     5.285   43.810   37.823
LGA    A    22_B      A    22_A     3.111     0    0.033   0.064     3.734   59.405   56.190
LGA    Y    23_B      Y    23_A     2.218     0    0.118   0.193    10.341   60.119   27.579
LGA    R    24_B      R    24_A     5.556     0    0.051   1.116    16.652   30.000   11.558
LGA    Y    25_B      Y    25_A     2.644     0    0.554   1.576    11.287   63.690   28.810
LGA    N    26_B      N    26_A     4.190     0    0.611   1.397     9.129   44.048   24.643
LGA    F    27_B      F    27_A     3.450     0    0.034   1.477     7.424   46.786   38.225
LGA    W    28_B      W    28_A     3.482     0    0.056   1.270     8.495   46.667   26.156
LGA    K    29_B      K    29_A     4.058     0    0.077   1.095     4.314   40.238   50.106
LGA    E    30_B      E    30_A     3.490     0    0.074   0.685     7.886   53.810   35.291
LGA    A    31_B      A    31_A     2.207     0    0.016   0.028     2.678   64.881   64.857
LGA    G    32_B      G    32_A     2.468     0    0.052   0.052     2.580   64.881   64.881
LGA    F    33_B      F    33_A     2.041     0    0.040   0.225     2.322   68.810   68.442
LGA    L    34_B      L    34_A     1.773     0    0.034   0.107     2.261   77.143   71.964
LGA    S    35_B      S    35_A     1.420     0    0.031   0.611     3.088   79.286   73.333
LGA    L    36_B      L    36_A     1.163     0    0.089   1.357     3.361   81.429   71.488
LGA    L    37_B      L    37_A     1.832     0    0.015   0.079     2.515   72.976   67.917
LGA    Q    38_B      Q    38_A     1.854     0    0.106   1.148     3.147   66.905   66.772
LGA    E    39_B      E    39_A     1.921     0    0.073   1.179     4.100   66.905   70.106
LGA    F    40_B      F    40_A     3.091     0    0.680   0.651     4.946   47.143   46.753
LGA    D    41_B      D    41_A     2.252     0    0.065   1.225     3.939   64.762   59.286
LGA    F    42_B      F    42_A     1.949     0    0.242   1.144     4.133   77.381   63.550
LGA    V    43_B      V    43_A     0.846     0    0.019   0.090     1.808   88.214   84.082
LGA    P    44_B      P    44_A     1.425     0    0.077   0.328     2.316   81.429   79.048
LGA    R    45_B      R    45_A     1.336     0    0.086   1.487     6.542   77.143   57.965
LGA    L    46_B      L    46_A     1.636     0    0.040   0.190     1.943   72.857   72.857
LGA    Y    47_B      Y    47_A     1.240     0    0.012   0.340     1.862   81.429   80.040
LGA    S    48_B      S    48_A     1.697     0    0.091   0.563     2.058   72.857   72.937
LGA    I    49_B      I    49_A     2.253     0    0.165   1.063     5.794   62.857   56.488
LGA    N    50_B      N    50_A     2.045     0    0.159   0.223     2.735   62.857   64.821
LGA    P    51_B      P    51_A     1.791     0    0.048   0.300     2.060   70.833   75.442
LGA    E    52_B      E    52_A     1.835     3    0.060   0.700     2.284   70.833   46.772
LGA    K    53_B      K    53_A     2.108     0    0.033   0.920     8.212   70.833   50.847
LGA    L    54_B      L    54_A     1.641     0    0.098   0.943     2.937   77.143   71.012
LGA    E    55_B      E    55_A     1.410     0    0.070   0.310     2.422   77.143   74.868
LGA    I    56_B      I    56_A     1.734     0    0.021   1.069     3.964   72.857   61.786
LGA    E    57_B      E    57_A     1.467     0    0.085   0.349     1.614   77.143   82.540
LGA    M    58_B      M    58_A     1.590     0    0.017   0.699     2.038   79.286   80.655
LGA    E    59_B      E    59_A     1.590     0    0.065   0.645     2.193   70.833   78.783
