
#######################################################
#                                                     #
#                        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:    79      56_A - 134_A       4.77    15.85
  LONGEST_CONTINUOUS_SEGMENT:    79      57_A - 135_A       4.94    15.85
  LCS_AVERAGE:     25.30

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    43      62_A - 104_A       1.94    15.52
  LCS_AVERAGE:     11.14

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    26      16_A - 41_A        0.98    15.48
  LCS_AVERAGE:      4.86

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      3    4   44      1   10   35   56   81  105  123  139  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     S     3_A     S     3_A      3    4   44      4   10   35   56   78  105  123  139  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     T     4_A     T     4_A      3    6   44      2    6   25   44   63   89  112  133  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     E     5_A     E     5_A      4    7   44      2    4    5    8   21   32   42   78  104  142  161  168  173  175  176  178  178  181  181  182 
LCS_GDT     N     6_A     N     6_A      4   37   44      3    5   12   29   64   87  110  138  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     K     7_A     K     7_A      7   37   44      4   12   51   77  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     N     8_A     N     8_A      7   37   44      7   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     F     9_A     F     9_A      7   37   44      7   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     V    10_A     V    10_A      7   37   44      5   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     I    11_A     I    11_A      9   37   44      6   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     S    12_A     S    12_A      9   37   44     12   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     I    13_A     I    13_A      9   37   44      7   28   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     S    14_A     S    14_A     14   37   44      4   19   42   73   98  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     T    15_A     T    15_A     14   37   44      4   16   29   58   84  106  132  142  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     A    16_A     A    16_A     26   37   44      4   21   51   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     E    17_A     E    17_A     26   37   44     12   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     Q    18_A     Q    18_A     26   37   44      6   25   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     R    19_A     R    19_A     26   37   44     12   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     R    20_A     R    20_A     26   37   44      9   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     N    21_A     N    21_A     26   37   44      9   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     H    22_A     H    22_A     26   37   44      9   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     I    23_A     I    23_A     26   37   44      9   28   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     I    24_A     I    24_A     26   37   44      9   28   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     E    25_A     E    25_A     26   37   44      9   28   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     Q    26_A     Q    26_A     26   37   44      6   28   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     F    27_A     F    27_A     26   37   44      5   28   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     T    28_A     T    28_A     26   37   44      7   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     H    29_A     H    29_A     26   37   44      8   25   43   70  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     Q    30_A     Q    30_A     26   37   44      8   25   42   62   98  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     N    31_A     N    31_A     26   37   44      5   28   43   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     I    32_A     I    32_A     26   37   44      4   28   44   77   99  117  133  144  150  156  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     P    33_A     P    33_A     26   37   44      8   24   43   62   99  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     F    34_A     F    34_A     26   37   44      7   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     E    35_A     E    35_A     26   37   44      6   28   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     F    36_A     F    36_A     26   37   44      5   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     F    37_A     F    37_A     26   37   44      7   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     D    38_A     D    38_A     26   37   44      6   24   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     A    39_A     A    39_A     26   37   44     12   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     F    40_A     F    40_A     26   37   44      4   19   44   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     T    41_A     T    41_A     26   37   44      4   19   42   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     P    42_A     P    42_A      6   37   44      3   14   30   50   78  106  128  142  151  159  164  169  173  175  176  178  178  181  181  182 
LCS_GDT     S    43_A     S    43_A      4    9   44      1    4   12   24   31   51   70   91  119  138  148  157  164  171  174  178  178  181  181  182 
LCS_GDT     D    44_A     D    44_A      4    6   44      0    4    5    6   10   21   26   35   56   65   90  104  115  119  138  157  167  171  175  180 
LCS_GDT     K    45_A     K    45_A      4    5   44      1    3    5   10   13   15   18   22   31   34   58   68   87   96  116  127  142  156  171  177 
LCS_GDT     L    46_A     L    46_A      3    4   44      1    3    4   10   13   15   18   22   23   30   36   62   66   87  101  117  133  145  162  176 
LCS_GDT     T    47_A     T    47_A      4    4   42      2    4    4   10   13   15   18   22   26   31   41   51   64   70   90  103  119  144  156  162 
LCS_GDT     D    48_A     D    48_A      4    4   24      3    4    4    7   11   11   12   16   20   22   23   26   44   48   53   64   71   75   85  107 
LCS_GDT     H    49_A     H    49_A      4    4   24      3    4    4    7   11   11   12   16   20   22   25   27   33   47   53   64   71   75   85   96 
