
#######################################################
#                                                     #
#                        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  251 ( 2082),  selected  239 , name one
# Molecule2: number of CA atoms  239 ( 1967),  selected  239 , 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:    69     154_A - 222_A       4.86    16.16
  LONGEST_CONTINUOUS_SEGMENT:    69     155_A - 223_A       4.93    16.15
  LCS_AVERAGE:     21.22

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    23     155_A - 177_A       1.90    17.31
  LCS_AVERAGE:      5.62

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    15      14_A - 28_A        0.97    20.98
  LCS_AVERAGE:      3.21

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  239
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     N     2_A     N     2_A      4    5   44      3    4    9   11   13   17   29   52   96  107  119  127  138  147  152  157  161  164  167  170 
LCS_GDT     S     3_A     S     3_A      4    5   44      3    4    7   11   31   50   74   96  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     T     4_A     T     4_A      4    7   44      5    7   13   23   46   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     E     5_A     E     5_A      4    7   44      3    6    9   19   29   46   75   94  103  111  118  127  138  147  152  157  161  164  167  170 
LCS_GDT     N     6_A     N     6_A      4    7   44      3    4   14   25   45   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     K     7_A     K     7_A      6    7   44      3    7   24   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     N     8_A     N     8_A      6    7   44      3    5    9   20   41   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     F     9_A     F     9_A      6    7   44      3    7   23   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     V    10_A     V    10_A      6    7   44      3    5   10   20   41   60   81   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     I    11_A     I    11_A      6   18   44      3    9   29   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     S    12_A     S    12_A      6   19   44      3    9   15   26   46   63   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     I    13_A     I    13_A      4   19   44      3    4   20   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     S    14_A     S    14_A     15   19   44      4   14   16   25   38   46   63   74   90  107  116  127  136  147  152  157  160  163  167  170 
LCS_GDT     T    15_A     T    15_A     15   19   44      4   14   19   28   38   54   71   83  102  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     A    16_A     A    16_A     15   19   44      6   14   17   34   50   61   81   97  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     E    17_A     E    17_A     15   19   44      3   14   22   42   51   62   84   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     Q    18_A     Q    18_A     15   19   44      6   14   29   42   51   65   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     R    19_A     R    19_A     15   19   44      8   14   29   42   51   64   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     R    20_A     R    20_A     15   19   44      8   14   29   42   51   64   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     N    21_A     N    21_A     15   19   44      8   14   29   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     H    22_A     H    22_A     15   19   44      8   14   24   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     I    23_A     I    23_A     15   19   44      8   14   20   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     I    24_A     I    24_A     15   19   44      8   14   16   28   48   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     E    25_A     E    25_A     15   19   44      8   14   16   29   46   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     Q    26_A     Q    26_A     15   19   44      8   11   16   29   45   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     F    27_A     F    27_A     15   19   44      5   10   17   28   45   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     T    28_A     T    28_A     15   19   44      4    9   16   29   45   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     H    29_A     H    29_A     12   19   44      4    4   13   19   28   34   55   75   99  109  118  127  138  147  152  157  161  164  167  170 
LCS_GDT     Q    30_A     Q    30_A      7   19   44      4    7   15   29   45   65   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     N    31_A     N    31_A      7   19   44      4    8   12   25   41   59   82   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     I    32_A     I    32_A      7   19   44      4    6   12   28   45   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     P    33_A     P    33_A      7   16   44      4    8   12   23   45   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     F    34_A     F    34_A      7   14   44      3    8   12   23   45   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     E    35_A     E    35_A      7   14   44      5    7   12   22   45   65   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     F    36_A     F    36_A      7   14   44      4    8   13   25   45   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     F    37_A     F    37_A      7   14   44      4    8   14   33   48   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     D    38_A     D    38_A      6   12   44      4    6   12   25   42   60   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     A    39_A     A    39_A      5   12   44      3    8   14   32   48   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     F    40_A     F    40_A      5   12   44      3    5   13   19   34   53   70   87  102  111  119  127  138  147  152  157  161  164  167  170 
LCS_GDT     T    41_A     T    41_A      5   18   44      3    8   13   28   47   62   89   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     P    42_A     P    42_A     12   18   44      5    9   13   16   19   30   51   67   81   99  114  126  136  145  152  156  161  164  167  170 
LCS_GDT     S    43_A     S    43_A     12   18   44      3    7   13   16   19   28   41   56   75   83  100  115  126  138  149  155  161  164  167  170 
LCS_GDT     D    44_A     D    44_A     12   18   44      4   10   12   15   18   20   34   37   41   50   68   82   98  113  119  131  147  155  161  167 
LCS_GDT     K    45_A     K    45_A     12   18   44      5   10   12   15   18   20   21   23   25   25   27   47   54   67   90  102  111  127  141  153 
LCS_GDT     L    46_A     L    46_A     12   18   24      5   10   12   15   16   20   21   23   25   36   43   55   70   88   99  115  126  138  151  158 
LCS_GDT     T    47_A     T    47_A     12   18   24      5   10   12   15   18   20   21   23   25   25   29   35   45   53   94  108  123  129  142  152 
LCS_GDT     D    48_A     D    48_A     12   18   24      5   10   12   15   18   20   21   23   25   25   26   29   32   40   48   55   66   81  108  114 
LCS_GDT     H    49_A     H    49_A     12   18   24      5   10   12   15   18   20   21   23   25   25   26   29   32   35   38   40   44   56   61   70 
LCS_GDT     L    50_A     L    50_A     12   18   24      5   10   12   15   18   20   21   23   25   25   26   29   32   35   38   40   44   50   63   74 
