
#######################################################
#                                                     #
#                        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  252 ( 1940),  selected  252 , name one
# Molecule2: number of CA atoms  504 ( 3955),  selected  252 , 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:    28     118_A - 145_A       4.73    31.98
  LCS_AVERAGE:      4.78

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    14     131_A - 144_A       1.28    33.24
  LCS_AVERAGE:      1.58

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    13     132_A - 144_A       0.79    32.85
  LCS_AVERAGE:      1.12

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  252
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     A    78_A     A    78_A      3    6   16      3    3    4    5    6    6    7   10   11   12   12   14   14   16   18   19   21   23   24   27 
LCS_GDT     E    79_A     E    79_A      5    6   16      4    4    5    5    6    6    7    9   11   12   13   14   14   16   18   19   21   23   30   33 
LCS_GDT     I    80_A     I    80_A      5    6   16      4    4    5    5    6    6    7   10   11   12   13   14   14   16   18   21   24   30   34   36 
LCS_GDT     T    81_A     T    81_A      5    6   21      4    4    5    5    6    6    7   10   11   12   15   17   18   18   19   21   22   24   30   33 
LCS_GDT     P    82_A     P    82_A      5    6   21      4    4    5    5    6    6    7   10   11   12   15   17   18   18   19   21   22   24   25   33 
LCS_GDT     A    83_A     A    83_A      5    6   22      0    4    5    5    6    7    9   13   14   16   17   18   19   21   22   23   23   24   25   34 
LCS_GDT     A    84_A     A    84_A      3    4   22      1    4    6    7    8   10   11   13   14   16   17   18   19   21   22   23   23   26   32   34 
LCS_GDT     A    85_A     A    85_A      7    9   22      5    6    7    8    9   10   11   13   14   16   17   18   19   21   22   23   25   27   32   34 
LCS_GDT     F    86_A     F    86_A      7    9   22      5    6    7    8    9    9   11   13   14   16   17   18   19   21   22   25   37   41   45   49 
LCS_GDT     Q    87_A     Q    87_A      7    9   22      5    6    7    8    9    9   11   13   14   16   21   26   28   33   36   40   43   44   46   50 
LCS_GDT     D    88_A     D    88_A      7    9   22      5    6    7    8    9    9   11   13   14   16   17   18   19   22   24   29   39   43   46   50 
LCS_GDT     K    89_A     K    89_A      7    9   22      5    6    7    8    9    9   11   13   14   15   15   17   19   22   24   37   39   43   46   49 
LCS_GDT     L    90_A     L    90_A      7    9   22      4    6    7    8    9    9   12   21   24   24   25   28   31   34   37   40   43   44   46   50 
LCS_GDT     Y    91_A     Y    91_A      7    9   22      4    5    7    8    9   14   18   21   24   24   25   28   31   34   38   40   43   44   46   50 
LCS_GDT     P    92_A     P    92_A      7   10   22      5    7    9    9    9   14   18   21   24   24   25   28   31   34   38   40   43   44   46   50 
LCS_GDT     F    93_A     F    93_A      7   10   22      5    7    9    9    9   10   11   13   14   16   25   28   31   34   38   40   43   44   46   50 
LCS_GDT     T    94_A     T    94_A      7   10   22      5    7    9    9    9   14   18   21   24   24   25   28   31   34   38   40   43   44   46   50 
LCS_GDT     W    95_A     W    95_A      7   10   22      5    7    9    9    9   10   11   15   23   24   25   28   30   32   36   40   43   44   46   50 
LCS_GDT     D    96_A     D    96_A      7   10   22      5    7    9    9    9   10   11   13   14   16   21   26   29   32   35   38   41   44   45   50 
LCS_GDT     A    97_A     A    97_A      7   10   22      4    7    9    9    9   14   18   21   24   24   25   28   31   34   37   40   43   44   46   50 
LCS_GDT     V    98_A     V    98_A      7   10   22      4    7    9    9    9   10   11   13   16   20   24   26   29   32   34   38   40   43   45   49 
LCS_GDT     R    99_A     R    99_A      5   10   22      3    4    9    9    9   10   11   13   13   17   18   21   22   27   29   31   35   37   41   41 
LCS_GDT     Y   100_A     Y   100_A      4   10   22      3    4    9    9    9   10   11   13   13   16   17   18   22   27   29   31   34   37   39   41 
LCS_GDT     N   101_A     N   101_A      4   10   22      3    4    4    5    9   10   11   13   13   15   17   18   19   27   29   31   34   37   39   41 
LCS_GDT     G   102_A     G   102_A      4    5   22      0    4    4    5    5    6    9   12   13   14   15   21   22   27   29   31   34   37   39   41 
LCS_GDT     K   103_A     K   103_A      3    5   22      3    3    4    5    5    6    6   12   13   14   16   21   22   27   29   31   35   37   40   42 
LCS_GDT     L   104_A     L   104_A      3    5   22      3    3    4    5    7    9   10   12   13   14   16   18   22   24   26   30   33   37   39   41 
LCS_GDT     I   105_A     I   105_A      3    4   22      3    3    4    6    8    9   10   11   13   14   16   17   22   26   28   31   34   37   39   41 
LCS_GDT     A   106_A     A   106_A      3    4   20      3    3    4    5    6    7    8    8   12   12   17   19   24   26   28   32   34   37   40   43 
LCS_GDT     Y   107_A     Y   107_A      3    6   17      3    3    4    4    6    7    8    8   10   11   13   14   16   20   24   28   30   32   35   37 
LCS_GDT     P   108_A     P   108_A      3    6   15      3    3    5    5    6    6    7    7    9   10   12   19   19   21   24   26   29   32   35   37 
LCS_GDT     I   109_A     I   109_A      4    6   15      3    4    5    5    6    6    9   10   11   12   14   19   19   21   22   26   29   32   36   41 
LCS_GDT     A   110_A     A   110_A      4    6   15      3    4    5    5    6    6    9   10   11   17   21   23   27   28   30   33   36   39   42   44 
LCS_GDT     V   111_A     V   111_A      4    6   15      0    4    5    5    6    6    7    9   13   16   21   23   27   28   30   33   36   39   42   44 
LCS_GDT     E   112_A     E   112_A      4    6   15      0    4    5    5    6    7   10   12   13   16   17   23   27   29   29   33   36   39   42   44 
LCS_GDT     A   113_A     A   113_A      3    5   15      3    3    3    5    6    7    8   10   13   16   17   21   25   29   29   33   36   39   42   44 
LCS_GDT     L   114_A     L   114_A      3    7   15      3    3    3    5    6    7   10   12   13   16   17   21   25   29   30   34   39   41   45   48 
LCS_GDT     S   115_A     S   115_A      6    8   15      4    6    7    8    8    8   10   12   13   16   17   19   20   23   24   26   33   37   41   46 
LCS_GDT     L   116_A     L   116_A      7    8   15      4    6    7    8    8    8   10   12   13   16   17   19   24   27   32   34   38   42   47   52 
LCS_GDT     I   117_A     I   117_A      7    8   18      4    6    7    8    8    8   10   13   14   16   20   25   28   34   36   40   43   48   52   60 
LCS_GDT     Y   118_A     Y   118_A      7    8   28      4    6    7    8    8    9   10   13   20   24   28   30   31   35   40   47   51   54   58   65 
LCS_GDT     N   119_A     N   119_A      7    8   28      3    6    7    8    8   10   15   18   21   24   28   30   31   35   40   47   51   54   58   65 
LCS_GDT     K   120_A     K   120_A      7    8   28      3    6    7    8    8   10   15   18   21   24   28   30   31   35   40   47   51   54   58   65 
LCS_GDT     D   121_A     D   121_A      7    8   28      3    4    7    8    8    9   13   16   19   22   25   26   28   35   40   47   51   54   58   65 
LCS_GDT     L   122_A     L   122_A      7    8   28      3    5    7    8    8    8   11   15   19   21   23   26   27   30   40   47   51   54   58   65 
LCS_GDT     L   123_A     L   123_A      5    7   28      3    4    5    5    7    9   11   15   19   21   24   26   27   31   40   47   51   54   58   65 
LCS_GDT     P   124_A     P   124_A      5    7   28      3    4    5    7   11   15   16   18   21   24   28   30   31   35   40   47   51   54   58   65 
LCS_GDT     N   125_A     N   125_A      5    7   28      3    4    5    8   11   15   16   17   21   24   28   30   31   35   40   47   51   54   58   65 
LCS_GDT     P   126_A     P   126_A      5    7   28      3    4    5    6    7   15   16   18   21   22   25   26   31   34   37   40   42   48   52   58 