LCS_GDT     L    50_A     L    50_A      4    4   24      3    4    5   10   13   15   18   25   32   39   50   62   71   79   89  115  127  144  156  169 
LCS_GDT     Q    51_A     Q    51_A      4    4   24      3    4    4    5   11   11   15   21   26   31   36   41   49   59   64   70   90   98  110  128 
LCS_GDT     R    52_A     R    52_A      4    6   24      3    4    4    6    6    9   11   13   20   22   28   30   38   47   52   58   64   72   81   95 
LCS_GDT     Y    53_A     Y    53_A      4    6   24      3    4    4    6   11   11   13   19   23   30   34   41   49   54   65   74   88   99  113  129 
LCS_GDT     L    54_A     L    54_A      3    6   50      3    3    4    6   10   15   20   26   35   44   54   64   74   89  109  122  127  136  156  168 
LCS_GDT     P    55_A     P    55_A      3    6   78      3    3    4    5   11   15   18   25   32   41   50   62   71   82   94  108  120  132  140  149 
LCS_GDT     N    56_A     N    56_A      3    6   79      2    3    4    6   14   19   35   43   52   72   85   95  105  122  134  145  154  164  173  180 
LCS_GDT     V    57_A     V    57_A      3    6   79      3    3    4    6   23   32   47   65   82   96  114  127  141  157  164  171  177  181  181  182 
LCS_GDT     A    58_A     A    58_A      3    4   79      3    3    4    5    9   17   23   32   51   65   89  103  123  142  155  166  172  178  181  182 
LCS_GDT     N    59_A     N    59_A      3    5   79      3    4    9   15   22   30   51   58   80   95  106  117  135  149  160  167  172  181  181  182 
LCS_GDT     A    60_A     A    60_A      3   42   79      3    9   24   53   76   97  117  132  142  154  161  169  173  175  176  178  178  181  181  182 
LCS_GDT     A    61_A     A    61_A      3   42   79      3   16   33   58   79  101  118  136  148  155  161  169  173  175  176  178  178  181  181  182 
LCS_GDT     Q    62_A     Q    62_A     20   43   79      0   12   30   71  100  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     L    63_A     L    63_A     24   43   79      3   19   41   77   98  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     T    64_A     T    64_A     24   43   79      3   19   47   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     M    65_A     M    65_A     24   43   79      4   19   37   57   95  111  132  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     G    66_A     G    66_A     24   43   79      4   17   37   63   98  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     E    67_A     E    67_A     24   43   79      3   17   37   63   98  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     K    68_A     K    68_A     24   43   79      3   19   41   77   98  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     G    69_A     G    69_A     24   43   79      6   19   40   63   98  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     C    70_A     C    70_A     24   43   79      6   21   44   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     L    71_A     L    71_A     24   43   79      6   19   50   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     M    72_A     M    72_A     24   43   79     10   19   43   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     S    73_A     S    73_A     24   43   79     10   19   50   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     H    74_A     H    74_A     24   43   79     10   19   51   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     F    75_A     F    75_A     24   43   79     10   19   44   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     M    76_A     M    76_A     24   43   79     10   19   43   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     L    77_A     L    77_A     24   43   79     10   19   43   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     W    78_A     W    78_A     24   43   79     10   19   44   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     K    79_A     K    79_A     24   43   79     10   19   42   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     K    80_A     K    80_A     24   43   79     10   19   42   77  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     C    81_A     C    81_A     24   43   79      8   17   42   77  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     I    82_A     I    82_A     24   43   79      6   18   42   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     D    83_A     D    83_A     24   43   79      9   19   43   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     E    84_A     E    84_A     24   43   79     10   19   42   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     N    85_A     N    85_A     24   43   79      9   19   42   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     L    86_A     L    86_A     24   43   79      9   19   45   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     D    87_A     D    87_A     24   43   79      9   19   45   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     Y    88_A     Y    88_A     24   43   79      3   28   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     I    89_A     I    89_A     24   43   79      9   28   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     T    90_A     T    90_A     24   43   79      7   28   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     L    91_A     L    91_A     24   43   79      6   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     F    92_A     F    92_A     12   43   79      7   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     E    93_A     E    93_A     12   43   79      7   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     D    94_A     D    94_A     12   43   79      7   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     D    95_A     D    95_A     12   43   79      7   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     I    96_A     I    96_A     12   43   79      7   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     L    97_A     L    97_A     12   43   79     12   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     L    98_A     L    98_A     12   43   79      3   21   49   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     G    99_A     G    99_A     12   43   79      3   11   42   70  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     E   100_A     E   100_A     11   43   79      3    6   43   73  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     N   101_A     N   101_A      8   43   79      4    7   24   65   94  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     A   102_A     A   102_A      8   43   79      3    7   15   51   94  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     