LCS_GDT     Q    51_A     Q    51_A     12   18   24      3   10   12   15   18   20   21   23   25   25   26   29   32   35   38   40   44   48   57   66 
LCS_GDT     R    52_A     R    52_A     12   18   24      4   10   12   15   18   20   21   23   25   25   26   29   31   35   38   40   44   48   51   55 
LCS_GDT     Y    53_A     Y    53_A     12   18   24      4   10   12   15   18   20   21   23   25   25   26   29   31   34   36   39   44   48   51   54 
LCS_GDT     L    54_A     L    54_A     12   18   24      3    4   12   15   18   20   21   23   25   25   26   29   31   34   36   39   44   48   51   54 
LCS_GDT     P    55_A     P    55_A     12   18   24      3    4   12   15   18   20   21   23   25   25   26   29   30   32   36   39   44   49   52   58 
LCS_GDT     N    56_A     N    56_A      3   18   24      3    8   12   15   18   20   21   23   25   25   26   29   30   32   36   41   44   49   52   66 
LCS_GDT     V    57_A     V    57_A      3   18   24      3    3    6    9   18   20   21   23   25   25   26   29   30   36   42   45   62   66   73   84 
LCS_GDT     A    58_A     A    58_A      3   18   24      3    3    3    8   11   19   21   23   25   25   26   30   37   44   55   76   88   96  106  114 
LCS_GDT     N    59_A     N    59_A      4    5   24      3    4    4    5    9   11   16   20   24   24   26   30   33   43   55   76   88   96  106  114 
LCS_GDT     A    60_A     A    60_A      4    5   24      3    4    4    6    8   10   12   14   19   23   26   28   41   55   65   81   89  109  119  128 
LCS_GDT     A    61_A     A    61_A      4    5   24      3    4    4    4    5    9   13   20   23   26   30   43   61   79   99  112  137  142  156  163 
LCS_GDT     Q    62_A     Q    62_A      4   11   25      3    4    4    6    7   10   12   20   28   35   42   58   74   87  100  122  137  145  156  163 
LCS_GDT     L    63_A     L    63_A     10   11   56      7    9   10   10   11   11   15   24   41   54   69   90  105  114  128  142  152  157  163  169 
LCS_GDT     T    64_A     T    64_A     10   11   57      3    9   10   10   11   17   46   54   71   87  101  113  128  138  147  155  161  164  167  170 
LCS_GDT     M    65_A     M    65_A     10   11   57      6    9   10   10   22   39   52   66   89  107  118  127  138  147  152  157  161  164  167  170 
LCS_GDT     G    66_A     G    66_A     10   11   57      7    9   10   10   12   15   18   21   23   32   41   66   85  112  133  141  148  159  167  170 
LCS_GDT     E    67_A     E    67_A     10   11   57      7    9   10   10   11   11   13   16   17   25   45   65   99  116  131  141  158  161  167  170 
LCS_GDT     K    68_A     K    68_A     10   11   60      7    9   10   14   24   40   57   77   94  107  118  127  138  147  152  157  161  164  167  170 
LCS_GDT     G    69_A     G    69_A     10   11   60      7    9   10   13   14   18   24   30   50   74   95  110  126  143  152  157  160  163  167  170 
LCS_GDT     C    70_A     C    70_A     10   11   60      7    9   10   10   11   11   12   16   19   20   22   26   36   63   86  112  138  155  162  167 
LCS_GDT     L    71_A     L    71_A     10   14   60      7    9   10   10   11   13   18   32   54   79  103  118  131  141  152  157  161  164  167  170 
LCS_GDT     M    72_A     M    72_A     12   15   60      4   10   15   24   35   52   72   84  100  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     S    73_A     S    73_A     12   15   60      5   10   12   19   28   42   59   75   90  102  118  125  136  147  152  157  161  164  167  170 
LCS_GDT     H    74_A     H    74_A     12   15   60      5   10   12   19   30   48   64   82   98  109  118  127  138  147  152  157  161  164  167  170 
LCS_GDT     F    75_A     F    75_A     12   15   60      5   10   14   26   43   61   72   90  103  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     M    76_A     M    76_A     12   15   60      5   10   14   26   38   49   64   80   94  107  118  127  136  147  152  157  161  164  167  170 
LCS_GDT     L    77_A     L    77_A     12   15   60      5   10   12   19   26   36   59   77   90  103  118  123  136  147  152  157  161  164  167  170 
LCS_GDT     W    78_A     W    78_A     12   15   60      5   10   12   13   17   45   64   77   94  107  118  127  138  147  152  157  161  164  167  170 
LCS_GDT     K    79_A     K    79_A     12   15   60      5   10   12   25   41   54   72   85  100  110  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     K    80_A     K    80_A     12   15   60      5   10   12   19   28   48   64   77   92  106  118  125  136  147  152  157  161  164  167  170 
LCS_GDT     C    81_A     C    81_A     12   15   60      5   10   12   13   17   23   31   62   86  100  113  123  133  144  152  157  161  164  167  170 
LCS_GDT     I    82_A     I    82_A     12   15   60      4   10   12   13   14   39   59   73   89  103  118  127  138  147  152  157  161  164  167  170 
LCS_GDT     D    83_A     D    83_A     12   17   60      6    9   20   31   44   58   72   91  104  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     E    84_A     E    84_A      8   17   60      3   13   22   33   45   59   73   91  104  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     N    85_A     N    85_A      8   17   60      3    7   22   30   47   58   70   86  104  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     L    86_A     L    86_A      8   17   60      3   13   22   35   50   59   74   92  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     D    87_A     D    87_A      8   17   60      6   13   22   35   50   61   82   97  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     Y    88_A     Y    88_A      9   18   60      6   16   29   42   51   67   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     I    89_A     I    89_A      9   18   60      4   13   28   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     T    90_A     T    90_A      9   18   60      5   13   28   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     L    91_A     L    91_A      9   18   60      5   13   28   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     F    92_A     F    92_A      9   18   60      5   16   29   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     E    93_A     E    93_A      9   18   60      4   16   29   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     D    94_A     D    94_A      9   18   60      4   16   29   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     D    95_A     D    95_A     11   18   60      6   16   29   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     I    96_A     I    96_A     11   18   60      6   16   29   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     L    97_A     L    97_A     11   18   60      5   12   17   36   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     L    98_A     L    98_A     11   18   60      5   12   17   29   46   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     G    99_A     G    99_A     11   18   60      5   12   17   29   46   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     E   100_A     E   100_A     11   18   60      4   12   16   19   33   54   70   89  100  113  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     N   101_A     N   101_A     11   18   60      4   12   17   26   45   65   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     A   102_A     A   102_A     11   18   60      4   12   17   28   45   65   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     N   103_A     N   103_A     11   18   60      5   14   16   29   45   65   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     K   104_A     K   104_A     11   18   60      4    8   16   29   45   63   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     F   105_A     F   105_A     11   18   60      5   14   17   29   45   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     L   106_A     L   106_A      8   18   60      4    7    8   21   31   57   82   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     A   107_A     A   107_A      5   13   60      3    5    8   10   12   19   43   52   72   85  108  121  130  141  151  156  161  164  167  170 