LGA    F    60_B      F    60_A     2.308     0    0.047   0.229     3.722   62.976   58.095
LGA    I    61_B      I    61_A     3.398     0    0.048   0.208     5.249   57.262   45.893
LGA    E    62_B      E    62_A     2.664     0    0.036   0.629     5.548   57.262   44.127
LGA    G    63_B      G    63_A     1.868     0    0.091   0.091     2.150   68.810   68.810
LGA    R    64_B      R    64_A     1.241     0    0.063   1.120     6.030   81.429   67.143
LGA    P    65_B      P    65_A     1.637     0    0.336   0.318     2.117   72.976   70.612
LGA    I    66_B      I    66_A     2.227     0    0.623   1.323     8.222   63.095   42.738
LGA    K    67_B      K    67_A     2.131     0    0.196   0.876    13.289   53.452   29.947
LGA    D    68_B      D    68_A     6.746     0    0.645   1.192     9.000   14.524   13.631
LGA    V    69_B      V    69_A    12.097     0    0.550   0.896    15.385    0.119    0.068
LGA    I    70_B      I    70_A    14.960     0    0.196   1.299    19.537    0.000    0.000
LGA    N    71_B      N    71_A    19.765     0    0.613   1.111    22.515    0.000    0.000
LGA    E    72_B      E    72_A    25.114     0    0.113   1.139    28.209    0.000    0.000
LGA    L    73_B      L    73_A    25.813     0    0.030   0.146    26.477    0.000    0.000
LGA    N    74_B      N    74_A    28.519     0    0.112   0.416    32.769    0.000    0.000
LGA    S    75_B      S    75_A    29.359     0    0.581   0.679    30.509    0.000    0.000
LGA    E    76_B      E    76_A    33.742     0    0.541   0.975    38.962    0.000    0.000
LGA    T    77_B      T    77_A    34.388     0    0.594   0.553    36.567    0.000    0.000
LGA    I    78_B      I    78_A    32.634     0    0.291   1.595    34.035    0.000    0.000
LGA    G    79_B      G    79_A    37.416     0    0.225   0.225    38.298    0.000    0.000
LGA    R    80_B      R    80_A    37.752     0    0.342   1.154    45.578    0.000    0.000
LGA    I    81_B      I    81_A    34.804     0    0.117   1.287    35.605    0.000    0.000
LGA    L    82_B      L    82_A    33.976     0    0.610   0.536    34.803    0.000    0.000
LGA    D    83_B      D    83_A    37.888     0    0.045   0.982    43.835    0.000    0.000
LGA    I    84_B      I    84_A    34.438     0    0.024   0.073    38.454    0.000    0.000
LGA    C    85_B      C    85_A    27.327     0    0.036   0.783    29.991    0.000    0.000
LGA    R    86_B      R    86_A    29.769     0    0.159   1.620    36.804    0.000    0.000
LGA    K    87_B      K    87_A    32.001     0    0.551   1.398    40.683    0.000    0.000
LGA    L    88_B      L    88_A    27.318     0    0.611   0.620    29.233    0.000    0.000
LGA    D    89_B      D    89_A    23.677     0    0.600   0.689    24.734    0.000    0.000
LGA    V    90_B      V    90_A    24.458     0    0.565   0.659    27.519    0.000    0.000
LGA    L    91_B      L    91_A    22.915     0    0.037   0.101    27.678    0.000    0.000
LGA    G    92_B      G    92_A    16.970     0    0.653   0.653    19.121    0.000    0.000
LGA    I    93_B      I    93_A    14.531     0    0.017   0.131    17.736    0.000    0.000
LGA    Q    94_B      Q    94_A    11.701     0    0.139   0.688    13.589    0.000    0.000
LGA    K    95_B      K    95_A    13.275     0    0.654   0.902    19.723    0.000    0.000
LGA    E    96_B      E    96_A    12.222     0    0.216   1.183    15.039    0.000    0.000
LGA    E    97_B      E    97_A    14.389     0    0.625   1.155    19.374    0.000    0.000