N   103_A     N   103_A      8   43   79      4    8   21   43   80  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     K   104_A     K   104_A      8   43   79      4   17   39   63   92  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     F   105_A     F   105_A      8   38   79      4   10   31   51   75  109  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     L   106_A     L   106_A      8   20   79      4    7   13   21   41   70  100  133  148  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     A   107_A     A   107_A      8   20   79      3    7   13   21   33   55   84  107  137  158  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     E   108_A     E   108_A      8   20   79      3    7   13   22   32   58   83  108  134  154  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     G   109_A     G   109_A      6   20   79      3    6   12   21   32   52   79  114  137  154  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     D   110_A     D   110_A      6   20   79      3    6   13   32   63   81  106  126  147  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     W   111_A     W   111_A      6   12   79      3    6   10   19   40   63   92  124  146  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     L   112_A     L   112_A      6   12   79      8   16   31   57   84  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     K   113_A     K   113_A      6   12   79      3   10   39   64   91  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     V   114_A     V   114_A      6   12   79      3   12   31   57   80  114  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     R   115_A     R   115_A      4   12   79      1    4   12   27   68   92  131  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     F   116_A     F   116_A      4   12   79      5   17   39   69  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     N   117_A     N   117_A      4   12   79      6   21   45   71  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     F   118_A     F   118_A      4   12   79      5   20   44   69  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     Q   119_A     Q   119_A      4   12   79      4   15   44   69  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     E   120_A     E   120_A      4   11   79      3    5   20   62   94  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     I   121_A     I   121_A      5   11   79      4    7   22   30   48   70   96  111  129  148  160  169  172  175  176  178  178  181  181  182 
LCS_GDT     F   122_A     F   122_A      5   11   79      3    9   29   61   94  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     V   123_A     V   123_A      5   11   79      3    9   31   60   90  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     L   124_A     L   124_A      5   11   79      3    9   20   43   72   99  132  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     R   125_A     R   125_A      5   11   79      3    8   20   32   64   91  122  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     L   126_A     L   126_A      5   11   79      3    5    7   11   27   39   55   99  134  154  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     E   127_A     E   127_A      3   11   79      3    3    7   12   21   38   59   94  112  141  161  168  173  175  176  178  178  181  181  182 
LCS_GDT     T   128_A     T   128_A      3   11   79      3    4   20   26   36   54   84  117  146  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     F   129_A     F   129_A      3   11   79      3    5    6   22   31   64   97  124  146  157  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     L   130_A     L   130_A      3   11   79      3    3    7    9   30   47   97  120  146  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     M   131_A     M   131_A      3   18   79      2    7   13   39   68  103  125  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     P   132_A     P   132_A      5   18   79      3    7   14   28   68   97  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     V   133_A     V   133_A      5   18   79      4   12   27   49   70  104  117  133  141  154  158  165  169  175  176  178  178  181  181  182 
LCS_GDT     Q   134_A     Q   134_A      5   21   79      3    4    8   12   19   36   46   63   79  101  121  130  142  155  161  167  173  175  178  181 
LCS_GDT     L   135_A     L   135_A      5   21   79      3    4   10   13   18   22   24   24   40   52   60   70   89  104  117  125  138  147  158  166 
LCS_GDT     E   136_A     E   136_A      5   21   30      3    4    8   13   18   22   24   24   26   26   28   40   52   62   81   92  106  115  127  138 
LCS_GDT     K   137_A     K   137_A      5   21   30      3    4    8   13   18   22   24   24   26   26   28   34   41   58   65   69   85   92  104  110 
LCS_GDT     Q   138_A     Q   138_A      5   21   30      3    4    8   13   18   22   24   24   26   26   28   32   39   48   54   56   61   77   81   89 
LCS_GDT     T   139_A     T   139_A      4   21   30      3    4    6   11   14   22   24   24   26   26   27   29   32   33   39   43   52   57   60   63 
LCS_GDT     Q   140_A     Q   140_A      4   21   30      3    4    9   13   18   22   24   24   26   26   27   29   32   35   39   43   52   57   60   63 
LCS_GDT     I   141_A     I   141_A      5   21   30      3    4    9   13   18   22   24   24   26   26   27   29   32   39   42   45   52   57   63   66 
LCS_GDT     P   142_A     P   142_A      5   21   30      3    4    9   13   18   22   24   24   26   26   27   29   34   39   42   45   52   57   63   70 
LCS_GDT     P   143_A     P   143_A      5   21   30      3    4    9   13   18   22   24   24   26   26   27   29   35   42   50   54   55   62   65   75 
LCS_GDT     F   144_A     F   144_A      8   21   30      3    7   10   13   18   22   24   24   26   26   27   29   32   33   34   35   36   55   61   66 
LCS_GDT     Q   145_A     Q   145_A      8   21   30      3    6    9   13   18   22   24   24   26   26   27   29   32   33   34   35   49   55   61   66 
LCS_GDT     Q   146_A     Q   146_A      9   21   30      3    9   10   13   18   22   24   24   26   26   27   29   32   33   34   54   55   62   65   71 
LCS_GDT     R   147_A     R   147_A      9   21   30      3    9   10   13   18   22   24   24   26   26   27   29   32   33   34   35   36   62   65   70 
LCS_GDT     D   148_A     D   148_A      9   21   30      3    9   10   13   18   22   24   24   26   26   27   29   35   44   50   56   61   68   72   82 