LCS_GDT     E   108_A     E   108_A      5   13   60      3    5    8   10   16   21   29   36   56   76   91  104  126  135  142  153  161  164  167  170 
LCS_GDT     G   109_A     G   109_A      5   13   60      5   11   15   21   39   53   68   84   98  111  118  126  138  147  152  157  161  164  167  170 
LCS_GDT     D   110_A     D   110_A      5   11   60      4   10   19   29   45   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     W   111_A     W   111_A      5   11   60      4    8   12   23   42   67   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     L   112_A     L   112_A      5   11   60      4    5    8   21   34   57   82   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     K   113_A     K   113_A      5   11   60      4   10   19   29   45   65   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     V   114_A     V   114_A      5   11   60      3    6   14   22   28   45   57   74   93  109  118  127  134  147  152  157  161  164  167  170 
LCS_GDT     R   115_A     R   115_A      5   11   60      3    5   11   17   31   50   76   92  104  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     F   116_A     F   116_A      5   11   60      2    5   13   27   46   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     N   117_A     N   117_A      5   11   60      4    9   19   29   45   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     F   118_A     F   118_A      5   11   60      5    7   12   16   29   41   59   68   80   95  106  120  132  142  150  156  161  164  167  170 
LCS_GDT     Q   119_A     Q   119_A      5    7   60      4    5    5    7    9   16   33   52   54   79   99  116  132  139  146  150  157  163  167  170 
LCS_GDT     E   120_A     E   120_A      5    8   60      4    5    5   10   25   44   60   74   95  110  119  127  138  147  152  157  161  164  167  170 
LCS_GDT     I   121_A     I   121_A      6    8   60      5    5    6    7    8   17   23   45   66   89  110  127  136  147  152  157  161  164  167  170 
LCS_GDT     F   122_A     F   122_A      6    8   60      5    5    6    7   12   18   33   45   66   95  110  127  136  147  152  157  161  164  167  170 
LCS_GDT     V   123_A     V   123_A      6    8   60      5    5    9   11   17   26   44   56   76   98  112  127  136  147  152  157  161  164  167  170 
LCS_GDT     L   124_A     L   124_A      6    8   60      5    5    9   13   18   24   44   60   78   95  112  127  136  147  152  157  161  164  167  170 
LCS_GDT     R   125_A     R   125_A      6    8   60      5    5   13   15   21   25   41   60   75   90  109  123  136  147  152  157  161  164  167  170 
LCS_GDT     L   126_A     L   126_A      6    8   60      3    5    6    7   18   27   39   53   66   89  110  126  136  147  152  157  161  164  167  170 
LCS_GDT     E   127_A     E   127_A      5    8   60      3    4   12   14   18   27   36   50   66   94  110  127  136  147  152  157  161  164  167  170 
LCS_GDT     T   128_A     T   128_A      5    8   60      3    4    5    6    8   19   39   45   72   92  110  127  136  144  152  157  161  164  167  170 
LCS_GDT     F   129_A     F   129_A      5    7   60      3    4    5    6    7    8    9   21   27   36   57   72   94  114  127  141  149  158  164  168 
LCS_GDT     L   130_A     L   130_A      5    7   60      3    4    5    6    9   11   24   29   45   59   80  104  119  139  141  148  155  163  167  170 
LCS_GDT     M   131_A     M   131_A      5    8   60      3    4    6    7    9   11   24   29   35   50   57   75  106  119  126  137  144  152  158  167 
LCS_GDT     P   132_A     P   132_A      4    8   46      3    6   12   14   18   21   24   32   38   54   74   98  110  119  126  138  144  151  158  163 
LCS_GDT     V   133_A     V   133_A      4    8   46      3    3    4    8   14   22   27   36   52   72   85  106  117  126  132  139  148  158  162  165 
LCS_GDT     Q   134_A     Q   134_A      4    8   16      3    3    6    7    9   11   14   21   33   62   97  123  129  137  147  153  157  161  164  170 
LCS_GDT     L   135_A     L   135_A      4    8   17      3    4    6    7    9   11   17   19   23   36   42   46   64   79   97  106  123  132  140  146 
LCS_GDT     E   136_A     E   136_A      4    8   21      3    4    5    7    9   11   14   16   20   25   30   33   43   57   69   80   88   98  112  119 
LCS_GDT     K   137_A     K   137_A      3    8   21      3    4    6    7    7   11   14   16   17   18   20   26   32   42   51   56   64   69   79  102 
LCS_GDT     Q   138_A     Q   138_A      3    8   21      3    3    6    7    9   11   14   16   19   22   24   26   27   29   33   38   41   47   52   58 
LCS_GDT     T   139_A     T   139_A      3    8   21      3    3    5    7    9   11   14   16   19   22   24   26   27   29   33   34   38   48   52   58 
LCS_GDT     Q   140_A     Q   140_A      4    8   21      3    4    5    7    9   11   14   16   17   22   24   26   27   29   33   34   38   41   47   51 
LCS_GDT     I   141_A     I   141_A      4    6   21      3    4    4    5    6    9   12   16   17   22   24   26   27   29   33   34   37   41   47   51 
LCS_GDT     P   142_A     P   142_A      4    7   21      3    4    4    5    7   11   14   16   18   22   24   26   27   29   33   34   37   41   47   52 
LCS_GDT     P   143_A     P   143_A      4    7   21      3    4    4    5    7   11   12   15   19   22   24   26   27   29   33   40   43   49   52   61 
LCS_GDT     F   144_A     F   144_A      4    7   21      3    4    5    6    9   11   13   15   19   22   24   26   27   29   33   34   38   42   48   54 
LCS_GDT     Q   145_A     Q   145_A      3    7   21      3    3    5    6    9   11   13   15   19   22   24   26   27   29   33   34   38   42   47   52 
LCS_GDT     Q   146_A     Q   146_A      3    7   21      3    3    4    6    9   11   13   15   19   22   24   26   27   29   33   34   38   41   47   51 
LCS_GDT     R   147_A     R   147_A      4    7   21      3    4    4    6    9   11   13   15   19   22   24   26   27   29   33   34   38   42   47   52 
LCS_GDT     D   148_A     D   148_A      4    7   21      3    4    5    6    9   11   13   15   19   22   24   26   27   29   33   34   38   42   47   52 
LCS_GDT     I   149_A     I   149_A      4    6   21      3    4    4    5    7    9   11   15   19   22   24   26   27   29   33   34   38   42   49   58 
LCS_GDT     D   150_A     D   150_A      4    6   21      3    4    4    6    9   11   13   15   19   22   24   26   29   31   34   41   43   57   62   71 
LCS_GDT     I   151_A     I   151_A      4    6   21      3    5    5    5    7   11   13   15   19   22   24   26   29   35   39   46   53   67   83   95 
LCS_GDT     L   152_A     L   152_A      4    6   28      3    5    5    6    9   11   13   15   19   22   24   27   34   42   51   70   95  103  123  131 