LCS_GDT     P   127_A     P   127_A      5    7   28      3    4    5    8   12   15   16   18   21   22   25   26   31   34   37   40   42   48   53   58 
LCS_GDT     K   128_A     K   128_A      5    7   28      3    4    5    6    7   10   14   17   20   22   25   26   30   34   36   40   42   47   50   56 
LCS_GDT     T   129_A     T   129_A      4    7   28      3    4    5    9   13   15   16   18   21   22   25   26   27   30   35   40   41   45   50   56 
LCS_GDT     W   130_A     W   130_A      4    7   28      3    3    4    6    7    9   11   15   15   18   21   21   27   30   30   33   38   42   47   55 
LCS_GDT     E   131_A     E   131_A      4   14   28      3    3    4    8   14   14   15   17   20   22   25   26   27   30   36   40   43   48   53   63 
LCS_GDT     E   132_A     E   132_A     13   14   28      6   11   13   13   14   15   15   18   21   24   26   30   31   35   38   47   51   54   58   65 
LCS_GDT     I   133_A     I   133_A     13   14   28      6   11   13   13   14   15   16   18   21   22   25   26   31   35   38   46   51   54   58   65 
LCS_GDT     P   134_A     P   134_A     13   14   28      6   11   13   13   14   15   16   18   21   22   25   28   31   35   38   46   51   54   58   65 
LCS_GDT     A   135_A     A   135_A     13   14   28      6   11   13   13   14   15   16   18   21   22   25   29   31   35   40   47   51   54   58   65 
LCS_GDT     L   136_A     L   136_A     13   14   28      5   11   13   13   14   15   16   18   21   24   28   30   31   35   40   47   51   54   58   65 
LCS_GDT     D   137_A     D   137_A     13   14   28      5   11   13   13   14   15   16   18   21   24   28   30   31   35   40   47   51   54   58   65 
LCS_GDT     K   138_A     K   138_A     13   14   28      6   11   13   13   14   15   16   18   21   24   28   30   31   35   40   47   51   54   58   65 
LCS_GDT     E   139_A     E   139_A     13   14   28      5   11   13   13   14   15   16   18   21   24   28   30   31   35   40   47   51   54   58   65 
LCS_GDT     L   140_A     L   140_A     13   14   28      6   11   13   13   14   15   16   18   21   24   28   30   31   35   40   47   51   54   58   65 
LCS_GDT     K   141_A     K   141_A     13   14   28      6   11   13   13   14   15   16   18   21   24   28   30   31   35   40   47   51   54   58   65 
LCS_GDT     A   142_A     A   142_A     13   14   28      6   11   13   13   14   15   16   18   21   24   28   30   31   35   40   47   51   54   58   65 
LCS_GDT     K   143_A     K   143_A     13   14   28      6   11   13   13   14   15   16   19   21   24   28   30   31   35   40   47   51   54   58   65 
LCS_GDT     G   144_A     G   144_A     13   14   28      6   10   13   13   14   15   16   19   21   24   28   30   31   35   39   47   51   54   58   65 
LCS_GDT     K   145_A     K   145_A      5    5   28      3    4    5    5    6    8   12   17   21   24   25   28   31   35   38   46   51   54   58   65 
LCS_GDT     S   146_A     S   146_A      5    8   25      3    4    5    6    7    8    9   12   15   18   19   23   28   30   32   38   44   47   54   63 
LCS_GDT     A   147_A     A   147_A      5    8   21      3    5    5    6    7    8    9   12   15   18   19   23   28   30   31   35   39   42   46   54 
LCS_GDT     L   148_A     L   148_A      5    8   21      3    5    5    6    7    8    9   12   15   18   19   23   28   30   32   36   39   46   52   59 
LCS_GDT     M   149_A     M   149_A      5    8   21      3    5    5    6    7    8    9   11   15   18   19   23   28   30   32   37   40   48   53   60 
LCS_GDT     F   150_A     F   150_A      5    8   21      3    5    5    6    7    8    9   12   15   18   19   23   28   30   36   38   43   48   53   60 
LCS_GDT     N   151_A     N   151_A      5    8   21      3    4    5    6    7    8    9   12   13   15   21   25   29   32   36   40   42   48   52   60 
LCS_GDT     L   152_A     L   152_A      3    8   21      3    4    4    6    7    8    9   12   15   18   21   25   29   32   34   38   41   45   48   51 
LCS_GDT     Q   153_A     Q   153_A      4    8   21      3    4    4    5    7    8   10   12   15   18   19   25   29   34   38   40   43   44   48   51 
LCS_GDT     E   154_A     E   154_A      4    7   26      3    4    5    6    7    8   12   15   16   19   21   25   29   34   38   40   43   44   47   51 
LCS_GDT     P   155_A     P   155_A      4    7   26      4    4    5    6    8   12   15   17   19   20   23   26   30   34   38   40   43   44   47   51 
LCS_GDT     Y   156_A     Y   156_A      4    7   26      4    4    5    6    8   12   15   17   19   20   23   26   28   30   32   37   41   44   48   51 
LCS_GDT     F   157_A     F   157_A      4    7   26      4    4    5    6    8   12   15   17   19   20   23   26   28   30   31   35   39   44   48   51 
LCS_GDT     T   158_A     T   158_A      4    7   26      4    4    5    6    8   12   15   17   19   20   23   26   28   30   31   35   39   44   47   51 
LCS_GDT     W   159_A     W   159_A      3    8   26      3    3    5    6    7    8   12   16   19   20   23   26   28   30   33   38   40   44   47   51 
LCS_GDT     P   160_A     P   160_A      7    8   26      6    7    7    7    8   11   12   16   19   20   23   26   29   34   38   40   43   44   47   55 
LCS_GDT     L   161_A     L   161_A      7    8   26      6    7    7    7    8   12   15   17   19   20   23   26   31   34   36   40   43   48   54   61 
LCS_GDT     I   162_A     I   162_A      7    8   26      6    7    7    7    8   10   14   17   19   20   23   26   30   34   38   40   43   44   50   57 
LCS_GDT     A   163_A     A   163_A      7    8   27      6    7    7    7    8   13   18   21   24   24   25   28   31   34   38   40   43   44   47   55 
LCS_GDT     A   164_A     A   164_A      7    8   27      6    7    7    7    8   14   18   21   24   24   25   28   31   34   38   40   43   48   53   60 
LCS_GDT     D   165_A     D   165_A      7    8   27      6    7    7    7    8   10   15   17   19   20   23   26   31   34   38   40   43   48   53   60 
LCS_GDT     G   166_A     G   166_A      7    8   27      4    7    7    7    8   12   15   17   19   20   23   26   28   28   31   36   41   43   47   55 
LCS_GDT     G   167_A     G   167_A      3    8   27      3    3    5    6    8   12   15   17   19   20   23   26   28   32   33   38   41   43   47   54 
LCS_GDT     Y   168_A     Y   168_A      3    5   27      3    3    5    5    8   12   15   17   19   20   23   26   28   28   31   33   37   42   46   55 
LCS_GDT     A   169_A     A   169_A      3    4   27      3    3    5    5    5    7    9   13   15   18   21   23   25   27   31   33   37   41   44   50 
LCS_GDT     F   170_A     F   170_A      3    4   27      3    3    5    5    7   12   15   17   19   20   23   26   28   28   30   32   34   37   44   48 
LCS_GDT     K   171_A     K   171_A      3    4   27      1    4    5    6    8   11   15   17   19   20   23   26   28   28   30   32   33   37   44   48 
LCS_GDT     Y   172_A     Y   172_A      3    4   27      1    4    4    6    7   11   15   17   19   20   23   26   28   28   30   32   33   36   40   44 
LCS_GDT     A   173_A     A   173_A      3    4   27      2    4    4    6    7    9   12   16   18   20   23   26   28   28   30   32   33   36   40   44 
LCS_GDT     A   174_A     A   174_A      4    5   27      4    4    5    6    7    7    9   12   15   18   21   24   27   28   30   32   33   36   40   44 
LCS_GDT     G   175_A     G   175_A      4    5   27      4    4    5    6    7   10   14   16   18   20   23   24   28   28   30   32   33   36   40   44 
LCS_GDT     K   176_A     K   176_A      4    5   27      4    4    5    6    7   10   14   16   18   20   23   26   28   28   30   32   33   36   40   44 
LCS_GDT     Y   177_A     Y   177_A      4    5   27      4    4    5    6    7    7    9   13   16   17   23   26   28   28   30   32   33   36   40   44 
LCS_GDT     D   178_A     D   178_A      4    7   27      3    4    4    4    6    7    9   13   16   19   21   24   27   28   30   32   33   37   40   44 
LCS_GDT     I   179_A     I   179_A      5    7   27      3    4    5    5    7    7   15   16   17   19   21   26   28   28   30   32   33   37   40   44 