LCS_GDT     I   149_A     I   149_A      9   21   30      4    9   10   13   18   22   24   24   26   26   27   29   35   42   50   54   55   68   71   76 
LCS_GDT     D   150_A     D   150_A      9   21   30      5    9   10   13   18   22   24   24   26   26   27   31   42   48   56   62   70   79   88   95 
LCS_GDT     I   151_A     I   151_A      9   21   30      5    9   10   13   18   22   24   24   26   26   27   35   42   48   56   63   70   79   89   98 
LCS_GDT     L   152_A     L   152_A      9   21   66      5    9   10   13   18   22   24   24   26   27   33   42   53   67   74   88  103  114  126  134 
LCS_GDT     T   153_A     T   153_A      9   21   67      5    9   10   13   18   22   24   24   26   41   51   67   76   96  106  119  132  142  155  165 
LCS_GDT     S   154_A     S   154_A      9   21   67      5    9   10   13   18   23   36   50   62   72   86  107  132  150  158  163  172  175  178  180 
LCS_GDT     K   155_A     K   155_A      5   23   68      3    5    6   11   20   30   41   56   74   87  113  137  154  164  171  175  177  177  179  181 
LCS_GDT     H   156_A     H   156_A      5   27   68      7   10   25   40   58   80  111  136  149  156  162  169  173  175  176  178  178  181  181  182 
LCS_GDT     F   157_A     F   157_A      5   27   68      3    5   13   38   59   78  106  137  149  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     G   158_A     G   158_A     19   37   68      4   20   39   72  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     T   159_A     T   159_A     19   37   68     10   21   51   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     A   160_A     A   160_A     19   37   68      4   19   35   61   98  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     G   161_A     G   161_A     19   37   68      4   15   35   55   90  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     Y   162_A     Y   162_A     19   37   68      9   24   49   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     V   163_A     V   163_A     19   37   68      7   25   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     I   164_A     I   164_A     19   37   68     12   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     S   165_A     S   165_A     19   37   68      9   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     Q   166_A     Q   166_A     19   37   68     10   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     G   167_A     G   167_A     19   37   68     12   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     A   168_A     A   168_A     19   37   68     12   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     A   169_A     A   169_A     19   37   68      9   21   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     K   170_A     K   170_A     19   37   68      9   28   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     Y   171_A     Y   171_A     19   37   68     12   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     L   172_A     L   172_A     19   37   68     12   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     I   173_A     I   173_A     19   37   68      9   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     A   174_A     A   174_A     19   37   68      5   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     L   175_A     L   175_A     19   37   68      9   29   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     F   176_A     F   176_A     19   37   68      7   25   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     E   177_A     E   177_A     19   37   68      7   21   36   63  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     K   178_A     K   178_A     17   37   68      4   17   31   70  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     L   179_A     L   179_A     17   37   68      4    9   27   44   75  105  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     T   180_A     T   180_A     17   37   68      4    7   18   33   49   80  116  137  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     T   181_A     T   181_A      3   37   68      3    3    3    6   49   96  115  135  149  156  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     E   182_A     E   182_A      5   37   68      3   10   26   44   66  114  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     E   183_A     E   183_A      8   37   68      3    4   12   32   61  100  131  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     I   184_A     I   184_A      8   37   68      3    8   13   50   88  111  132  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     K   185_A     K   185_A      8   37   68      7   21   37   78  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     P   186_A     P   186_A      8   37   68      7   21   51   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     I   187_A     I   187_A      8   37   68     12   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     D   188_A     D   188_A      8   37   68      3   16   41   67   98  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     E   189_A     E   189_A      8   37   68      5   16   43   69   98  117  133  143  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     I   190_A     I   190_A      8   37   68      4   22   45   69   99  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     M   191_A     M   191_A      8   37   68      5   28   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     F   192_A     F   192_A      7   37   68      5   28   45   77  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     N   193_A     N   193_A      7   37   68      4   17   41   66   98  115  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     Q   194_A     Q   194_A      5   37   68      3   11   39   70  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     Q   195_A     Q   195_A      4   34   68      3    9   31   61   92  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     I   196_A     I   196_A      3   34   68      3   14   41   65   98  113  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     N   197_A     N   197_A      3   34   68      3   14   38   58   94  108  130  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     A   198_A     A   198_A      3   20   68      3    4    7   40   81  108  127  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     T   199_A     T   199_A      3   20   68      5   34   52   77   99  117  133  142  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     D   200_A     D   200_A      4   20   68      3   13   42   77  100  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     Y   201_A     Y   201_A      6   20   68     12   34   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     R   202_A     R   202_A      7   20   68      3   14   39   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     V   203_A     V   203_A      7   20   68      3   17   35   73  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     Y   204_A     Y   204_A      7   20   68      4   19   43   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     Q   205_A     Q   205_A      7   20   68      4   24   42   70  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     L   206_A     L   206_A      7   20   68      4   20   41   68  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     N   207_A     N   207_A      7   13   68      3    7   17   38   70  103  125  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     P   208_A     P   208_A      7   13   68      4    6    9   19   31   49   93  115  138  152  163  168  173  175  176  178  178  181  181  182 