LCS_GDT     T   153_A     T   153_A      4    6   67      3    5    5    5    7   11   13   15   20   24   27   44   65   93  105  111  122  136  142  149 
LCS_GDT     S   154_A     S   154_A      4    6   69      3    5    5    5    8   18   24   45   65   90  101  116  123  134  145  154  156  161  165  169 
LCS_GDT     K   155_A     K   155_A      3   23   69      3    3    9   27   38   50   68   90  102  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     H   156_A     H   156_A      3   23   69      3    3   18   27   38   50   71   90  102  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     F   157_A     F   157_A      3   23   69      3    3    9   17   38   50   68   90  102  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     G   158_A     G   158_A     10   23   69      6   16   29   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     T   159_A     T   159_A     10   23   69      5   16   29   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     A   160_A     A   160_A     10   23   69      5    8   20   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     G   161_A     G   161_A     11   23   69      5   12   20   30   47   67   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     Y   162_A     Y   162_A     13   23   69      4   13   29   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     V   163_A     V   163_A     14   23   69      6   16   29   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     I   164_A     I   164_A     14   23   69      6   15   29   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     S   165_A     S   165_A     14   23   69      6   16   29   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     Q   166_A     Q   166_A     14   23   69      6   16   29   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     G   167_A     G   167_A     14   23   69      5   12   22   35   51   63   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     A   168_A     A   168_A     14   23   69      6   13   29   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     A   169_A     A   169_A     14   23   69      4   13   29   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     K   170_A     K   170_A     14   23   69      6   13   29   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     Y   171_A     Y   171_A     14   23   69      6   13   22   30   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     L   172_A     L   172_A     14   23   69      6   13   22   28   48   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     I   173_A     I   173_A     14   23   69      6   13   22   31   48   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     A   174_A     A   174_A     14   23   69      6   13   22   28   46   65   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     L   175_A     L   175_A     14   23   69      4   11   21   27   34   60   81   95  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     F   176_A     F   176_A     14   23   69      6   13   22   28   45   63   81   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     E   177_A     E   177_A     13   23   69      4    8   17   36   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     K   178_A     K   178_A      4    5   69      3    3    6   10   19   36   53   70   86  104  118  127  138  147  152  157  161  164  167  170 
LCS_GDT     L   179_A     L   179_A      4    5   69      2    3    4    4    4    5   14   18   22   34   48   61   96  120  139  149  155  163  167  170 
LCS_GDT     T   180_A     T   180_A      3    5   69      1    3    4    4    6    6    7    8   10   13   16   19   27   36   68   75  105  148  157  167 
LCS_GDT     T   181_A     T   181_A      3    5   69      3    3    3    4    6    6    8   15   21   36   59   92  124  135  142  152  157  164  167  170 
LCS_GDT     E   182_A     E   182_A      3    5   69      3    3    4    4    6    6   18   26   35   49   63   82  108  128  144  153  161  164  167  170 
LCS_GDT     E   183_A     E   183_A      3   11   69      3    3    4   11   18   29   55   71   88  105  117  127  138  147  152  157  161  164  167  170 
LCS_GDT     I   184_A     I   184_A      3   11   69      3    3    6   21   28   46   56   75   98  107  118  127  138  147  152  157  161  164  167  170 
LCS_GDT     K   185_A     K   185_A      3   11   69      1    8   12   21   30   46   60   83   99  110  118  127  138  147  152  157  161  164  167  170 
LCS_GDT     P   186_A     P   186_A      8   12   69      5    9   18   33   50   62   85   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     I   187_A     I   187_A      8   12   69      5   12   20   38   50   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     D   188_A     D   188_A      8   12   69      5   10   20   40   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     E   189_A     E   189_A      8   12   69      5    8   20   39   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     I   190_A     I   190_A      8   12   69      5   11   20   40   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     M   191_A     M   191_A      8   12   69      4    7   15   28   47   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     F   192_A     F   192_A      8   12   69      4    7   13   26   42   65   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     N   193_A     N   193_A      8   12   69      4    5   10   17   25   50   81   95  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     Q   194_A     Q   194_A      6   15   69      4    5    7   13   22   39   56   81   96  107  118  127  138  147  152  157  161  164  167  170 
LCS_GDT     Q   195_A     Q   195_A      6   15   69      4    5    9   14   18   36   56   75   96  107  119  127  138  147  152  157  161  164  167  170 
LCS_GDT     I   196_A     I   196_A      6   15   69      4    6    9   18   25   50   62   83  102  113  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     N   197_A     N   197_A      4   15   69      3    3    7   13   18   31   53   67   82  107  117  127  138  147  152  157  161  164  167  170 
LCS_GDT     A   198_A     A   198_A      4   18   69      3    5   11   27   47   61   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     T   199_A     T   199_A      4   18   69      3   12   28   42   51   63   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     D   200_A     D   200_A      7   18   69      3   11   18   38   51   67   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     Y   201_A     Y   201_A      8   18   69      5   16   29   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     R   202_A     R   202_A      8   18   69      6   16   29   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     V   203_A     V   203_A      8   18   69      5   16   29   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     Y   204_A     Y   204_A      8   18   69      3   11   29   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     Q   205_A     Q   205_A      8   18   69      5   13   29   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     L   206_A     L   206_A      8   18   69      5   11   29   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     N   207_A     N   207_A      8   18   69      5   15   29   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     P   208_A     P   208_A      8   18   69      3   10   28   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     A   209_A     A   209_A      6   18   69      5   12   19   35   51   65   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     I   210_A     I   210_A      6   18   69      6   16   29   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     C   211_A     C   211_A      6   18   69      5   16   29   42   51   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     V   212_A     V   212_A      6   18   69      5   12   20   37   50   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     Q   213_A     Q   213_A      6   18   69      5   10   19   33   50   65   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     E   214_A     E   214_A      6   18   69      3    6   14   29   46   62   89   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     L   215_A     L   215_A      4   18   69      3    9   18   34   50   68   90   98  105  116  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     Q   216_A     Q   216_A      3    5   69      3    3    3    5   10   13   18   31   64   86  107  118  136  139  146  155  161  164  167  170 