LCS_GDT     K   180_A     K   180_A      5    7   27      4    4    5    6    7    7    9   13   16   19   21   24   27   28   30   32   33   37   39   40 
LCS_GDT     D   181_A     D   181_A      5    7   27      4    4    5    6    7    7    9   13   16   19   21   24   27   28   30   32   33   37   39   40 
LCS_GDT     V   182_A     V   182_A      5    7   27      4    4    5    6    7    8    9   13   16   19   21   24   27   28   30   32   34   37   40   44 
LCS_GDT     G   183_A     G   183_A      5    7   27      4    4    5    6    7    8    9   12   16   19   21   25   28   31   31   36   39   40   45   47 
LCS_GDT     V   184_A     V   184_A      5    7   27      3    4    5    6    7   13   18   21   24   24   25   28   31   34   38   40   43   44   46   50 
LCS_GDT     D   185_A     D   185_A      3    6   27      3    3    4    5    8   14   18   21   24   24   25   28   31   34   38   40   43   44   46   50 
LCS_GDT     N   186_A     N   186_A      3    5   27      0    3    4    5    8   14   18   21   24   24   25   28   31   34   38   40   43   44   46   50 
LCS_GDT     A   187_A     A   187_A      3    5   27      0    3    3    5    5   14   18   21   24   24   25   28   31   34   38   40   43   44   47   50 
LCS_GDT     G   188_A     G   188_A      3    5   27      1    4    4    5    7   14   18   21   24   24   25   28   31   34   38   40   43   47   54   59 
LCS_GDT     A   189_A     A   189_A      3   11   27      1    4    4    6    8   11   12   17   24   24   25   28   31   34   38   40   43   47   54   61 
LCS_GDT     K   190_A     K   190_A     10   12   27      8   10   10   11   12   13   14   15   18   19   23   27   31   34   38   40   43   49   57   65 
LCS_GDT     A   191_A     A   191_A     10   12   26      8   10   10   11   12   13   14   16   20   24   28   30   31   35   40   47   51   54   58   65 
LCS_GDT     G   192_A     G   192_A     10   12   26      8   10   10   11   12   13   14   18   21   24   28   30   31   35   40   47   51   54   58   65 
LCS_GDT     L   193_A     L   193_A     10   12   26      8   10   10   11   12   13   14   15   18   24   28   30   31   35   40   47   51   54   58   65 
LCS_GDT     T   194_A     T   194_A     10   12   26      8   10   10   11   12   13   18   21   24   24   28   30   31   34   38   40   51   54   58   62 
LCS_GDT     F   195_A     F   195_A     10   12   26      8   10   10   11   12   13   18   21   24   24   28   30   31   35   40   47   51   54   58   63 
LCS_GDT     L   196_A     L   196_A     10   12   26      8   10   10   11   12   13   14   21   24   24   28   30   31   35   40   47   51   54   58   65 
LCS_GDT     V   197_A     V   197_A     10   12   26      8   10   10   11   12   13   18   21   24   24   28   30   31   35   40   47   51   54   58   65 
LCS_GDT     D   198_A     D   198_A     10   12   26      7   10   10   11   12   14   18   21   24   24   25   28   31   34   38   40   43   46   48   51 
LCS_GDT     L   199_A     L   199_A     10   12   26      4   10   10   11   12   14   18   21   24   24   25   28   31   34   38   40   43   46   50   55 
LCS_GDT     I   200_A     I   200_A      5   12   26      3    4    5    9   11   12   14   16   24   24   28   30   31   35   40   47   51   54   58   62 
LCS_GDT     K   201_A     K   201_A      5   12   26      4    5    6    8   11   12   14   15   16   24   28   30   31   34   38   40   51   54   58   60 
LCS_GDT     N   202_A     N   202_A      3    6   26      3    3    3    6    8    9   14   15   16   18   19   23   28   32   36   40   43   46   48   51 
LCS_GDT     K   203_A     K   203_A      5    6   26      3    4    5    5   12   13   14   15   16   16   21   25   33   34   38   40   43   46   48   50 
LCS_GDT     H   204_A     H   204_A      5    6   26      3    4   10   11   12   13   14   15   16   20   24   28   33   34   38   40   43   44   47   50 
LCS_GDT     M   205_A     M   205_A      5    9   26      3    4    5    7   11   14   18   21   24   24   25   28   33   34   38   40   43   46   48   52 
LCS_GDT     N   206_A     N   206_A      5    9   26      3    5    7    7    8   14   18   21   24   24   25   28   33   34   38   40   43   46   58   59 
LCS_GDT     A   207_A     A   207_A      5    9   26      3    5    7    7    8   10   12   18   24   24   25   28   33   35   40   47   51   54   58   60 
LCS_GDT     D   208_A     D   208_A      4    9   26      3    5    7    7    8   14   18   21   24   24   28   30   33   35   40   47   51   54   58   65 
LCS_GDT     T   209_A     T   209_A      4    9   26      3    4    5    5    8   10   12   16   20   24   28   30   33   35   40   47   51   54   58   65 
LCS_GDT     D   210_A     D   210_A      4    9   23      3    5    7    7    8   10   14   16   20   24   28   30   33   35   40   47   51   54   58   65 
LCS_GDT     Y   211_A     Y   211_A      4    9   21      3    5    7    7    8   10   14   16   20   24   28   30   33   35   40   47   51   54   58   65 
LCS_GDT     S   212_A     S   212_A      4    9   21      3    5    7    7    8   10   12   15   19   24   28   30   33   34   39   47   51   54   58   65 
LCS_GDT     I   213_A     I   213_A      4    9   21      3    4    7    7    8   10   13   16   18   22   25   30   33   34   39   47   51   54   58   65 
LCS_GDT     A   214_A     A   214_A      4    9   21      3    4    4    6    8   10   12   13   16   20   24   26   33   34   36   40   51   54   58   65 
LCS_GDT     E   215_A     E   215_A      4    6   21      3    4    4    4    7   10   15   18   21   22   25   26   33   34   36   40   48   53   58   65 
LCS_GDT     A   216_A     A   216_A      3    5   21      3    3    3    5    8   11   13   17   21   22   25   26   33   34   36   39   43   46   48   49 
LCS_GDT     A   217_A     A   217_A      4    5   21      3    4    4    4    5    7   10   14   19   21   24   26   33   34   36   39   43   44   46   48 
LCS_GDT     F   218_A     F   218_A      4    5   21      3    4    4    4    5    6    7   11   13   21   22   26   27   34   36   39   43   44   47   48 
LCS_GDT     N   219_A     N   219_A      4    5   21      3    4    4    4    5    7    7   15   17   20   21   26   33   34   36   39   43   44   46   47 
LCS_GDT     K   220_A     K   220_A      4    5   21      3    4    4    4    7    8   12   13   16   20   24   26   33   34   36   39   43   44   46   47 
LCS_GDT     G   221_A     G   221_A      4    5   21      3    4    4    4    5    7   10   13   14   17   19   25   33   34   36   39   43   44   46   47 
LCS_GDT     E   222_A     E   222_A      4    5   21      4    5    6    6    6    7    9   11   14   15   16   20   23   34   36   39   43   44   46   47 
LCS_GDT     T   223_A     T   223_A      4    5   21      4    5    6    6    6    7    9   11   14   16   19   21   23   34   36   39   43   44   46   47 
LCS_GDT     A   224_A     A   224_A      4    5   21      3    5    6    6    6    7    8   11   14   16   19   21   23   26   30   39   43   44   46   47 
LCS_GDT     M   225_A     M   225_A      4    5   20      0    4    6    6    6    7    9   11   14   15   16   20   23   24   25   29   37   41   42   47 
LCS_GDT     T   226_A     T   226_A      3    5   26      2    3    5    5    6    7    9   12   14   16   18   21   23   26   27   28   31   36   40   44 
LCS_GDT     I   227_A     I   227_A      3    4   26      2    3    4    4    5    7   10   15   19   22   23   25   28   30   36   40   46   52   57   60 
LCS_GDT     N   228_A     N   228_A      3   10   26      1    3    4    7    8   12   15   19   19   22   23   25   28   30   36   40   46   52   57   60 
LCS_GDT     G   229_A     G   229_A      6   10   26      4    5    8    9    9   10   13   19   19   22   23   25   28   30   36   40   46   52   57   60 
LCS_GDT     P   230_A     P   230_A      6   10   26      4    5    8    9   11   15   15   16   18   18   20   25   27   30   36   40   46   50   57   60 
LCS_GDT     W   231_A     W   231_A      6   10   26      4    5    8    9    9   12   14   16   18   21   21   25   28   32   36   40   46   52   57   60 
LCS_GDT     A   232_A     A   232_A      6   10   26      4    5    8    9    9   12   15   19   19   22   23   25   28   30   36   40   46   52   57   60 
LCS_GDT     W   233_A     W   233_A      6   10   26      4    5    8    9    9   11   14   19   19   22   23   25   28   30   36   40   46   50   54   60 