LGA    M    98_B      M    98_A    12.015     0    0.570   1.183    13.957    0.000    0.000
LGA    N    99_B      N    99_A    11.626     0    0.687   1.176    14.414    0.000    0.179
LGA    H   100_B      H   100_A    10.785     0    0.421   1.455    13.018    0.476    0.190
LGA    P   101_B      P   101_A     9.669     0    0.127   0.593    13.083    0.238    0.136
LGA    D   102_B      D   102_A     9.646     0    0.438   0.808    10.545    1.310    0.655
LGA    R   103_B      R   103_A     6.037     0    0.506   1.514    11.163   24.762   14.242
LGA    H   104_B      H   104_A     0.902     0    0.577   0.586     2.890   82.143   80.905
LGA    I   105_B      I   105_A     0.715     0    0.042   0.099     1.334   88.214   87.083
LGA    I   106_B      I   106_A     0.464     0    0.098   1.159     2.576   97.619   84.464
LGA    I   107_B      I   107_A     1.294     0    0.024   0.073     2.306   77.381   73.095
LGA    S   108_B      S   108_A     2.501     0    0.477   0.566     5.086   51.548   53.413
LGA    D   109_B      D   109_A     1.583     0    0.208   1.052     2.076   81.667   76.310
LGA    R   110_B      R   110_A     0.501     0    0.037   0.982     9.280   92.857   54.199
LGA    I   111_B      I   111_A     0.856     0    0.058   0.093     1.849   88.214   82.679
LGA    V   112_B      V   112_A     0.765     0    0.027   0.049     0.919   90.476   90.476
LGA    F   113_B      F   113_A     0.853     0    0.043   0.472     2.575   88.214   81.039
LGA    I   114_B      I   114_A     0.558     0    0.072   0.165     1.091   92.857   91.726
LGA    D   115_B      D   115_A     1.324     0    0.099   0.796     5.078   83.690   65.060
LGA    F   116_B      F   116_A     0.838     0    0.019   0.407     1.255   90.476   91.429
LGA    E   117_B      E   117_A     1.051     0    0.055   1.001     4.756   83.690   62.910
LGA    R   118_B      R   118_A     1.139     0    0.046   1.149     4.776   81.429   67.576
LGA    G   119_B      G   119_A     1.011     0    0.344   0.344     2.159   79.524   79.524
LGA    V   120_B      V   120_A     1.370     0    0.282   1.090     5.395   67.738   59.864
LGA    I   121_B      I   121_A     2.733     0    0.648   1.135     4.292   62.976   54.940
LGA    K   122_B      K   122_A     5.848     0    0.660   0.658    11.748   14.524    9.365
LGA    C   123_B      C   123_A    11.620     0    0.089   0.085    14.006    0.357    0.238
LGA    R   124_B      R   124_A     9.991     0    0.031   1.535    20.403    6.190    2.251
LGA    P   125_B      P   125_A     7.199     0    0.666   0.615    10.658    9.524    5.510
LGA    S   126_B      S   126_A     5.099     0    0.533   0.797     5.494   26.190   31.032
LGA    N   127_B      N   127_A     5.014     0    0.192   0.664     5.702   28.810   28.929
LGA    L   128_B      L   128_A     7.724     0    0.077   0.270    12.244    9.405    4.881
LGA    T   129_B      T   129_A     7.584     0    0.064   1.074    10.629   11.905    8.503
LGA    Q   130_B      Q   130_A     3.776     0    0.014   1.539     5.458   45.119   43.810
LGA    F   131_B      F   131_A     4.248     0    0.070   0.309    10.827   33.214   15.844
LGA    A   132_B      A   132_A     8.122     0    0.040   0.040     9.662    7.024    5.714
LGA    V   133_B      V   133_A     7.664     0    0.019   0.048     9.446   10.119    7.415
LGA    Y   134_B      Y   134_A     4.075     0    0.013   1.306     5.087   35.714   39.524
LGA    L   135_B      L   135_A     6.328     0    0.060   0.827    11.763   15.119    8.512