LCS_GDT     L   217_A     L   217_A      3    5   69      3    3   12   12   14   18   22   23   26   44   63   75  106  129  141  150  158  163  167  170 
LCS_GDT     N   218_A     N   218_A      3    5   69      3    5    8   10   14   18   24   34   51   68   84  107  126  136  143  154  160  164  167  170 
LCS_GDT     Q   219_A     Q   219_A      3    5   69      3    3    6   15   27   46   71   94  103  111  120  127  138  147  152  157  161  164  167  170 
LCS_GDT     E   220_A     E   220_A      3    4   69      3    3    5    9   21   33   49   72   86  103  116  126  136  145  152  157  161  164  167  170 
LCS_GDT     A   221_A     A   221_A      3    3   69      3    3    4   16   19   33   43   65   81   99  108  116  127  140  150  157  161  164  167  170 
LCS_GDT     S   222_A     S   222_A      4    5   69      3    4    4    5    7   10   24   28   35   38   53   97  109  122  124  137  146  155  160  168 
LCS_GDT     L   223_A     L   223_A      4    5   69      3    4    4    5    6   11   13   16   16   23   34   54   83  103  116  127  131  143  156  166 
LCS_GDT     L   224_A     L   224_A      4    5   39      3    4    4    5    6    8   14   16   17   18   20   28   44   51   63  100  113  119  128  141 
LCS_GDT     V   225_A     V   225_A      4    5   15      3    4    4    7    8   11   14   16   17   18   20   20   25   44   50   66   82   90  110  127 
LCS_GDT     S   226_A     S   226_A      4    5   15      3    3    4    4    4    5    7    9   17   21   26   36   44   51   63  100  111  120  132  142 
LCS_GDT     N   227_A     N   227_A      4    4   15      3    3    4    4    4    8    9    9   17   19   26   33   39   44   50   79   89   98  114  118 
LCS_GDT     L   228_A     L   228_A      4    4   15      3    3    4    4    5   10   12   12   14   17   24   33   39   44   66   71   79   83   94  109 
LCS_GDT     E   229_A     E   229_A      3    3   15      3    3    3    3    5    8    8    9   10   15   18   24   28   37   43   46   67   70   77   85 
LCS_GDT     Q   230_A     Q   230_A      3    3   15      1    3    3    3    4    8    8   11   14   17   19   25   30   44   52   60   67   70   81   93 
LCS_GDT     E   231_A     E   231_A      3    6   15      1    3    3    5    5    6    7    9   11   17   19   25   29   35   40   42   67   70   77   80 
LCS_GDT     R   232_A     R   232_A      4    6   15      3    4    4    5    5    6    7    8   10   15   18   24   28   32   38   40   46   49   54   60 
LCS_GDT     K   233_A     K   233_A      4    6   15      3    4    4    5    5    6    7    9   11   15   18   21   25   28   38   40   44   47   54   57 
LCS_GDT     I   234_A     I   234_A      4    6   15      3    4    4    5    5    6    7    9   11   15   18   21   25   32   38   40   44   47   53   56 
LCS_GDT     N   235_A     N   235_A      4    6   15      3    4    4    5    5    6    7    9   10   15   18   20   25   28   29   32   36   41   47   51 
LCS_GDT     L   236_A     L   236_A      3    6   13      3    3    3    4    4    6    6    9   11   15   20   20   25   28   29   31   33   36   37   39 
LCS_GDT     K   237_A     K   237_A      3    4   13      3    3    3    4    4    7    9   14   17   18   20   20   23   26   29   30   33   36   37   39 
LCS_GDT     Y   238_A     Y   238_A      3    4   12      3    3    3    4    8   10   12   14   17   18   20   20   22   26   29   30   31   36   37   39 
LCS_GDT     E   239_A     E   239_A      3    3   12      3    3    3    3    4    6    6    8    9   14   14   16   19   20   22   23   29   30   34   35 
LCS_GDT     K   240_A     K   240_A      3    3   12      3    3    3    3    4    4    5    8    8    9    9   11   11   12   12   13   13   13   14   16 
LCS_AVERAGE  LCS_A:  10.02  (   3.21    5.62   21.22 )

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     16     29     42     51     68     90     98    105    116    120    127    138    147    152    157    161    164    167    170 
GDT PERCENT_AT   3.35   6.69  12.13  17.57  21.34  28.45  37.66  41.00  43.93  48.54  50.21  53.14  57.74  61.51  63.60  65.69  67.36  68.62  69.87  71.13
GDT RMS_LOCAL    0.20   0.74   1.19   1.44   1.67   2.27   2.55   2.67   2.82   3.15   3.26   3.52   3.86   4.14   4.29   4.48   4.70   4.81   4.91   5.07
GDT RMS_ALL_AT  19.87  16.70  16.64  16.74  16.56  16.59  16.53  16.55  16.52  16.60  16.60  16.51  16.46  16.62  16.58  16.59  16.52  16.50  16.56  16.60

# Checking swapping
#   possible swapping detected:  E     5_A      E     5_A
#   possible swapping detected:  F    27_A      F    27_A
#   possible swapping detected:  F    34_A      F    34_A
#   possible swapping detected:  F    40_A      F    40_A
#   possible swapping detected:  D    48_A      D    48_A
#   possible swapping detected:  E    84_A      E    84_A
#   possible swapping detected:  F    92_A      F    92_A
#   possible swapping detected:  E    93_A      E    93_A
#   possible swapping detected:  E   100_A      E   100_A
#   possible swapping detected:  F   105_A      F   105_A
#   possible swapping detected:  F   116_A      F   116_A
#   possible swapping detected:  F   118_A      F   118_A
#   possible swapping detected:  E   120_A      E   120_A
#   possible swapping detected:  E   127_A      E   127_A
#   possible swapping detected:  F   129_A      F   129_A
#   possible swapping detected:  F   144_A      F   144_A
#   possible swapping detected:  D   148_A      D   148_A
#   possible swapping detected:  D   150_A      D   150_A
#   possible swapping detected:  F   157_A      F   157_A
#   possible swapping detected:  Y   162_A      Y   162_A
#   possible swapping detected:  F   176_A      F   176_A
#   possible swapping detected:  E   182_A      E   182_A
#   possible swapping detected:  E   189_A      E   189_A
#   possible swapping detected:  D   200_A      D   200_A
#   possible swapping detected:  Y   201_A      Y   201_A
#   possible swapping detected:  Y   204_A      Y   204_A
#   possible swapping detected:  E   231_A      E   231_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    N     2_A      N     2_A     6.649     0    0.258   0.817    11.356   17.381   10.060
LGA    S     3_A      S     3_A     4.358     0    0.049   0.486     5.215   39.167   38.571
LGA    T     4_A      T     4_A     2.727     0    0.695   1.373     4.326   51.905   55.850
LGA    E     5_A      E     5_A     4.999     0    0.047   1.117    12.825   38.810   19.048
LGA    N     6_A      N     6_A     2.929     0    0.045   0.721     4.523   55.595   52.321
LGA    K     7_A      K     7_A     0.933     0    0.679   1.186     4.745   78.095   58.677