LCS_GDT     S   234_A     S   234_A      6   10   26      4    5    8   12   14   15   15   16   18   21   21   25   28   30   36   40   46   50   57   60 
LCS_GDT     N   235_A     N   235_A      6   10   26      4    5    8    9    9   10   14   15   18   21   22   25   28   30   36   40   46   52   57   60 
LCS_GDT     I   236_A     I   236_A      6   10   26      4    5    8    9    9   11   15   15   19   22   23   25   28   30   34   39   46   50   54   60 
LCS_GDT     D   237_A     D   237_A      6   10   26      3    5    8    9    9   10   11   19   19   22   23   25   28   30   34   35   38   50   54   60 
LCS_GDT     T   238_A     T   238_A      5   10   26      3    4    6    7    9   12   15   19   19   22   23   25   28   30   36   40   46   50   54   60 
LCS_GDT     S   239_A     S   239_A      5   10   26      3    4    6    7    9   12   15   19   19   22   23   25   28   30   36   40   46   52   57   60 
LCS_GDT     A   240_A     A   240_A      5   10   26      3    4    5    7    9   12   15   19   19   22   23   25   28   30   34   40   46   50   54   60 
LCS_GDT     V   241_A     V   241_A      5   10   26      3    4    6    7    9   12   15   19   19   22   23   25   28   30   36   40   46   52   57   60 
LCS_GDT     N   242_A     N   242_A      5   10   26      3    3    5    6    8   12   15   19   19   22   23   25   28   30   36   40   46   52   57   60 
LCS_GDT     Y   243_A     Y   243_A      5   10   26      3    4    5    7    9   12   15   19   19   22   23   25   28   30   36   40   46   52   57   60 
LCS_GDT     G   244_A     G   244_A      5   10   26      3    4    6    7    9   12   15   19   19   22   23   25   28   30   36   40   46   52   57   60 
LCS_GDT     V   245_A     V   245_A      5   10   26      3    4    6    7    9   12   15   19   20   24   25   28   31   35   38   42   49   53   58   65 
LCS_GDT     T   246_A     T   246_A      5   10   26      3    4    6    7   10   12   15   19   21   24   25   28   31   35   38   47   51   54   58   65 
LCS_GDT     V   247_A     V   247_A      5   10   26      3    4    5    6   10   13   15   19   21   24   25   28   31   35   40   47   51   54   58   65 
LCS_GDT     L   248_A     L   248_A      3    6   26      3    3    4    6    9   12   15   19   19   22   23   25   28   35   40   47   51   54   58   65 
LCS_GDT     P   249_A     P   249_A      4    6   26      3    4    4    5    6    9   15   19   19   22   23   25   28   30   34   39   46   50   57   65 
LCS_GDT     T   250_A     T   250_A      4    5   26      3    4    4    4    5    8   10   13   17   22   23   25   28   30   36   40   46   54   58   65 
LCS_GDT     F   251_A     F   251_A      4    5   26      3    4    4    4    5    8   10   11   13   17   21   22   24   26   27   33   38   41   50   55 
LCS_GDT     K   252_A     K   252_A      4    5   18      3    4    4    4    5    6    6    8   12   16   18   18   21   22   24   28   31   37   40   42 
LCS_GDT     G   253_A     G   253_A      3    4   17      0    3    3    3    4    6    6    8    9   16   18   18   21   22   24   28   31   35   40   50 
LCS_GDT     Q   254_A     Q   254_A      3    4   17      0    3    3    3    3    5    5    6    9   11   13   16   18   21   25   28   31   35   45   50 
LCS_GDT     P   255_A     P   255_A      3    4   17      3    3    3    3    4    5    6    8   13   15   18   18   21   23   26   32   38   45   50   55 
LCS_GDT     S   256_A     S   256_A      3    3   17      3    3    3    4    4    6    9   10   12   15   17   22   24   25   28   35   42   46   50   59 
LCS_GDT     K   257_A     K   257_A      3    3   17      3    3    3    4    4    6    9   10   12   15   17   20   24   27   29   35   42   46   58   60 
LCS_GDT     P   258_A     P   258_A      3    3   17      3    3    4    4    4    7    9   11   12   15   17   22   24   25   28   35   42   46   50   58 
LCS_GDT     F   259_A     F   259_A      3    3   17      2    3    4    6    8   11   13   17   21   24   25   26   29   35   40   47   51   54   58   65 
LCS_GDT     V   260_A     V   260_A      3    3   17      0    3    4    6   10   13   14   18   21   24   25   28   31   35   40   47   51   54   58   65 
LCS_GDT     G   261_A     G   261_A      3    3   17      1    3    3    5   10   13   14   18   21   24   25   28   31   35   40   47   51   54   58   65 
LCS_GDT     V   262_A     V   262_A      3    3   12      3    3    4    6    9   11   14   17   21   24   25   28   31   35   38   46   49   54   58   65 
LCS_GDT     L   263_A     L   263_A      3    3   14      3    3    3    5    6    9   12   17   19   22   25   28   31   35   38   42   49   53   58   65 
LCS_GDT     S   264_A     S   264_A      3    5   14      3    3    5    5    5    6   10   11   14   18   21   23   29   33   37   42   49   53   58   65 
LCS_GDT     A   265_A     A   265_A      4    5   14      3    4    5    5    6    7   10   11   14   18   21   23   26   33   37   42   49   53   58   65 
LCS_GDT     G   266_A     G   266_A      4    5   14      3    4    5    5    6    7   10   13   15   18   21   23   25   28   31   36   43   48   52   60 
LCS_GDT     I   267_A     I   267_A      4    5   14      3    4    4    4    5    8   10   13   15   18   21   23   25   28   31   33   37   44   50   55 
LCS_GDT     N   268_A     N   268_A      4    5   14      3    4    4    4    5    5    7    9   10   17   21   23   24   26   27   30   36   41   44   53 
LCS_GDT     A   269_A     A   269_A      5    7   14      4    5    5    5    7    7    7    9   10   12   14   17   19   20   22   27   29   30   33   36 
LCS_GDT     A   270_A     A   270_A      5    7   14      4    5    5    6    7    7    8    9   10   12   13   15   17   20   21   23   24   30   31   36 
LCS_GDT     S   271_A     S   271_A      5    7   14      4    5    5    6    7    7    8    9   10   12   13   15   17   20   21   23   24   25   29   36 
LCS_GDT     P   272_A     P   272_A      5    7   14      4    5    5    6    7    7    8    9   10   12   13   15   17   20   21   23   24   25   26   31 
LCS_GDT     N   273_A     N   273_A      5    7   14      3    5    5    6    7    7    8    9   10   12   13   15   17   20   21   23   24   25   29   32 
LCS_GDT     K   274_A     K   274_A      4    7   14      1    4    5    6    7    7    8    8   10   12   13   15   17   20   21   23   25   27   30   36 
LCS_GDT     E   275_A     E   275_A      3    7   24      1    3    5    6    7    7    8    8   10   12   13   15   17   20   21   23   25   27   30   36 
LCS_GDT     L   276_A     L   276_A      4    5   26      1    4    4    5    6    6    8    9   14   16   19   22   23   24   26   26   26   28   33   37 
LCS_GDT     A   277_A     A   277_A      4    5   26      3    4    4    4    5    7    9   13   17   20   22   23   24   25   26   27   30   34   38   41 
LCS_GDT     K   278_A     K   278_A      4    5   27      3    4    4    4    5    5    8   12   17   20   22   23   24   25   27   29   31   36   38   41 
LCS_GDT     E   279_A     E   279_A      4    5   27      3    4    4    4    6    7    9   13   17   20   22   23   24   25   27   29   31   36   38   41 
LCS_GDT     F   280_A     F   280_A      3    5   27      3    3    4    4    5    5    9   13   16   20   22   23   24   25   27   28   31   33   38   41 
LCS_GDT     L   281_A     L   281_A      3    8   27      3    3    4    6    9   10   12   14   17   20   22   23   24   25   28   30   32   36   45   49 
LCS_GDT     E   282_A     E   282_A      4    8   27      3    4    5    6    9   11   14   15   18   20   22   23   24   26   32   34   37   47   50   57 
LCS_GDT     N   283_A     N   283_A      5    8   27      3    4    5    8   10   12   14   15   18   20   22   23   24   27   32   37   41   48   53   62 
LCS_GDT     Y   284_A     Y   284_A      5    8   27      3    4    5    6    9   11   14   15   18   19   21   23   24   30   32   37   41   46   51   56 
LCS_GDT     L   285_A     L   285_A      5    8   27      3    4    5    6    9   11   14   15   18   20   22   23   24   30   32   37   41   47   51   58 
LCS_GDT     L   286_A     L   286_A      5   12   27      3    4    5    6    8   10   15   17   18   22   25   28   31   35   38   45   49   54   58   65 
LCS_GDT     T   287_A     T   287_A     11   12   27      7   10   10   11   11   12   15   16   19   22   25   26   31   34   37   41   46   52   58   65 