LCS_GDT     A   209_A     A   209_A      6    9   68      3    6   13   39   59   89  123  138  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     I   210_A     I   210_A      6    9   68      3    6   35   63   85  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     C   211_A     C   211_A      6    9   68      4   17   41   70  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     V   212_A     V   212_A      6    9   68      4   25   49   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     Q   213_A     Q   213_A      6    9   68      5   28   52   80  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     E   214_A     E   214_A      6    9   68      3    4   17   32   66   94  121  135  147  156  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     L   215_A     L   215_A      5    9   68      3   18   45   67  101  117  133  144  152  159  165  169  173  175  176  178  178  181  181  182 
LCS_GDT     Q   216_A     Q   216_A      3    9   68      4    9   22   27   40   55   79  102  115  141  152  158  165  171  174  178  178  181  181  182 
LCS_GDT     L   217_A     L   217_A      3    9   68      3    7   22   27   48   73   89  116  135  144  154  162  169  173  176  178  178  181  181  182 
LCS_GDT     N   218_A     N   218_A      3    8   68      3    3   11   27   40   55   79   93  115  126  141  154  163  169  174  176  178  181  181  182 
LCS_GDT     Q   219_A     Q   219_A      4    6   68      4    4    4    8   12   23   33   54   67   73   79   87  108  117  122  133  160  162  171  179 
LCS_GDT     E   220_A     E   220_A      4    6   68      4    4    4    7    7   10   12   23   37   45   54   62   74   81   98  103  131  141  150  158 
LCS_GDT     A   221_A     A   221_A      4    6   68      4    4    4    7   18   23   27   32   37   52   61   66   85   96  101  112  135  145  160  169 
LCS_GDT     S   222_A     S   222_A      4    6   68      4    4    5    9   12   14   21   39   52   70   96  119  136  149  161  169  172  176  177  179 
LCS_GDT     L   223_A     L   223_A      3    6   68      3    3    6   14   17   23   24   25   31   46   52   75   94  111  128  144  155  165  170  174 
LCS_GDT     L   224_A     L   224_A      3    4   67      3    3    5    9   12   14   16   17   31   33   37   61   78   91  107  117  128  144  151  165 
LCS_GDT     V   225_A     V   225_A      3    9   25      3    3    3    5   13   13   14   15   17   20   21   35   40   45   59   80   96  107  119  132 
LCS_GDT     S   226_A     S   226_A      4   10   25      3    3    4    9   10   13   14   15   16   19   22   26   33   38   45   60   71   88  105  115 
LCS_GDT     N   227_A     N   227_A      7   14   25      3    7   10   13   13   14   16   17   18   24   25   26   33   45   48   60   73   92  105  112 
LCS_GDT     L   228_A     L   228_A      7   14   25      3    7   10   13   13   14   16   17   18   24   25   26   33   45   48   51   57   74   80   88 
LCS_GDT     E   229_A     E   229_A      7   14   25      3    7   10   13   13   14   16   17   18   24   25   35   40   45   48   60   73   92  105  112 
LCS_GDT     Q   230_A     Q   230_A      7   14   25      3    7   10   13   13   14   16   17   18   27   29   35   40   52   63   80   91  101  106  118 
LCS_GDT     E   231_A     E   231_A      7   14   25      3    5    8   13   13   14   16   17   18   24   25   26   40   45   48   56   65   74   80   88 
LCS_GDT     R   232_A     R   232_A      7   14   25      3    7   10   13   13   14   16   17   18   24   25   26   32   35   42   47   55   64   73   77 
LCS_GDT     K   233_A     K   233_A      7   14   25      3    7   10   13   13   14   16   17   18   24   25   26   33   40   45   51   63   74   80  103 
LCS_GDT     I   234_A     I   234_A      3   14   25      3    3    4    4    6   10   12   15   16   20   21   25   25   27   42   51   56   69   84  103 
LCS_GDT     N   235_A     N   235_A      5   14   25      4    5    8   13   13   14   16   17   18   24   25   26   32   40   45   51   55   69   80   84 
LCS_GDT     L   236_A     L   236_A      5   14   25      4    4   10   13   13   14   16   17   18   24   25   26   32   40   45   47   55   74   80   87 
LCS_GDT     K   237_A     K   237_A      5   14   25      4    4   10   13   13   14   16   17   18   24   25   26   32   40   48   56   65   74   80   89 
LCS_GDT     Y   238_A     Y   238_A      5   14   25      4    7   10   13   13   14   16   17   18   24   25   26   32   40   45   47   55   61   65   77 
LCS_GDT     E   239_A     E   239_A      5   14   25      3    4    6   13   13   14   16   17   18   24   25   26   29   32   36   45   55   59   65   67 
LCS_GDT     K   240_A     K   240_A      3   14   25      3    7   10   13   13   14   16   17   18   20   22   25   27   31   36   45   55   59   65   67 
LCS_AVERAGE  LCS_A:  13.77  (   4.86   11.14   25.30 )

GLOBAL_DISTANCE_TEST (summary information about detected largest sets of residues (represented by selected AToms) that can fit under specified thresholds)
GDT DIST_CUTOFF  0.50   1.00   1.50   2.00   2.50   3.00   3.50   4.00   4.50   5.00   5.50   6.00   6.50   7.00   7.50   8.00   8.50   9.00   9.50  10.00
GDT NUMBER_AT     12     34     52     80    101    117    133    144    152    159    165    169    173    175    176    178    178    181    181    182 
GDT PERCENT_AT   5.02  14.23  21.76  33.47  42.26  48.95  55.65  60.25  63.60  66.53  69.04  70.71  72.38  73.22  73.64  74.48  74.48  75.73  75.73  76.15
GDT RMS_LOCAL    0.36   0.74   0.98   1.46   1.74   1.94   2.19   2.44   2.60   2.83   3.00   3.12   3.27   3.33   3.37   3.50   3.49   3.82   3.82   3.97