LGA    N     8_A      N     8_A     3.075     0    0.201   1.234    10.125   57.738   33.571
LGA    F     9_A      F     9_A     1.087     0    0.090   1.399     8.225   75.357   40.736
LGA    V    10_A      V    10_A     3.742     0    0.138   1.076     8.458   50.595   32.517
LGA    I    11_A      I    11_A     1.046     0    0.069   1.399     6.421   79.881   54.107
LGA    S    12_A      S    12_A     3.240     0    0.061   0.066     7.341   49.048   37.222
LGA    I    13_A      I    13_A     2.615     0    0.047   0.834     4.961   47.619   47.679
LGA    S    14_A      S    14_A     8.547     0    0.623   0.806    11.368    7.976    5.317
LGA    T    15_A      T    15_A     7.415     0    0.434   0.476     8.131    9.405    7.755
LGA    A    16_A      A    16_A     5.338     0    0.218   0.212     5.788   30.595   29.714
LGA    E    17_A      E    17_A     4.660     0    0.059   0.683     6.444   36.071   27.619
LGA    Q    18_A      Q    18_A     3.210     0    0.074   0.976     7.163   50.119   38.095
LGA    R    19_A      R    19_A     3.422     0    0.075   1.910     9.927   51.786   30.779
LGA    R    20_A      R    20_A     3.508     0    0.073   1.684     6.424   51.905   40.779
LGA    N    21_A      N    21_A     2.186     0    0.073   1.058     3.988   66.905   59.524
LGA    H    22_A      H    22_A     1.370     0    0.047   0.718     4.670   79.286   61.619
LGA    I    23_A      I    23_A     2.209     0    0.102   1.133     3.845   64.881   62.202
LGA    I    24_A      I    24_A     2.874     0    0.072   0.993     3.874   59.048   60.298
LGA    E    25_A      E    25_A     2.306     0    0.055   0.774     3.046   59.167   62.381
LGA    Q    26_A      Q    26_A     2.624     0    0.116   1.178     5.818   53.810   43.757
LGA    F    27_A      F    27_A     3.085     0    0.052   1.205     6.512   50.119   39.437
LGA    T    28_A      T    28_A     2.793     0    0.540   1.265     3.689   57.262   56.327
LGA    H    29_A      H    29_A     5.601     0    0.181   1.508    14.024   31.786   13.714
LGA    Q    30_A      Q    30_A     3.069     0    0.570   1.137     7.568   46.786   39.894
LGA    N    31_A      N    31_A     3.661     0    0.060   0.985     6.149   48.333   38.810
LGA    I    32_A      I    32_A     2.819     0    0.040   1.282     6.298   55.357   48.333
LGA    P    33_A      P    33_A     3.058     0    0.137   0.378     3.074   55.357   55.102
LGA    F    34_A      F    34_A     2.870     0    0.059   1.167     7.964   55.357   37.576
LGA    E    35_A      E    35_A     3.183     0    0.096   0.596     6.500   53.571   40.952
LGA    F    36_A      F    36_A     2.828     0    0.270   0.912     3.718   65.000   60.216
LGA    F    37_A      F    37_A     1.945     0    0.030   1.056     6.452   64.881   47.835
LGA    D    38_A      D    38_A     3.353     0    0.039   0.117     7.408   51.905   36.488
LGA    A    39_A      A    39_A     2.237     0    0.054   0.080     3.339   57.381   58.857
LGA    F    40_A      F    40_A     6.107     0    0.076   1.303    13.069   25.238    9.437
LGA    T    41_A      T    41_A     3.843     0    0.620   1.426     6.129   28.333   35.986
LGA    P    42_A      P    42_A     9.575     0    0.276   0.330    10.729    2.381    2.381
LGA    S    43_A      S    43_A    12.037     0    0.085   0.731    15.976    0.000    0.238
LGA    D    44_A      D    44_A    18.003     0    0.293   1.088    20.557    0.000    0.000
LGA    K    45_A      K    45_A    21.054     0    0.051   0.987    26.081    0.000    0.000
LGA    L    46_A      L    46_A    19.220     0    0.125   1.015    21.682    0.000    0.000
LGA    T    47_A      T    47_A    21.285     0    0.032   0.439    24.776    0.000    0.000
LGA    D    48_A      D    48_A    25.679     0    0.191   0.998    28.662    0.000    0.000
LGA    H    49_A      H    49_A    26.953     0    0.083   0.219    28.561    0.000    0.000
LGA    L    50_A      L    50_A    25.878     0    0.172   0.779    28.490    0.000    0.000
LGA    Q    51_A      Q    51_A    29.643     0    0.144   0.690    32.469    0.000    0.000
LGA    R    52_A      R    52_A    32.594     0    0.122   1.086    38.248    0.000    0.000
LGA    Y    53_A      Y    53_A    32.176     0    0.095   0.992    34.079    0.000    0.000
LGA    L    54_A      L    54_A    31.484     0    0.307   1.362    31.484    0.000    0.000
LGA    P    55_A      P    55_A    32.628     0    0.583   0.569    35.869    0.000    0.000
LGA    N    56_A      N    56_A    31.138     0    0.578   0.732    31.686    0.000    0.000
LGA    V    57_A      V    57_A    25.259     0    0.613   0.916    26.920    0.000    0.000
LGA    A    58_A      A    58_A    22.098     0    0.603   0.602    23.201    0.000    0.000
LGA    N    59_A      N    59_A    22.704     0    0.588   1.036    22.796    0.000    0.000
LGA    A    60_A      A    60_A    22.017     0    0.196   0.237    22.603    0.000    0.000
LGA    A    61_A      A    61_A    18.057     0    0.694   0.631    19.851    0.000    0.000
LGA    Q    62_A      Q    62_A    18.792     0    0.714   1.236    19.302    0.000    0.000
LGA    L    63_A      L    63_A    15.695     0    0.152   1.431    20.708    0.000    0.000
LGA    T    64_A      T    64_A    10.922     0    0.040   1.137    12.929    0.714    0.408
LGA    M    65_A      M    65_A     7.684     0    0.051   0.989    12.422    6.548    4.345
LGA    G    66_A      G    66_A    10.259     0    0.054   0.054    10.896    0.714    0.714
LGA    E    67_A      E    67_A    11.157     0    0.057   1.045    17.794    0.476    0.212
LGA    K    68_A      K    68_A     7.515     0    0.070   1.335    10.148    7.976    6.085
LGA    G    69_A      G    69_A     9.112     0    0.055   0.055    11.088    2.143    2.143
LGA    C    70_A      C    70_A    11.920     0    0.080   0.855    16.291    0.000    0.000
LGA    L    71_A      L    71_A     8.611     0    0.570   1.449    11.809    2.976    2.321
LGA    M    72_A      M    72_A     6.063     0    0.192   1.185     8.161   14.167   19.643
LGA    S    73_A      S    73_A     7.478     0    0.265   0.677     7.888   10.833   10.635
LGA    H    74_A      H    74_A     6.879     0    0.037   1.302     6.881   13.333   30.048
LGA    F    75_A      F    75_A     6.025     0    0.075   0.519     6.468   17.143   23.030
LGA    M    76_A      M    76_A     7.495     0    0.046   0.978     8.055    9.405   10.893
LGA    L    77_A      L    77_A     8.364     0    0.099   0.316    10.449    5.357    3.810
LGA    W    78_A      W    78_A     7.749     0    0.035   1.199     7.749    7.857   36.803
LGA    K    79_A      K    79_A     6.878     0    0.033   0.922     7.239   10.833   16.243
LGA    K    80_A      K    80_A     8.346     0    0.041   1.173    14.310    4.405    2.275
LGA    C    81_A      C    81_A     9.605     0    0.048   0.137    11.119    1.310    0.873
LGA    I    82_A      I    82_A     8.306     0    0.517   0.516     9.616    4.881    4.048
LGA    D    83_A      D    83_A     6.129     0    0.480   0.431     7.502   13.690   20.000
LGA    E    84_A      E    84_A     5.794     0    0.690   0.984     5.945   21.429   23.598
LGA    N    85_A      N    85_A     6.206     0    0.448   1.104    11.947   21.548   11.667
LGA    L    86_A      L    86_A     5.331     0    0.088   1.056     5.713   25.000   31.369
LGA    D    87_A      D    87_A     4.648     0    0.032   0.927     6.837   35.833   30.179
LGA    Y    88_A      Y    88_A     2.983     0    0.093   1.445     4.147   50.238   60.675