LCS_GDT     D   288_A     D   288_A     11   12   27      8   10   10   11   11   12   15   17   19   20   23   26   28   30   34   37   40   46   51   55 
LCS_GDT     E   289_A     E   289_A     11   12   27      8   10   10   11   11   12   12   13   17   20   22   23   28   30   32   37   41   46   51   56 
LCS_GDT     G   290_A     G   290_A     11   12   27      8   10   10   11   11   12   15   17   19   22   25   27   31   34   37   42   46   52   58   65 
LCS_GDT     L   291_A     L   291_A     11   12   27      7   10   10   11   11   12   12   16   19   22   25   26   31   33   37   40   46   52   57   63 
LCS_GDT     E   292_A     E   292_A     11   12   27      8   10   10   11   11   12   12   15   18   20   23   26   29   31   36   40   46   52   57   60 
LCS_GDT     A   293_A     A   293_A     11   12   27      8   10   10   11   11   12   14   15   19   22   25   26   31   33   37   40   46   52   57   63 
LCS_GDT     V   294_A     V   294_A     11   12   27      8   10   10   11   11   12   14   17   20   22   25   28   31   35   38   41   46   52   58   65 
LCS_GDT     N   295_A     N   295_A     11   12   27      8   10   10   11   11   12   12   15   17   21   23   25   31   32   36   40   46   52   57   60 
LCS_GDT     K   296_A     K   296_A     11   12   27      8   10   10   11   11   12   14   15   18   22   24   26   31   32   36   40   46   52   57   60 
LCS_GDT     D   297_A     D   297_A     11   12   27      3    4   10   11   11   12   14   17   20   22   25   28   31   35   38   41   46   52   57   63 
LCS_GDT     K   298_A     K   298_A      4    7   27      4    4    5    6   10   12   14   17   20   24   25   28   31   35   38   42   46   52   58   65 
LCS_GDT     P   299_A     P   299_A      4    7   27      4    4    5    6   10   12   14   18   21   24   25   28   31   35   38   42   49   53   58   65 
LCS_GDT     L   300_A     L   300_A      4    7   27      4    4    4    6    9   13   14   18   21   24   25   27   31   35   38   46   49   54   58   65 
LCS_GDT     G   301_A     G   301_A      5    7   27      4    5    5    6   10   13   14   18   21   24   25   28   31   35   39   47   51   54   58   65 
LCS_GDT     A   302_A     A   302_A      5    7   27      3    5    5    6   10   13   14   18   21   24   25   28   31   35   40   47   51   54   58   65 
LCS_GDT     V   303_A     V   303_A      5    5   27      3    5    5    6    8   11   14   15   18   19   21   25   28   35   40   47   51   54   58   65 
LCS_GDT     A   304_A     A   304_A      5    5   27      3    5    5    6    8   11   14   16   18   19   22   25   28   35   40   47   51   54   58   65 
LCS_GDT     L   305_A     L   305_A      5    5   27      3    5    5    5    7    9   11   16   18   19   21   23   26   28   32   45   51   54   58   62 
LCS_GDT     K   306_A     K   306_A      3    5   27      3    3    3    6    8    9   11   16   18   19   22   25   28   35   40   47   51   54   58   65 
LCS_GDT     S   307_A     S   307_A      3    5   27      3    4    4    6    8   11   11   16   18   22   25   28   31   35   40   47   51   54   58   65 
LCS_GDT     Y   308_A     Y   308_A      3    5   27      3    3    4    6    7    9   13   16   18   21   21   25   27   34   40   47   51   54   58   65 
LCS_GDT     E   309_A     E   309_A      3    8   27      3    3    3    6    8    9   11   16   18   19   21   23   28   34   38   47   51   54   58   65 
LCS_GDT     E   310_A     E   310_A      6    8   27      4    5    7    7    7    9   11   16   18   19   21   22   26   27   32   38   48   53   58   65 
LCS_GDT     E   311_A     E   311_A      6    8   27      4    5    7    7    8    9   11   16   18   19   21   22   33   34   36   39   43   48   54   60 
LCS_GDT     L   312_A     L   312_A      6    8   27      4    5    7    7    8    9   11   16   18   19   21   22   26   27   36   39   43   44   46   50 
LCS_GDT     A   313_A     A   313_A      6    8   27      4    5    7    7    8    9   11   16   18   19   21   26   33   34   36   39   43   44   50   56 
LCS_GDT     K   314_A     K   314_A      6    8   27      3    5    7    7    8    9   11   16   18   20   24   26   33   34   36   39   43   44   46   51 
LCS_GDT     D   315_A     D   315_A      9   11   27      6    8    9    9    9   10   11   16   18   20   24   26   33   34   36   39   43   44   46   47 
LCS_GDT     P   316_A     P   316_A      9   11   27      6    8    9    9    9   10   11   16   18   20   24   26   33   34   36   39   43   44   46   47 
LCS_GDT     R   317_A     R   317_A      9   11   27      6    8    9    9    9   10   11   16   18   20   24   26   33   34   36   39   43   44   46   47 
LCS_GDT     I   318_A     I   318_A      9   11   27      6    8    9    9    9   10   11   14   18   20   24   26   33   34   36   39   43   44   46   47 
LCS_GDT     A   319_A     A   319_A      9   11   27      6    8    9    9    9   10   11   13   17   20   24   26   33   34   36   39   43   44   46   47 
LCS_GDT     A   320_A     A   320_A      9   11   27      6    8    9    9    9   10   11   15   18   20   24   26   33   34   36   39   43   44   46   47 
LCS_GDT     T   321_A     T   321_A      9   11   27      5    8    9    9    9   10   11   16   18   20   24   26   33   34   36   39   43   44   46   47 
LCS_GDT     M   322_A     M   322_A      9   11   27      4    8    9    9    9   10   11   13   16   20   24   26   33   34   36   39   43   44   46   47 
LCS_GDT     E   323_A     E   323_A      9   11   27      3    5    9    9    9   10   11   12   15   20   24   26   32   34   36   39   43   44   46   47 
LCS_GDT     N   324_A     N   324_A      4   11   27      3    4    4    5    9   10   10   12   14   19   21   22   26   28   30   35   37   39   41   43 
LCS_GDT     A   325_A     A   325_A      4   11   27      3    4    4    5    5    9   11   12   16   20   24   26   33   34   36   39   43   44   46   47 
LCS_GDT     Q   326_A     Q   326_A      4    5   27      3    4    4    5    6    8   11   13   16   20   24   26   33   34   36   39   43   44   46   47 
LCS_GDT     K   327_A     K   327_A      4    5   27      3    3    4    6    8    8   11   13   16   19   21   26   33   34   36   39   43   44   46   47 
LCS_GDT     G   328_A     G   328_A      3    4   27      3    3    4    6    8    8   11   16   18   19   21   22   33   34   36   39   43   44   46   47 
LCS_GDT     E   329_A     E   329_A      3    4   27      3    3    4    6    8    8   11   15   18   19   20   22   23   27   28   32   35   44   46   47 
LCS_AVERAGE  LCS_A:   2.49  (   1.12    1.58    4.78 )

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      8     11     13     13     14     15     18     21     24     24     28     30     33     35     40     47     51     54     58     65 
GDT PERCENT_AT   1.59   2.18   2.58   2.58   2.78   2.98   3.57   4.17   4.76   4.76   5.56   5.95   6.55   6.94   7.94   9.33  10.12  10.71  11.51  12.90
GDT RMS_LOCAL    0.19   0.57   0.79   0.79   1.33   1.64   2.60   2.90   3.23   3.19   3.86   4.06   5.08   4.96   5.66   6.08   6.29   6.45   6.69   7.54
GDT RMS_ALL_AT  42.78  33.76  32.85  32.85  30.46  30.13  36.96  37.12  37.26  37.33  29.12  29.13  35.52  27.43  27.76  27.81  27.91  27.92  28.00  27.26

# Checking swapping
#   possible swapping detected:  D    88_A      D    88_A
#   possible swapping detected:  Y    91_A      Y    91_A
#   possible swapping detected:  D    96_A      D    96_A
#   possible swapping detected:  D   121_A      D   121_A
#   possible swapping detected:  E   132_A      E   132_A
#   possible swapping detected:  E   139_A      E   139_A
#   possible swapping detected:  F   150_A      F   150_A
#   possible swapping detected:  E   154_A      E   154_A
#   possible swapping detected:  Y   156_A      Y   156_A
#   possible swapping detected:  F   157_A      F   157_A
#   possible swapping detected:  Y   168_A      Y   168_A
#   possible swapping detected:  F   170_A      F   170_A
#   possible swapping detected:  Y   177_A      Y   177_A
#   possible swapping detected:  D   178_A      D   178_A
#   possible swapping detected:  D   181_A      D   181_A
#   possible swapping detected:  D   198_A      D   198_A
#   possible swapping detected:  D   208_A      D   208_A
#   possible swapping detected:  D   210_A      D   210_A
#   possible swapping detected:  Y   211_A      Y   211_A
#   possible swapping detected:  F   218_A      F   218_A
#   possible swapping detected:  E   222_A      E   222_A
#   possible swapping detected:  D   237_A      D   237_A
#   possible swapping detected:  F   251_A      F   251_A
#   possible swapping detected:  E   279_A      E   279_A
#   possible swapping detected:  F   280_A      F   280_A
#   possible swapping detected:  D   297_A      D   297_A
#   possible swapping detected:  Y   308_A      Y   308_A
#   possible swapping detected:  E   309_A      E   309_A
#   possible swapping detected:  E   310_A      E   310_A
#   possible swapping detected:  D   315_A      D   315_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    A    78_A      A    78_A    36.338     0    0.091   0.096    37.297    0.000    0.000
LGA    E    79_A      E    79_A    30.612     0    0.609   1.094    32.985    0.000    0.000