GDT RMS_ALL_AT  15.43  15.31  15.34  15.34  15.41  15.38  15.45  15.51  15.55  15.60  15.63  15.63  15.63  15.62  15.61  15.60  15.58  15.56  15.56  15.55

# Checking swapping
#   possible swapping detected:  E     5_A      E     5_A
#   possible swapping detected:  F     9_A      F     9_A
#   possible swapping detected:  E    25_A      E    25_A
#   possible swapping detected:  F    27_A      F    27_A
#   possible swapping detected:  E    35_A      E    35_A
#   possible swapping detected:  F    37_A      F    37_A
#   possible swapping detected:  F    40_A      F    40_A
#   possible swapping detected:  D    48_A      D    48_A
#   possible swapping detected:  F    75_A      F    75_A
#   possible swapping detected:  D    83_A      D    83_A
#   possible swapping detected:  F    92_A      F    92_A
#   possible swapping detected:  E    93_A      E    93_A
#   possible swapping detected:  D    94_A      D    94_A
#   possible swapping detected:  D    95_A      D    95_A
#   possible swapping detected:  F   105_A      F   105_A
#   possible swapping detected:  E   120_A      E   120_A
#   possible swapping detected:  E   127_A      E   127_A
#   possible swapping detected:  F   144_A      F   144_A
#   possible swapping detected:  E   182_A      E   182_A
#   possible swapping detected:  D   188_A      D   188_A
#   possible swapping detected:  F   192_A      F   192_A
#   possible swapping detected:  D   200_A      D   200_A
#   possible swapping detected:  E   214_A      E   214_A
#   possible swapping detected:  E   220_A      E   220_A
#   possible swapping detected:  E   229_A      E   229_A
#   possible swapping detected:  Y   238_A      Y   238_A
#   possible swapping detected:  E   239_A      E   239_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    N     2_A      N     2_A     4.654     0    0.712   0.950     6.537   23.095   26.607
LGA    S     3_A      S     3_A     4.781     0    0.201   0.401     4.985   32.857   32.381
LGA    T     4_A      T     4_A     6.081     0    0.197   0.314     8.839   12.143   11.429
LGA    E     5_A      E     5_A     8.773     0    0.617   1.181    16.958   11.190    4.974
LGA    N     6_A      N     6_A     5.264     0    0.190   1.220     8.589   27.262   17.143
LGA    K     7_A      K     7_A     2.559     0    0.781   1.393     9.491   64.881   36.931
LGA    N     8_A      N     8_A     1.636     0    0.137   0.953     4.738   75.000   65.893
LGA    F     9_A      F     9_A     1.351     0    0.054   0.967     4.215   79.286   67.879
LGA    V    10_A      V    10_A     1.618     0    0.136   1.299     4.709   72.976   61.633
LGA    I    11_A      I    11_A     1.278     0    0.076   1.057     3.674   81.429   76.726
LGA    S    12_A      S    12_A     0.943     0    0.089   0.710     2.264   85.952   81.667
LGA    I    13_A      I    13_A     1.534     0    0.036   1.150     4.963   75.238   69.048
LGA    S    14_A      S    14_A     3.126     0    0.144   0.155     4.315   48.810   46.984
LGA    T    15_A      T    15_A     4.610     0    0.185   1.130     7.998   43.690   32.789
LGA    A    16_A      A    16_A     1.244     0    0.195   0.218     2.358   79.524   76.571
LGA    E    17_A      E    17_A     1.167     0    0.087   1.186     6.545   81.548   57.407
LGA    Q    18_A      Q    18_A     1.487     0    0.133   0.998     4.169   81.429   67.460
LGA    R    19_A      R    19_A     1.046     0    0.050   1.053     3.072   79.286   74.805
LGA    R    20_A      R    20_A     1.645     0    0.076   0.775     2.681   72.976   71.472
LGA    N    21_A      N    21_A     1.935     0    0.087   0.747     3.639   72.857   68.214
LGA    H    22_A      H    22_A     1.864     0    0.034   0.887     2.208   72.857   73.762
LGA    I    23_A      I    23_A     1.867     0    0.088   0.953     4.230   66.905   65.417
LGA    I    24_A      I    24_A     2.233     0    0.103   1.367     4.114   64.762   58.452
LGA    E    25_A      E    25_A     2.447     0    0.051   0.899     4.539   64.762   54.550
LGA    Q    26_A      Q    26_A     2.152     0    0.058   0.661     4.399   64.762   56.085
LGA    F    27_A      F    27_A     2.359     0    0.036   0.405     4.027   64.762   56.970
LGA    T    28_A      T    28_A     1.729     0    0.180   0.204     1.902   72.857   74.082
LGA    H    29_A      H    29_A     2.371     0    0.095   1.342     7.588   60.952   41.667
LGA    Q    30_A      Q    30_A     2.943     0    0.132   1.061     5.787   57.143   42.593
LGA    N    31_A      N    31_A     2.330     0    0.446   0.596     4.360   55.952   57.560
LGA    I    32_A      I    32_A     3.202     0    0.253   1.702     5.978   48.571   36.845
LGA    P    33_A      P    33_A     2.688     0    0.115   0.347     3.744   57.262   53.197
LGA    F    34_A      F    34_A     1.927     0    0.173   0.452     4.902   68.810   52.987
LGA    E    35_A      E    35_A     2.253     0    0.086   1.082     5.005   68.810   55.979
LGA    F    36_A      F    36_A     2.051     0    0.177   0.642     5.310   62.857   50.779
LGA    F    37_A      F    37_A     1.414     0    0.042   0.726     3.040   83.810   76.450
LGA    D    38_A      D    38_A     0.518     0    0.116   0.915     2.697   92.857   80.952
LGA    A    39_A      A    39_A     1.296     0    0.502   0.542     3.375   75.833   75.238
LGA    F    40_A      F    40_A     1.151     0    0.281   1.034     9.388   73.690   42.338
LGA    T    41_A      T    41_A     1.612     0    0.229   0.727     6.050   52.143   56.735
LGA    P    42_A      P    42_A     5.020     0    0.489   0.532     6.256   25.238   27.143
LGA    S    43_A      S    43_A    10.236     0    0.427   0.521    13.335    0.714    0.476
LGA    D    44_A      D    44_A    17.525     0    0.108   1.065    19.493    0.000    0.000
LGA    K    45_A      K    45_A    20.167     0    0.483   0.973    21.960    0.000    0.000
LGA    L    46_A      L    46_A    20.179     0    0.416   1.474    21.855    0.000    0.000
LGA    T    47_A      T    47_A    22.208     0    1.025   0.821    23.681    0.000    0.000
LGA    D    48_A      D    48_A    27.862     0    0.091   0.971    32.066    0.000    0.000
LGA    H    49_A      H    49_A    26.080     0    0.200   1.085    32.067    0.000    0.000
LGA    L    50_A      L    50_A    20.123     0    0.357   0.866    22.088    0.000    0.000
LGA    Q    51_A      Q    51_A    26.205     0    0.135   1.295    29.795    0.000    0.000
LGA    R    52_A      R    52_A    29.626     0    0.151   1.209    39.961    0.000    0.000
LGA    Y    53_A      Y    53_A    24.173     0    0.197   1.471    25.742    0.000    0.000