LGA    I    89_A      I    89_A     2.307     0    0.090   1.353     3.471   66.786   61.131
LGA    T    90_A      T    90_A     2.388     0    0.234   1.027     4.755   62.857   60.204
LGA    L    91_A      L    91_A     2.436     0    0.051   1.237     7.635   64.762   46.369
LGA    F    92_A      F    92_A     1.954     0    0.040   0.163     2.417   66.786   68.442
LGA    E    93_A      E    93_A     1.986     0    0.038   0.486     4.052   68.810   60.212
LGA    D    94_A      D    94_A     2.270     0    0.204   0.931     2.892   68.810   69.940
LGA    D    95_A      D    95_A     1.818     0    0.272   1.145     4.902   70.833   61.845
LGA    I    96_A      I    96_A     1.621     0    0.091   1.253     5.359   75.000   64.464
LGA    L    97_A      L    97_A     1.789     0    0.073   1.000     4.949   77.143   60.655
LGA    L    98_A      L    98_A     2.362     0    0.041   1.396     5.118   57.500   52.560
LGA    G    99_A      G    99_A     2.767     0    0.170   0.170     4.359   50.595   50.595
LGA    E   100_A      E   100_A     4.787     0    0.080   0.749     6.846   35.833   29.683
LGA    N   101_A      N   101_A     3.189     0    0.036   0.273     3.653   48.333   49.226
LGA    A   102_A      A   102_A     3.106     0    0.062   0.074     3.617   50.000   48.667
LGA    N   103_A      N   103_A     3.339     0    0.108   1.287     4.962   53.571   46.964
LGA    K   104_A      K   104_A     3.172     0    0.080   0.885     6.522   50.119   35.291
LGA    F   105_A      F   105_A     3.031     0    0.107   0.292     5.330   51.786   42.251
LGA    L   106_A      L   106_A     3.869     0    0.063   1.066     6.535   34.167   36.131
LGA    A   107_A      A   107_A     7.407     0    0.110   0.129     9.378    9.405    8.952
LGA    E   108_A      E   108_A     8.840     0    0.608   1.335    10.012    5.476    4.074
LGA    G   109_A      G   109_A     5.500     0    0.381   0.381     6.637   27.262   27.262
LGA    D   110_A      D   110_A     3.011     0    0.030   0.554     5.570   55.714   46.845
LGA    W   111_A      W   111_A     3.016     0    0.088   1.106     8.056   52.024   30.204
LGA    L   112_A      L   112_A     3.650     0    0.557   1.302     9.211   57.738   37.143
LGA    K   113_A      K   113_A     3.195     0    0.314   1.119     4.433   43.571   52.063
LGA    V   114_A      V   114_A     7.427     0    0.104   0.129    10.312   14.643    8.776
LGA    R   115_A      R   115_A     5.175     0    0.189   1.147    14.575   33.214   15.065
LGA    F   116_A      F   116_A     2.091     0    0.239   0.378     7.500   59.405   37.879
LGA    N   117_A      N   117_A     2.585     0    0.601   1.041     3.550   57.619   67.440
LGA    F   118_A      F   118_A     7.504     0    0.239   0.281    13.556   10.119    3.680
LGA    Q   119_A      Q   119_A     9.673     0    0.347   0.836    17.246    2.619    1.164
LGA    E   120_A      E   120_A     5.821     0    0.626   1.328     8.054   17.262   15.079
LGA    I   121_A      I   121_A     7.749     0    0.416   0.416     9.941    8.690    5.298
LGA    F   122_A      F   122_A     7.636     0    0.053   1.286     7.955    7.857   14.545
LGA    V   123_A      V   123_A     7.233     0    0.031   1.082     8.705    8.571   12.517
LGA    L   124_A      L   124_A     7.425     0    0.242   1.011     8.511   10.000    7.798
LGA    R   125_A      R   125_A     7.788     0    0.077   0.721    15.413    8.571    3.377
LGA    L   126_A      L   126_A     7.535     0    0.669   1.392    12.432    7.857    4.286
LGA    E   127_A      E   127_A     7.705     0    0.059   0.377    12.670    6.071    3.175
LGA    T   128_A      T   128_A     8.530     0    0.064   0.917    10.120    2.500    6.803
LGA    F   129_A      F   129_A    13.303     0    0.038   1.267    20.898    0.000    0.000
LGA    L   130_A      L   130_A    11.701     0    0.206   1.372    14.960    0.000    0.238
LGA    M   131_A      M   131_A    14.850     0    0.582   0.521    16.365    0.000    0.000
LGA    P   132_A      P   132_A    15.392     0    0.171   0.454    16.345    0.000    0.000
LGA    V   133_A      V   133_A    14.133     0    0.032   0.078    18.627    0.000    0.000
LGA    Q   134_A      Q   134_A    10.954     0    0.211   1.019    14.839    0.000    3.492
LGA    L   135_A      L   135_A    17.091     0    0.036   0.998    18.562    0.000    0.000
LGA    E   136_A      E   136_A    21.956     0    0.282   1.059    25.698    0.000    0.000
LGA    K   137_A      K   137_A    25.255     0    0.530   1.420    27.402    0.000    0.000
LGA    Q   138_A      Q   138_A    31.699     0    0.502   1.133    35.483    0.000    0.000
LGA    T   139_A      T   139_A    37.434     0    0.039   1.128    41.578    0.000    0.000
LGA    Q   140_A      Q   140_A    40.765     0    0.481   0.545    41.120    0.000    0.000
LGA    I   141_A      I   141_A    41.225     0    0.288   1.519    44.732    0.000    0.000
LGA    P   142_A      P   142_A    43.275     0    0.138   0.398    44.514    0.000    0.000
LGA    P   143_A      P   143_A    44.254     0    0.141   0.432    47.088    0.000    0.000
LGA    F   144_A      F   144_A    48.466     0    0.147   1.347    54.184    0.000    0.000
LGA    Q   145_A      Q   145_A    52.094     0    0.077   1.134    57.694    0.000    0.000
LGA    Q   146_A      Q   146_A    50.140     0    0.548   1.218    54.825    0.000    0.000
LGA    R   147_A      R   147_A    44.340     0    0.110   0.710    49.451    0.000    0.000
LGA    D   148_A      D   148_A    39.941     0    0.375   1.097    43.437    0.000    0.000
LGA    I   149_A      I   149_A    35.615     0    0.044   1.657    38.387    0.000    0.000
LGA    D   150_A      D   150_A    29.810     0    0.053   1.126    31.960    0.000    0.000
LGA    I   151_A      I   151_A    27.155     0    0.384   1.313    28.368    0.000    0.000
LGA    L   152_A      L   152_A    20.353     0    0.044   1.408    22.730    0.000    0.000
LGA    T   153_A      T   153_A    16.124     0    0.671   1.494    17.821    0.000    0.000
LGA    S   154_A      S   154_A     9.223     0    0.366   0.581    11.957    4.643    6.111
LGA    K   155_A      K   155_A     6.015     0    0.659   1.605    10.305   20.000   11.640
LGA    H   156_A      H   156_A     5.924     0    0.528   0.748     7.268   18.333   15.857
LGA    F   157_A      F   157_A     5.738     0    0.290   1.327    12.477   34.048   13.203
LGA    G   158_A      G   158_A     1.415     0    0.668   0.668     2.233   77.262   77.262
LGA    T   159_A      T   159_A     1.328     0    0.236   0.250     2.524   73.214   70.748
LGA    A   160_A      A   160_A     1.779     0    0.599   0.566     3.869   65.595   67.048
LGA    G   161_A      G   161_A     2.968     0    0.548   0.548     2.968   62.857   62.857
LGA    Y   162_A      Y   162_A     1.427     0    0.054   0.451     2.181   77.143   80.913
LGA    V   163_A      V   163_A     1.495     0    0.048   0.999     2.928   79.286   71.973
LGA    I   164_A      I   164_A     1.658     0    0.128   1.107     3.804   75.000   69.226
LGA    S   165_A      S   165_A     2.439     0    0.037   0.526     4.969   68.810   59.444
LGA    Q   166_A      Q   166_A     2.780     0    0.600   0.550     5.594   55.357   43.016
LGA    G   167_A      G   167_A     3.510     0    0.085   0.085     3.510   53.810   53.810
LGA    A   168_A      A   168_A     1.769     0    0.088   0.087     2.356   75.119   74.667
LGA    A   169_A      A   169_A     0.548     0    0.094   0.110     1.526   90.476   86.952