LGA    I    80_A      I    80_A    27.586     0    0.078   1.082    29.938    0.000    0.000
LGA    T    81_A      T    81_A    26.237     0    0.275   0.842    28.075    0.000    0.000
LGA    P    82_A      P    82_A    25.591     0    0.622   0.790    26.388    0.000    0.000
LGA    A    83_A      A    83_A    24.453     0    0.578   0.571    26.105    0.000    0.000
LGA    A    84_A      A    84_A    17.964     0    0.580   0.581    20.585    0.000    0.000
LGA    A    85_A      A    85_A    14.959     0    0.617   0.602    16.235    0.000    0.000
LGA    F    86_A      F    86_A    12.801     0    0.063   0.079    13.733    0.119    0.043
LGA    Q    87_A      Q    87_A     7.867     0    0.043   0.817     9.943    9.762   12.063
LGA    D    88_A      D    88_A     8.919     0    0.129   0.888    11.207    3.333    1.667
LGA    K    89_A      K    89_A     9.158     0    0.172   1.177    16.935    8.333    3.704
LGA    L    90_A      L    90_A     3.839     0    0.088   1.122     8.968   60.357   35.000
LGA    Y    91_A      Y    91_A     2.760     0    0.332   1.395    13.824   67.381   26.825
LGA    P    92_A      P    92_A     2.023     0    0.652   0.764     4.153   59.167   54.422
LGA    F    93_A      F    93_A     5.569     0    0.082   1.126    13.560   36.310   13.896
LGA    T    94_A      T    94_A     3.095     0    0.051   0.071     7.373   57.500   41.769
LGA    W    95_A      W    95_A     4.725     0    0.105   1.267    13.100   33.929   12.789
LGA    D    96_A      D    96_A     6.546     0    0.085   1.399    11.671   21.071   11.429
LGA    A    97_A      A    97_A     1.544     0    0.179   0.180     2.901   61.071   63.429
LGA    V    98_A      V    98_A     7.084     0    0.553   0.510    10.741   10.714    8.435
LGA    R    99_A      R    99_A    13.226     0    0.267   1.244    19.934    0.000    0.000
LGA    Y   100_A      Y   100_A    17.943     0    0.090   0.096    24.390    0.000    0.000
LGA    N   101_A      N   101_A    19.631     0    0.550   0.994    23.313    0.000    0.000
LGA    G   102_A      G   102_A    16.431     0    0.684   0.684    17.906    0.000    0.000
LGA    K   103_A      K   103_A    14.897     0    0.612   1.066    15.619    0.000    0.000
LGA    L   104_A      L   104_A    15.883     0    0.585   1.129    19.190    0.000    0.000
LGA    I   105_A      I   105_A    16.553     0    0.269   1.529    16.638    0.000    0.000
LGA    A   106_A      A   106_A    13.869     0    0.571   0.582    16.991    0.000    0.000
LGA    Y   107_A      Y   107_A    16.835     0    0.587   1.438    27.678    0.000    0.000
LGA    P   108_A      P   108_A    17.158     0    0.669   0.756    20.473    0.000    0.000
LGA    I   109_A      I   109_A    17.429     0    0.504   1.695    18.811    0.000    0.000
LGA    A   110_A      A   110_A    18.402     0    0.226   0.329    18.885    0.000    0.000
LGA    V   111_A      V   111_A    20.643     0    0.586   0.997    24.108    0.000    0.000
LGA    E   112_A      E   112_A    21.317     0    0.583   1.229    21.317    0.000    0.000
LGA    A   113_A      A   113_A    19.864     0    0.586   0.588    21.466    0.000    0.000
LGA    L   114_A      L   114_A    18.775     0    0.293   0.955    20.946    0.000    0.000
LGA    S   115_A      S   115_A    24.907     0    0.483   0.903    28.159    0.000    0.000
LGA    L   116_A      L   116_A    26.132     0    0.110   1.232    30.981    0.000    0.000
LGA    I   117_A      I   117_A    26.384     0    0.000   1.244    27.755    0.000    0.000
LGA    Y   118_A      Y   118_A    31.099     0    0.073   1.239    37.158    0.000    0.000
LGA    N   119_A      N   119_A    34.001     0    0.067   0.894    37.333    0.000    0.000
LGA    K   120_A      K   120_A    39.619     0    0.596   1.551    41.576    0.000    0.000
LGA    D   121_A      D   121_A    45.666     0    0.343   1.241    49.311    0.000    0.000
LGA    L   122_A      L   122_A    42.390     0    0.412   1.353    46.224    0.000    0.000
LGA    L   123_A      L   123_A    39.712     0    0.069   1.353    41.794    0.000    0.000
LGA    P   124_A      P   124_A    37.542     0    0.689   0.602    39.160    0.000    0.000
LGA    N   125_A      N   125_A    33.986     0    0.083   0.199    40.204    0.000    0.000
LGA    P   126_A      P   126_A    27.552     0    0.070   0.098    29.574    0.000    0.000
LGA    P   127_A      P   127_A    25.456     0    0.180   0.221    28.193    0.000    0.000
LGA    K   128_A      K   128_A    18.923     0    0.127   0.823    21.545    0.000    0.000
LGA    T   129_A      T   129_A    20.791     0    0.586   1.391    23.375    0.000    0.000
LGA    W   130_A      W   130_A    23.314     0    0.154   1.437    25.232    0.000    0.000
LGA    E   131_A      E   131_A    22.818     0    0.371   1.166    24.103    0.000    0.000
LGA    E   132_A      E   132_A    22.813     0    0.301   0.942    23.110    0.000    0.000
LGA    I   133_A      I   133_A    20.007     0    0.058   0.126    22.017    0.000    0.000
LGA    P   134_A      P   134_A    25.130     0    0.090   0.141    27.080    0.000    0.000
LGA    A   135_A      A   135_A    29.213     0    0.082   0.075    30.237    0.000    0.000
LGA    L   136_A      L   136_A    25.527     0    0.045   0.936    27.265    0.000    0.000
LGA    D   137_A      D   137_A    23.527     0    0.000   0.603    25.451    0.000    0.000
LGA    K   138_A      K   138_A    29.404     0    0.064   0.785    33.783    0.000    0.000
LGA    E   139_A      E   139_A    30.863     0    0.053   1.051    33.959    0.000    0.000
LGA    L   140_A      L   140_A    25.527     0    0.064   1.046    27.010    0.000    0.000
LGA    K   141_A      K   141_A    26.270     0    0.065   0.638    28.445    0.000    0.000
LGA    A   142_A      A   142_A    32.576     0    0.134   0.133    34.752    0.000    0.000
LGA    K   143_A      K   143_A    30.694     0    0.136   0.844    32.495    0.000    0.000
LGA    G   144_A      G   144_A    25.648     0    0.259   0.259    27.505    0.000    0.000
LGA    K   145_A      K   145_A    23.373     0    0.145   0.743    27.063    0.000    0.000
LGA    S   146_A      S   146_A    20.775     0    0.661   0.572    21.761    0.000    0.000
LGA    A   147_A      A   147_A    23.847     0    0.114   0.134    25.267    0.000    0.000
LGA    L   148_A      L   148_A    20.006     0    0.083   0.951    21.044    0.000    0.000
LGA    M   149_A      M   149_A    19.466     0    0.650   0.943    23.317    0.000    0.000
LGA    F   150_A      F   150_A    16.475     0    0.194   1.404    17.151    0.000    0.000
LGA    N   151_A      N   151_A    13.136     0    0.584   1.264    14.582    0.000    0.000
LGA    L   152_A      L   152_A    12.949     0    0.676   0.960    17.817    0.000    0.000
LGA    Q   153_A      Q   153_A    11.171     0    0.670   1.504    13.883    0.119    0.053
LGA    E   154_A      E   154_A    12.142     0    0.135   1.164    16.249    0.000    0.000
LGA    P   155_A      P   155_A    10.338     0    0.235   0.361    11.910    0.000    2.109
LGA    Y   156_A      Y   156_A    15.426     0    0.092   1.373    26.627    0.000    0.000
LGA    F   157_A      F   157_A    19.566     0    0.350   0.862    28.180    0.000    0.000
LGA    T   158_A      T   158_A    15.503     0    0.716   0.930    16.303    0.000    0.000
LGA    W   159_A      W   159_A    11.499     0    0.573   1.277    13.014    0.357    0.102
LGA    P   160_A      P   160_A     8.512     0    0.271   0.290    11.096    6.905    4.150