LGA    N   136_B      N   136_A     9.931     0    0.014   0.734    12.313    1.429    0.714
LGA    S   137_B      S   137_A     8.959     0    0.139   0.491     9.275    2.976    3.254
LGA    R   138_B      R   138_A     6.094     0    0.168   1.342     7.756   13.452   26.667
LGA    L   139_B      L   139_A    10.512     0    0.634   0.495    15.640    0.714    0.357
LGA    R   140_B      R   140_A    10.180     0    0.198   1.105    12.144    0.000    0.000
LGA    L   141_B      L   141_A    10.822     0    0.318   0.309    13.091    0.000    0.000
LGA    M   142_B      M   142_A    10.399     0    0.255   1.117    11.692    1.548    1.488
LGA    K   143_B      K   143_A     7.781     4    0.083   0.102     9.167   10.119    4.656
LGA    N   144_B      N   144_A     3.969     3    0.024   0.026     5.687   30.595   20.714
LGA    E   145_B      E   145_A     9.464     4    0.043   0.051    11.416    2.262    1.005
LGA    E   146_B      E   146_A    10.441     4    0.035   0.037    11.326    1.190    0.529
LGA    L   147_B      L   147_A     5.403     0    0.067   0.747     7.016   22.143   35.000
LGA    K   148_B      K   148_A     6.970     0    0.022   0.830    11.476   10.119    5.608
LGA    K   149_B      K   149_A    11.372     0    0.036   0.832    20.273    0.119    0.053
LGA    L   150_B      L   150_A     9.246     0    0.014   0.820    12.204    3.452    2.083
LGA    L   151_B      L   151_A     5.229     0    0.039   0.169     6.855   17.500   39.762
LGA    R   152_B      R   152_A    10.432     0    0.017   0.882    17.106    0.714    0.260
LGA    E   153_B      E   153_A    11.890     0    0.033   1.387    18.481    0.000    0.000
LGA    Y   154_B      Y   154_A     7.478     0    0.046   0.194     8.780    9.881   26.508
LGA    K   155_B      K   155_A     7.199     0    0.599   0.841    10.996    6.190    4.815
LGA    K   156_B      K   156_A     8.392     0    0.610   0.828    18.427   11.310    5.026
LGA    G   157_B      G   157_A     2.813     0    0.249   0.249     4.935   60.714   60.714
LGA    F   158_B      F   158_A     1.240     0    0.138   0.987     8.877   67.024   38.095
LGA    D   159_B      D   159_A     6.671     0    0.481   1.014    11.173   17.619    9.940
LGA    D   160_B      D   160_A    10.882     0    0.584   1.576    13.683    0.357    0.179
LGA    E   161_B      E   161_A    14.035     0    0.617   1.103    15.607    0.000    0.000
LGA    S   162_B      S   162_A    13.784     0    0.698   0.778    14.324    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      151     604    604  100.00    1252   1252  100.00               173
SUMMARY(RMSD_GDC):    11.560         11.477                 12.242           33.470   29.775

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  151  173    4.0     78    2.19    37.572    32.941     3.403

LGA_LOCAL      RMSD:   2.192  Number of atoms:   78  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  12.903  Number of assigned atoms:  151 
Std_ASGN_ATOMS RMSD:  11.560  Standard rmsd on all 151 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.009980 * X  +  -0.292283 * Y  +   0.956280 * Z  +  18.791513
  Y_new =   0.805630 * X  +   0.568844 * Y  +   0.165457 * Z  + -21.693439
  Z_new =  -0.592335 * X  +   0.768756 * Y  +   0.241150 * Z  +  19.699867 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  1.558409  0.633954  1.266830   [DEG:   89.2903   36.3229   72.5840 ]
ZXZ:  1.742122  1.327246 -0.656499   [DEG:   99.8162   76.0456  -37.6146 ]
 
# END of job