LGA    K   170_A      K   170_A     1.562     0    0.087   0.859     7.290   72.976   54.127
LGA    Y   171_A      Y   171_A     2.757     0    0.124   1.539    13.123   59.048   28.056
LGA    L   172_A      L   172_A     2.483     0    0.046   1.127     4.749   60.952   58.690
LGA    I   173_A      I   173_A     2.102     0    0.105   0.207     3.271   59.167   71.429
LGA    A   174_A      A   174_A     3.285     0    0.073   0.094     4.377   46.905   47.524
LGA    L   175_A      L   175_A     4.258     0    0.056   0.755     7.245   37.262   28.155
LGA    F   176_A      F   176_A     3.894     0    0.040   0.332     7.674   45.000   28.918
LGA    E   177_A      E   177_A     2.753     0    0.202   1.203     7.038   48.690   42.434
LGA    K   178_A      K   178_A     7.097     0    0.586   1.028     9.306   11.429    9.735
LGA    L   179_A      L   179_A    11.234     0    0.554   0.560    13.443    0.357    0.179
LGA    T   180_A      T   180_A    12.813     0    0.450   1.044    16.731    0.000    0.000
LGA    T   181_A      T   181_A     9.264     0    0.678   0.556    11.292    0.476    1.020
LGA    E   182_A      E   182_A    11.309     0    0.053   0.358    12.965    0.119    0.106
LGA    E   183_A      E   183_A     7.860     0    0.668   0.902     8.835    5.476    5.397
LGA    I   184_A      I   184_A     7.849     0    0.477   0.836     8.861    7.143    5.476
LGA    K   185_A      K   185_A     7.299     0    0.579   1.002    14.204   11.071    5.503
LGA    P   186_A      P   186_A     4.196     0    0.369   0.396     4.651   49.048   44.014
LGA    I   187_A      I   187_A     2.762     0    0.052   0.252     5.080   61.190   53.631
LGA    D   188_A      D   188_A     1.571     0    0.072   0.539     2.870   72.976   68.929
LGA    E   189_A      E   189_A     2.438     0    0.268   0.991     5.648   61.429   50.000
LGA    I   190_A      I   190_A     1.612     0    0.107   0.644     3.540   69.048   63.274
LGA    M   191_A      M   191_A     2.946     0    0.054   0.591     3.713   53.810   54.643
LGA    F   192_A      F   192_A     3.325     0    0.052   0.981     4.956   43.929   57.316
LGA    N   193_A      N   193_A     4.570     0    0.203   0.555     6.681   30.595   26.250
LGA    Q   194_A      Q   194_A     6.447     0    0.057   1.051    10.768   14.762    9.312
LGA    Q   195_A      Q   195_A     6.651     0    0.552   1.274    12.418   17.262   10.476
LGA    I   196_A      I   196_A     5.708     0    0.316   0.840     7.939   14.762   22.798
LGA    N   197_A      N   197_A     7.531     0    0.312   1.184     9.415   12.143    7.143
LGA    A   198_A      A   198_A     3.630     0    0.338   0.352     4.567   38.810   41.048
LGA    T   199_A      T   199_A     3.677     0    0.667   0.955     5.587   48.452   38.980
LGA    D   200_A      D   200_A     2.847     0    0.170   1.210     4.357   60.952   50.595
LGA    Y   201_A      Y   201_A     2.606     0    0.111   1.402     9.255   62.857   36.389
LGA    R   202_A      R   202_A     1.663     0    0.086   1.107     3.895   70.833   66.623
LGA    V   203_A      V   203_A     2.096     0    0.056   1.130     3.931   66.786   62.925
LGA    Y   204_A      Y   204_A     2.279     0    0.134   0.245     3.184   59.167   67.024
LGA    Q   205_A      Q   205_A     2.081     0    0.180   1.106     5.335   62.857   56.349
LGA    L   206_A      L   206_A     1.653     0    0.091   1.286     3.681   72.857   67.202
LGA    N   207_A      N   207_A     1.673     0    0.645   0.991     5.212   63.452   49.702
LGA    P   208_A      P   208_A     2.639     0    0.048   0.284     4.685   60.952   50.816
LGA    A   209_A      A   209_A     3.199     0    0.339   0.441     4.188   51.905   48.952
LGA    I   210_A      I   210_A     1.841     0    0.201   1.595     4.846   68.810   59.226
LGA    C   211_A      C   211_A     1.469     0    0.119   0.736     2.479   72.976   73.016
LGA    V   212_A      V   212_A     3.011     0    0.035   1.020     5.421   59.167   52.993
LGA    Q   213_A      Q   213_A     3.425     0    0.247   0.963     6.151   43.452   38.730
LGA    E   214_A      E   214_A     3.693     0    0.587   1.370     5.199   40.714   38.413
LGA    L   215_A      L   215_A     3.069     0    0.619   1.069     5.216   39.405   51.548
LGA    Q   216_A      Q   216_A     9.815     0    0.561   1.628    15.348    1.905    0.847
LGA    L   217_A      L   217_A    11.500     0    0.520   1.508    15.787    0.119    0.060
LGA    N   218_A      N   218_A     9.467     0    0.627   1.010    13.360    5.357    2.679
LGA    Q   219_A      Q   219_A     4.742     0    0.584   1.673     9.051   21.905   17.090
LGA    E   220_A      E   220_A     7.004     0    0.613   0.698    15.065   14.524    6.614
LGA    A   221_A      A   221_A     8.131     0    0.594   0.597    10.853    3.333    2.952
LGA    S   222_A      S   222_A    11.007     0    0.654   0.627    12.890    0.357    0.238
LGA    L   223_A      L   223_A    11.813     0    0.057   1.260    14.832    0.000    0.000
LGA    L   224_A      L   224_A    16.043     0    0.691   1.098    20.145    0.000    0.000
LGA    V   225_A      V   225_A    18.439     0    0.620   1.482    20.903    0.000    0.000
LGA    S   226_A      S   226_A    16.940     0    0.121   0.681    19.994    0.000    0.000
LGA    N   227_A      N   227_A    21.506     0    0.622   1.549    24.226    0.000    0.000
LGA    L   228_A      L   228_A    25.317     0    0.604   0.722    29.224    0.000    0.000
LGA    E   229_A      E   229_A    30.425     0    0.586   1.095    35.043    0.000    0.000
LGA    Q   230_A      Q   230_A    31.451     0    0.550   1.445    34.844    0.000    0.000
LGA    E   231_A      E   231_A    34.038     0    0.560   0.888    36.688    0.000    0.000
LGA    R   232_A      R   232_A    37.945     0    0.541   1.771    44.163    0.000    0.000
LGA    K   233_A      K   233_A    38.882     0    0.063   0.566    41.194    0.000    0.000
LGA    I   234_A      I   234_A    41.314     0    0.540   0.993    43.474    0.000    0.000
LGA    N   235_A      N   235_A    42.513     0    0.634   0.911    44.484    0.000    0.000
LGA    L   236_A      L   236_A    45.387     0    0.587   1.235    49.936    0.000    0.000
LGA    K   237_A      K   237_A    42.163     0    0.520   1.385    43.894    0.000    0.000
LGA    Y   238_A      Y   238_A    39.559     0    0.668   1.476    42.757    0.000    0.000
LGA    E   239_A      E   239_A    41.541     0    0.476   0.465    43.607    0.000    0.000
LGA    K   240_A      K   240_A    40.569     0    0.194   1.088    40.992    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      239     956    956  100.00    1967   1967  100.00               239
SUMMARY(RMSD_GDC):    15.488         15.524                 16.260           28.660   25.296

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  251  239    4.0     98    2.67    32.741    27.357     3.537

LGA_LOCAL      RMSD:   2.671  Number of atoms:   98  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  16.547  Number of assigned atoms:  239 
Std_ASGN_ATOMS RMSD:  15.488  Standard rmsd on all 239 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.202949 * X  +   0.907222 * Y  +   0.368455 * Z  + -36.804913
  Y_new =  -0.909097 * X  +   0.034768 * Y  +   0.415132 * Z  + -39.442505
  Z_new =   0.363806 * X  +  -0.419212 * Y  +   0.831809 * Z  + -45.418312 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -1.351155 -0.372351 -0.466824   [DEG:  -77.4155  -21.3341  -26.7470 ]
ZXZ:  2.415692  0.588437  2.426836   [DEG:  138.4090   33.7150  139.0475 ]
 
# END of job