LGA    L   161_A      L   161_A     9.223     0    0.035   1.125    14.952    8.333    4.167
LGA    I   162_A      I   162_A     8.174     0    0.000   0.090    15.558   12.024    6.012
LGA    A   163_A      A   163_A     2.901     0    0.000   0.011     4.455   52.619   56.667
LGA    A   164_A      A   164_A     3.061     0    0.043   0.060     6.747   47.738   45.619
LGA    D   165_A      D   165_A     6.424     0    0.246   1.283    10.894   15.833   12.143
LGA    G   166_A      G   166_A    10.457     0    0.148   0.148    12.598    1.190    1.190
LGA    G   167_A      G   167_A     8.193     0    0.620   0.620    10.072    2.500    2.500
LGA    Y   168_A      Y   168_A    12.744     0    0.635   1.348    15.910    0.000    0.000
LGA    A   169_A      A   169_A    15.786     0    0.142   0.176    18.591    0.000    0.000
LGA    F   170_A      F   170_A    17.680     0    0.613   0.990    19.388    0.000    0.000
LGA    K   171_A      K   171_A    21.497     0    0.611   0.935    25.145    0.000    0.000
LGA    Y   172_A      Y   172_A    25.934     0    0.574   1.500    29.246    0.000    0.000
LGA    A   173_A      A   173_A    29.489     0    0.591   0.576    32.028    0.000    0.000
LGA    A   174_A      A   174_A    31.231     0    0.558   0.614    33.712    0.000    0.000
LGA    G   175_A      G   175_A    32.047     0    0.174   0.174    32.946    0.000    0.000
LGA    K   176_A      K   176_A    31.372     0    0.103   1.008    37.094    0.000    0.000
LGA    Y   177_A      Y   177_A    27.597     0    0.152   1.236    29.212    0.000    0.000
LGA    D   178_A      D   178_A    27.265     0    0.074   1.290    31.544    0.000    0.000
LGA    I   179_A      I   179_A    22.428     0    0.622   1.430    24.601    0.000    0.000
LGA    K   180_A      K   180_A    23.548     0    0.419   0.834    28.818    0.000    0.000
LGA    D   181_A      D   181_A    19.578     0    0.229   0.920    20.783    0.000    0.000
LGA    V   182_A      V   182_A    13.087     0    0.095   0.908    15.599    0.000    0.000
LGA    G   183_A      G   183_A     9.337     0    0.510   0.510    10.022    9.048    9.048
LGA    V   184_A      V   184_A     3.015     0    0.656   0.671     5.997   53.452   42.585
LGA    D   185_A      D   185_A     1.001     0    0.519   1.091     4.492   72.024   63.036
LGA    N   186_A      N   186_A     1.964     0    0.600   1.114     7.241   61.905   43.690
LGA    A   187_A      A   187_A     3.126     0    0.649   0.619     5.467   61.190   54.190
LGA    G   188_A      G   188_A     2.695     0    0.606   0.606     2.751   67.381   67.381
LGA    A   189_A      A   189_A     5.376     0    0.639   0.611     7.210   22.619   20.762
LGA    K   190_A      K   190_A     7.723     0    0.600   1.174    13.829   13.810    6.296
LGA    A   191_A      A   191_A     6.181     0    0.000   0.033     7.227   18.452   16.762
LGA    G   192_A      G   192_A     7.950     0    0.054   0.054     7.950   10.357   10.357
LGA    L   193_A      L   193_A     6.794     0    0.072   0.138     8.404   18.929   12.440
LGA    T   194_A      T   194_A     2.953     0    0.000   1.156     4.599   56.548   55.306
LGA    F   195_A      F   195_A     3.466     0    0.088   0.426     7.621   51.786   30.346
LGA    L   196_A      L   196_A     4.332     0    0.023   1.024     6.709   43.571   30.952
LGA    V   197_A      V   197_A     3.790     0    0.095   0.119     5.933   46.786   38.844
LGA    D   198_A      D   198_A     2.621     0    0.078   1.089     3.656   61.190   60.298
LGA    L   199_A      L   199_A     1.852     0    0.151   1.086     8.368   81.548   51.607
LGA    I   200_A      I   200_A     4.871     0    0.000   0.607     9.426   30.000   17.202
LGA    K   201_A      K   201_A     8.398     0    0.548   0.938    11.171    6.905    3.228
LGA    N   202_A      N   202_A    10.713     0    0.247   0.820    15.835    0.476    0.238
LGA    K   203_A      K   203_A     8.486     0    0.395   0.900    13.673    4.405    1.958
LGA    H   204_A      H   204_A     6.136     0    0.066   1.029     7.760   18.452   17.429
LGA    M   205_A      M   205_A     3.045     0    0.027   1.007     6.647   45.119   35.893
LGA    N   206_A      N   206_A     3.089     0    0.627   1.569     6.293   48.571   42.143
LGA    A   207_A      A   207_A     5.204     0    0.141   0.143     7.398   39.167   33.333
LGA    D   208_A      D   208_A     2.511     0    0.619   1.213     6.773   55.595   38.095
LGA    T   209_A      T   209_A     6.613     0    0.292   1.200    10.101   17.619   10.952
LGA    D   210_A      D   210_A     9.679     0    0.205   1.140    13.618    0.833    0.655
LGA    Y   211_A      Y   211_A    16.466     0    0.000   1.374    28.431    0.000    0.000
LGA    S   212_A      S   212_A    20.084     0    0.497   0.661    21.776    0.000    0.000
LGA    I   213_A      I   213_A    16.740     0    0.070   1.432    19.122    0.000    0.000
LGA    A   214_A      A   214_A    19.670     0    0.664   0.629    22.946    0.000    0.000
LGA    E   215_A      E   215_A    24.046     0    0.539   1.243    28.232    0.000    0.000
LGA    A   216_A      A   216_A    29.700     0    0.615   0.593    30.782    0.000    0.000
LGA    A   217_A      A   217_A    30.040     0    0.620   0.599    33.504    0.000    0.000
LGA    F   218_A      F   218_A    33.744     0    0.652   1.420    35.572    0.000    0.000
LGA    N   219_A      N   219_A    38.537     0    0.325   1.369    40.081    0.000    0.000
LGA    K   220_A      K   220_A    36.871     0    0.182   1.192    37.277    0.000    0.000
LGA    G   221_A      G   221_A    37.177     0    0.587   0.587    37.177    0.000    0.000
LGA    E   222_A      E   222_A    36.349     0    0.637   0.923    42.525    0.000    0.000
LGA    T   223_A      T   223_A    30.583     0    0.048   1.081    33.576    0.000    0.000
LGA    A   224_A      A   224_A    30.788     0    0.670   0.635    30.788    0.000    0.000
LGA    M   225_A      M   225_A    30.460     0    0.614   1.077    32.078    0.000    0.000
LGA    T   226_A      T   226_A    27.895     0    0.588   0.556    29.376    0.000    0.000
LGA    I   227_A      I   227_A    25.084     0    0.615   0.533    26.438    0.000    0.000
LGA    N   228_A      N   228_A    30.287     0    0.599   0.930    34.170    0.000    0.000
LGA    G   229_A      G   229_A    33.867     0    0.497   0.497    33.867    0.000    0.000
LGA    P   230_A      P   230_A    33.946     0    0.089   0.246    34.287    0.000    0.000
LGA    W   231_A      W   231_A    33.932     0    0.143   1.337    34.428    0.000    0.000
LGA    A   232_A      A   232_A    35.004     0    0.164   0.169    35.210    0.000    0.000
LGA    W   233_A      W   233_A    35.731     0    0.063   1.555    40.526    0.000    0.000
LGA    S   234_A      S   234_A    35.070     0    0.138   0.539    36.394    0.000    0.000
LGA    N   235_A      N   235_A    35.047     0    0.079   0.377    35.848    0.000    0.000
LGA    I   236_A      I   236_A    35.809     0    0.620   1.208    36.742    0.000    0.000
LGA    D   237_A      D   237_A    38.859     0    0.343   1.126    43.157    0.000    0.000
LGA    T   238_A      T   238_A    35.482     0    0.461   1.256    36.718    0.000    0.000
LGA    S   239_A      S   239_A    30.579     0    0.149   0.578    34.146    0.000    0.000
LGA    A   240_A      A   240_A    33.607     0    0.200   0.194    34.794    0.000    0.000
LGA    V   241_A      V   241_A    30.115     0    0.625   1.036    32.797    0.000    0.000
LGA    N   242_A      N   242_A    34.424     0    0.106   1.050    38.158    0.000    0.000
LGA    Y   243_A      Y   243_A    35.656     0    0.437   1.226    38.708    0.000    0.000
LGA    G   244_A      G   244_A    36.734     0    0.031   0.031    36.734    0.000    0.000
LGA    V   245_A      V   245_A    33.926     0    0.061   1.104    37.235    0.000    0.000
LGA    T   246_A      T   246_A    34.092     0    0.124   0.272    35.882    0.000    0.000
LGA    V   247_A      V   247_A    31.472     0    0.184   1.244    33.051    0.000    0.000
LGA    L   248_A      L   248_A    29.552     0    0.088   0.481    29.821    0.000    0.000
LGA    P   249_A      P   249_A    28.766     0    0.343   0.465    29.790    0.000    0.000
LGA    T   250_A      T   250_A    24.253     0    0.108   1.152    26.461    0.000    0.000