LGA    L    54_A      L    54_A    19.673     0    0.252   0.876    21.297    0.000    0.000
LGA    P    55_A      P    55_A    22.941     0    0.124   0.178    24.403    0.000    0.000
LGA    N    56_A      N    56_A    18.218     0    0.410   0.849    21.696    0.000    0.000
LGA    V    57_A      V    57_A    13.695     0    0.591   1.062    15.752    0.000    0.000
LGA    A    58_A      A    58_A    15.568     0    0.428   0.413    16.614    0.000    0.000
LGA    N    59_A      N    59_A    13.784     0    0.464   1.203    19.308    0.000    0.000
LGA    A    60_A      A    60_A     6.778     0    0.591   0.544     9.255   13.333   13.333
LGA    A    61_A      A    61_A     6.139     0    0.533   0.496     7.583   20.714   18.000
LGA    Q    62_A      Q    62_A     2.572     0    0.421   0.759    10.018   55.357   34.021
LGA    L    63_A      L    63_A     3.617     0    0.158   0.983     6.302   48.333   35.238
LGA    T    64_A      T    64_A     2.192     0    0.097   0.294     3.718   53.810   59.932
LGA    M    65_A      M    65_A     4.082     0    0.142   1.605    12.432   43.452   25.893
LGA    G    66_A      G    66_A     3.601     0    0.070   0.070     3.931   46.667   46.667
LGA    E    67_A      E    67_A     3.524     0    0.074   0.925     7.819   48.452   33.228
LGA    K    68_A      K    68_A     3.362     0    0.133   1.082     4.227   51.786   51.058
LGA    G    69_A      G    69_A     3.590     0    0.108   0.108     3.624   52.143   52.143
LGA    C    70_A      C    70_A     2.307     0    0.143   0.838     3.089   66.905   62.460
LGA    L    71_A      L    71_A     1.710     0    0.023   0.933     5.476   72.976   55.774
LGA    M    72_A      M    72_A     2.090     0    0.103   0.946     6.375   70.833   52.024
LGA    S    73_A      S    73_A     1.435     0    0.086   0.090     1.739   79.286   78.571
LGA    H    74_A      H    74_A     1.035     0    0.031   1.249     4.261   81.429   71.524
LGA    F    75_A      F    75_A     1.437     0    0.041   0.638     5.726   79.286   56.320
LGA    M    76_A      M    76_A     1.856     0    0.043   0.914     4.905   72.857   62.202
LGA    L    77_A      L    77_A     1.562     0    0.110   0.791     3.858   77.143   69.286
LGA    W    78_A      W    78_A     1.329     0    0.048   1.293     5.852   81.429   65.782
LGA    K    79_A      K    79_A     1.851     0    0.039   1.073     5.722   68.810   58.519
LGA    K    80_A      K    80_A     2.300     0    0.031   0.883     5.310   64.762   58.995
LGA    C    81_A      C    81_A     2.372     0    0.051   0.330     2.566   64.762   63.492
LGA    I    82_A      I    82_A     1.874     0    0.129   1.686     4.520   72.857   61.250
LGA    D    83_A      D    83_A     1.784     0    0.131   0.923     2.335   68.810   70.893
LGA    E    84_A      E    84_A     2.248     0    0.137   0.636     2.946   64.881   65.820
LGA    N    85_A      N    85_A     2.105     0    0.148   1.053     6.529   64.762   51.250
LGA    L    86_A      L    86_A     2.083     0    0.121   0.716     3.651   64.762   64.107
LGA    D    87_A      D    87_A     2.526     0    0.037   0.517     3.699   62.857   56.488
LGA    Y    88_A      Y    88_A     2.078     0    0.058   0.718     4.812   68.810   62.381
LGA    I    89_A      I    89_A     1.084     0    0.101   0.405     2.083   79.286   77.262
LGA    T    90_A      T    90_A     1.069     0    0.183   1.219     3.244   85.952   77.143
LGA    L    91_A      L    91_A     1.085     0    0.081   1.443     4.570   85.952   74.286
LGA    F    92_A      F    92_A     1.573     0    0.201   1.090     3.577   72.857   70.433
LGA    E    93_A      E    93_A     1.741     0    0.092   0.587     2.251   72.857   80.847
LGA    D    94_A      D    94_A     1.461     0    0.344   0.774     2.730   71.071   71.012
LGA    D    95_A      D    95_A     1.317     0    0.175   0.712     3.011   79.286   73.214
LGA    I    96_A      I    96_A     1.346     0    0.229   0.240     2.781   71.071   74.405
LGA    L    97_A      L    97_A     1.023     0    0.168   1.259     3.285   85.952   76.607
LGA    L    98_A      L    98_A     1.316     0    0.194   0.400     3.606   75.357   63.690
LGA    G    99_A      G    99_A     2.446     0    0.191   0.191     2.446   70.833   70.833
LGA    E   100_A      E   100_A     2.511     0    0.283   0.653     4.840   67.143   51.958
LGA    N   101_A      N   101_A     3.019     0    0.232   0.722     6.832   55.357   39.107
LGA    A   102_A      A   102_A     2.853     0    0.039   0.065     3.528   55.357   52.952
LGA    N   103_A      N   103_A     3.035     0    0.094   1.093     6.764   55.476   42.857
LGA    K   104_A      K   104_A     2.981     0    0.071   0.801     7.278   50.595   37.778
LGA    F   105_A      F   105_A     4.185     0    0.157   0.844     5.740   33.333   35.541
LGA    L   106_A      L   106_A     5.813     0    0.141   0.316     7.232   20.000   24.524
LGA    A   107_A      A   107_A     6.820     0    0.118   0.129     8.763   10.119   11.524
LGA    E   108_A      E   108_A     8.529     0    0.689   0.773     9.220    4.286    5.132
LGA    G   109_A      G   109_A     7.998     0    0.362   0.362     8.065    9.762    9.762
LGA    D   110_A      D   110_A     6.773     0    0.359   0.345     8.837   14.405   10.952
LGA    W   111_A      W   111_A     6.824     0    0.141   1.030    12.641   17.381    5.850
LGA    L   112_A      L   112_A     3.231     0    0.205   0.892     4.648   56.905   63.095
LGA    K   113_A      K   113_A     3.086     0    0.154   1.159     5.725   57.500   41.958
LGA    V   114_A      V   114_A     3.692     0    0.195   1.153     7.153   43.333   35.238
LGA    R   115_A      R   115_A     4.214     0    0.084   1.539    12.886   43.571   20.173
LGA    F   116_A      F   116_A     1.883     0    0.679   1.416     7.987   59.524   44.978
LGA    N   117_A      N   117_A     1.768     0    0.311   0.777     4.782   72.857   63.750
LGA    F   118_A      F   118_A     2.257     0    0.417   1.226     3.816   62.857   60.736
LGA    Q   119_A      Q   119_A     2.294     0    0.167   1.232     7.465   64.762   43.757
LGA    E   120_A      E   120_A     2.897     0    0.669   0.839     4.268   48.690   57.037
LGA    I   121_A      I   121_A     6.130     0    0.200   1.029    13.599   24.048   12.381
LGA    F   122_A      F   122_A     2.868     0    0.129   1.081     5.741   46.905   41.991
LGA    V   123_A      V   123_A     3.216     0    0.079   1.078     5.668   53.571   44.354
LGA    L   124_A      L   124_A     3.869     0    0.073   1.311     5.241   40.238   39.702
LGA    R   125_A      R   125_A     4.481     0    0.175   1.732     6.110   33.214   33.463