LGA    F   251_A      F   251_A    22.296     0    0.058   1.282    22.575    0.000    0.000
LGA    K   252_A      K   252_A    22.311     0    0.443   0.390    25.663    0.000    0.000
LGA    G   253_A      G   253_A    28.273     0    0.735   0.735    30.609    0.000    0.000
LGA    Q   254_A      Q   254_A    31.850     0    0.642   1.186    32.301    0.000    0.000
LGA    P   255_A      P   255_A    32.980     0    0.658   0.610    34.438    0.000    0.000
LGA    S   256_A      S   256_A    29.039     0    0.649   0.577    30.925    0.000    0.000
LGA    K   257_A      K   257_A    32.670     0    0.569   1.200    35.744    0.000    0.000
LGA    P   258_A      P   258_A    36.299     0    0.645   0.550    38.028    0.000    0.000
LGA    F   259_A      F   259_A    35.480     0    0.573   1.192    36.636    0.000    0.000
LGA    V   260_A      V   260_A    37.820     0    0.606   1.330    40.325    0.000    0.000
LGA    G   261_A      G   261_A    43.751     0    0.590   0.590    46.225    0.000    0.000
LGA    V   262_A      V   262_A    48.485     0    0.590   1.032    51.446    0.000    0.000
LGA    L   263_A      L   263_A    48.198     0    0.634   1.411    50.193    0.000    0.000
LGA    S   264_A      S   264_A    50.751     0    0.648   0.993    53.184    0.000    0.000
LGA    A   265_A      A   265_A    57.848     0    0.602   0.550    60.092    0.000    0.000
LGA    G   266_A      G   266_A    57.689     0    0.048   0.048    58.497    0.000    0.000
LGA    I   267_A      I   267_A    60.893     0    0.629   1.654    64.319    0.000    0.000
LGA    N   268_A      N   268_A    58.454     0    0.631   0.622    59.549    0.000    0.000
LGA    A   269_A      A   269_A    57.290     0    0.626   0.569    59.619    0.000    0.000
LGA    A   270_A      A   270_A    56.851     0    0.119   0.113    57.558    0.000    0.000
LGA    S   271_A      S   271_A    57.131     0    0.122   0.666    59.530    0.000    0.000
LGA    P   272_A      P   272_A    59.716     0    0.163   0.211    61.384    0.000    0.000
LGA    N   273_A      N   273_A    58.251     0    0.552   0.513    59.798    0.000    0.000
LGA    K   274_A      K   274_A    56.067     0    0.627   0.899    57.065    0.000    0.000
LGA    E   275_A      E   275_A    56.950     0    0.638   1.427    57.496    0.000    0.000
LGA    L   276_A      L   276_A    59.601     0    0.600   0.677    65.593    0.000    0.000
LGA    A   277_A      A   277_A    55.206     0    0.610   0.599    56.287    0.000    0.000
LGA    K   278_A      K   278_A    55.321     0    0.406   0.852    56.742    0.000    0.000
LGA    E   279_A      E   279_A    60.501     0    0.069   1.074    64.138    0.000    0.000
LGA    F   280_A      F   280_A    63.166     0    0.446   1.339    66.782    0.000    0.000
LGA    L   281_A      L   281_A    61.855     0    0.612   1.381    63.157    0.000    0.000
LGA    E   282_A      E   282_A    65.842     0    0.593   1.077    67.908    0.000    0.000
LGA    N   283_A      N   283_A    72.512     0    0.167   1.082    77.795    0.000    0.000
LGA    Y   284_A      Y   284_A    72.809     0    0.051   0.287    83.808    0.000    0.000
LGA    L   285_A      L   285_A    66.073     0    0.119   0.974    68.298    0.000    0.000
LGA    L   286_A      L   286_A    65.468     0    0.497   1.053    67.241    0.000    0.000
LGA    T   287_A      T   287_A    70.339     0    0.611   1.046    74.226    0.000    0.000
LGA    D   288_A      D   288_A    67.742     0    0.000   0.087    68.649    0.000    0.000
LGA    E   289_A      E   289_A    68.375     0    0.057   1.116    69.486    0.000    0.000
LGA    G   290_A      G   290_A    69.578     0    0.072   0.072    69.578    0.000    0.000
LGA    L   291_A      L   291_A    67.090     0    0.060   1.443    67.974    0.000    0.000
LGA    E   292_A      E   292_A    65.135     0    0.052   0.988    65.973    0.000    0.000
LGA    A   293_A      A   293_A    66.825     0    0.000   0.015    68.097    0.000    0.000
LGA    V   294_A      V   294_A    66.659     0    0.040   0.071    68.474    0.000    0.000
LGA    N   295_A      N   295_A    63.503     0    0.022   1.410    64.688    0.000    0.000
LGA    K   296_A      K   296_A    62.816     0    0.622   1.014    65.486    0.000    0.000
LGA    D   297_A      D   297_A    61.574     0    0.173   1.271    64.191    0.000    0.000
LGA    K   298_A      K   298_A    54.071     0    0.656   1.123    56.765    0.000    0.000
LGA    P   299_A      P   299_A    52.079     0    0.081   0.222    52.834    0.000    0.000
LGA    L   300_A      L   300_A    51.110     0    0.146   1.375    55.192    0.000    0.000
LGA    G   301_A      G   301_A    48.596     0    0.210   0.210    49.289    0.000    0.000
LGA    A   302_A      A   302_A    47.996     0    0.028   0.050    49.096    0.000    0.000
LGA    V   303_A      V   303_A    49.636     0    0.136   1.254    52.187    0.000    0.000
LGA    A   304_A      A   304_A    50.107     0    0.601   0.544    52.320    0.000    0.000
LGA    L   305_A      L   305_A    52.858     0    0.152   0.938    55.416    0.000    0.000
LGA    K   306_A      K   306_A    53.949     0    0.472   0.849    55.436    0.000    0.000
LGA    S   307_A      S   307_A    59.221     0    0.630   0.656    61.879    0.000    0.000
LGA    Y   308_A      Y   308_A    62.744     0    0.534   1.331    70.866    0.000    0.000
LGA    E   309_A      E   309_A    60.747     0    0.065   1.133    62.776    0.000    0.000
LGA    E   310_A      E   310_A    65.601     0    0.653   0.908    67.541    0.000    0.000
LGA    E   311_A      E   311_A    71.500     0    0.054   0.916    79.538    0.000    0.000
LGA    L   312_A      L   312_A    68.961     0    0.078   0.854    71.116    0.000    0.000
LGA    A   313_A      A   313_A    63.211     0    0.162   0.164    65.203    0.000    0.000
LGA    K   314_A      K   314_A    67.468     0    0.103   1.112    70.399    0.000    0.000
LGA    D   315_A      D   315_A    68.070     0    0.616   1.054    69.383    0.000    0.000
LGA    P   316_A      P   316_A    62.599     0    0.056   0.350    65.642    0.000    0.000
LGA    R   317_A      R   317_A    58.326     0    0.029   0.746    63.086    0.000    0.000
LGA    I   318_A      I   318_A    62.511     0    0.044   0.694    66.535    0.000    0.000
LGA    A   319_A      A   319_A    63.332     0    0.042   0.040    64.226    0.000    0.000
LGA    A   320_A      A   320_A    56.379     0    0.036   0.041    58.832    0.000    0.000
LGA    T   321_A      T   321_A    55.437     0    0.109   1.042    56.842    0.000    0.000
LGA    M   322_A      M   322_A    60.827     0    0.000   0.683    67.037    0.000    0.000
LGA    E   323_A      E   323_A    59.471     0    0.583   1.280    61.632    0.000    0.000
LGA    N   324_A      N   324_A    55.802     0    0.036   0.127    58.673    0.000    0.000
LGA    A   325_A      A   325_A    54.715     0    0.049   0.062    55.845    0.000    0.000
LGA    Q   326_A      Q   326_A    53.416     0    0.638   0.978    57.533    0.000    0.000
LGA    K   327_A      K   327_A    49.137     0    0.473   0.954    56.705    0.000    0.000
LGA    G   328_A      G   328_A    43.360     0    0.128   0.128    45.869    0.000    0.000
LGA    E   329_A      E   329_A    41.614     0    0.065   1.145    42.722    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      252    1008   1008  100.00    1940   1940  100.00               504
SUMMARY(RMSD_GDC):    24.595         24.547                 25.128            3.164    2.451

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  252  504    4.0     21    2.90     4.563     3.595     0.700

LGA_LOCAL      RMSD:   2.899  Number of atoms:   21  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  37.117  Number of assigned atoms:  252 
Std_ASGN_ATOMS RMSD:  24.595  Standard rmsd on all 252 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.931743 * X  +   0.107650 * Y  +   0.346796 * Z  + -325.814697
  Y_new =   0.265191 * X  +  -0.854133 * Y  +  -0.447359 * Z  + 219.037460
  Z_new =   0.248051 * X  +   0.508791 * Y  +  -0.824380 * Z  +  59.296196 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  0.277286 -0.250668  2.588636   [DEG:   15.8873  -14.3622  148.3179 ]
ZXZ:  0.659439  2.539902  0.453623   [DEG:   37.7830  145.5257   25.9907 ]
 
# END of job