LGA    L   126_A      L   126_A     7.392     0    0.301   0.539    10.475    8.810    5.536
LGA    E   127_A      E   127_A     8.332     0    0.459   0.472    10.263    4.881    2.910
LGA    T   128_A      T   128_A     6.730     0    0.666   1.050     7.704   10.952   16.190
LGA    F   129_A      F   129_A     6.425     0    0.249   1.268    10.720   14.405    7.576
LGA    L   130_A      L   130_A     6.387     0    0.659   1.269     8.615   14.643   11.905
LGA    M   131_A      M   131_A     4.786     0    0.246   0.922     9.735   39.405   23.512
LGA    P   132_A      P   132_A     4.209     0    0.409   0.510     5.087   37.262   34.014
LGA    V   133_A      V   133_A     6.849     0    0.163   1.142     8.863   13.095   10.272
LGA    Q   134_A      Q   134_A    13.573     0    0.388   1.395    16.777    0.000    0.000
LGA    L   135_A      L   135_A    19.879     0    0.155   1.061    21.992    0.000    0.000
LGA    E   136_A      E   136_A    26.424     0    0.027   1.038    28.719    0.000    0.000
LGA    K   137_A      K   137_A    31.962     0    0.089   1.644    35.210    0.000    0.000
LGA    Q   138_A      Q   138_A    37.433     0    0.241   1.271    41.221    0.000    0.000
LGA    T   139_A      T   139_A    44.647     0    0.574   0.519    46.473    0.000    0.000
LGA    Q   140_A      Q   140_A    48.438     0    0.561   1.452    49.489    0.000    0.000
LGA    I   141_A      I   141_A    45.469     0    0.061   1.465    45.891    0.000    0.000
LGA    P   142_A      P   142_A    48.342     0    0.191   0.237    52.263    0.000    0.000
LGA    P   143_A      P   143_A    45.199     0    0.254   0.265    49.192    0.000    0.000
LGA    F   144_A      F   144_A    49.227     0    0.651   1.466    52.578    0.000    0.000
LGA    Q   145_A      Q   145_A    50.053     0    0.168   0.970    56.572    0.000    0.000
LGA    Q   146_A      Q   146_A    43.668     0    0.277   1.098    46.251    0.000    0.000
LGA    R   147_A      R   147_A    39.765     0    0.030   1.364    43.280    0.000    0.000
LGA    D   148_A      D   148_A    37.073     0    0.184   1.233    37.347    0.000    0.000
LGA    I   149_A      I   149_A    36.848     0    0.100   1.087    43.391    0.000    0.000
LGA    D   150_A      D   150_A    32.157     0    0.079   1.058    33.404    0.000    0.000
LGA    I   151_A      I   151_A    29.751     0    0.038   1.339    33.688    0.000    0.000
LGA    L   152_A      L   152_A    22.454     0    0.046   0.829    25.343    0.000    0.000
LGA    T   153_A      T   153_A    19.516     0    0.197   0.293    21.900    0.000    0.000
LGA    S   154_A      S   154_A    13.904     0    0.502   0.461    16.047    0.000    0.000
LGA    K   155_A      K   155_A    11.079     0    0.452   1.556    17.841    2.500    1.111
LGA    H   156_A      H   156_A     5.814     0    0.210   1.408     8.173   19.643   21.238
LGA    F   157_A      F   157_A     5.204     0    0.255   1.393     8.377   34.762   19.610
LGA    G   158_A      G   158_A     1.549     0    0.501   0.501     2.436   72.976   72.976
LGA    T   159_A      T   159_A     0.814     0    0.089   0.881     1.858   85.952   82.857
LGA    A   160_A      A   160_A     2.699     0    0.335   0.357     3.925   62.976   59.048
LGA    G   161_A      G   161_A     2.838     0    0.189   0.189     2.838   62.976   62.976
LGA    Y   162_A      Y   162_A     1.039     0    0.169   1.309     7.303   90.714   61.032
LGA    V   163_A      V   163_A     0.536     0    0.051   1.062     3.993   92.857   81.293
LGA    I   164_A      I   164_A     1.432     0    0.090   1.588     4.572   79.405   68.095
LGA    S   165_A      S   165_A     1.984     0    0.083   0.194     2.629   72.857   68.889
LGA    Q   166_A      Q   166_A     1.334     0    0.090   0.995     4.698   75.000   59.735
LGA    G   167_A      G   167_A     2.236     0    0.034   0.034     2.255   66.786   66.786
LGA    A   168_A      A   168_A     2.193     0    0.046   0.050     2.250   66.786   66.381
LGA    A   169_A      A   169_A     1.660     0    0.115   0.121     1.726   72.857   72.857
LGA    K   170_A      K   170_A     1.743     0    0.141   1.046     5.964   72.857   59.735
LGA    Y   171_A      Y   171_A     1.909     0    0.093   0.527     3.243   72.857   65.873
LGA    L   172_A      L   172_A     1.893     0    0.074   1.077     2.197   72.857   70.833
LGA    I   173_A      I   173_A     1.334     0    0.127   1.469     3.696   75.000   69.286
LGA    A   174_A      A   174_A     2.106     0    0.178   0.185     2.635   64.881   64.857
LGA    L   175_A      L   175_A     1.550     0    0.074   1.350     4.019   72.857   65.536
LGA    F   176_A      F   176_A     1.677     0    0.083   1.035     6.891   72.857   51.385
LGA    E   177_A      E   177_A     2.328     0    0.031   0.737     2.812   64.881   61.429
LGA    K   178_A      K   178_A     2.126     0    0.300   0.955     5.773   59.167   57.090
LGA    L   179_A      L   179_A     3.400     0    0.376   1.142     5.012   42.619   49.167
LGA    T   180_A      T   180_A     4.522     0    0.230   0.976     7.072   38.810   32.653
LGA    T   181_A      T   181_A     5.212     0    0.097   0.242     9.571   35.952   22.041
LGA    E   182_A      E   182_A     3.147     0    0.562   0.985     5.330   59.167   43.810
LGA    E   183_A      E   183_A     3.799     0    0.346   1.147    10.548   50.119   25.450
LGA    I   184_A      I   184_A     3.718     0    0.271   1.229     7.503   46.667   35.060
LGA    K   185_A      K   185_A     2.755     0    0.351   0.800    10.890   52.143   33.122
LGA    P   186_A      P   186_A     2.695     0    0.150   0.162     3.692   59.167   53.333
LGA    I   187_A      I   187_A     1.666     0    0.108   1.202     4.336   66.905   58.988
LGA    D   188_A      D   188_A     3.268     0    0.117   0.620     3.884   51.786   49.226
LGA    E   189_A      E   189_A     3.404     0    0.320   0.818     5.155   43.690   37.619
LGA    I   190_A      I   190_A     2.814     0    0.196   1.064     3.892   51.905   52.857
LGA    M   191_A      M   191_A     2.212     0    0.071   1.109     4.936   64.762   53.750
LGA    F   192_A      F   192_A     2.311     0    0.096   0.566     2.653   60.952   68.701
LGA    N   193_A      N   193_A     3.085     0    0.496   1.018     4.798   50.357   51.488
LGA    Q   194_A      Q   194_A     2.456     0    0.362   1.171     7.255   66.905   49.524
LGA    Q   195_A      Q   195_A     2.863     0    0.564   1.452     8.224   67.024   37.302
LGA    I   196_A      I   196_A     3.201     0    0.321   0.910     5.951   51.548   40.298
LGA    N   197_A      N   197_A     3.875     0    0.094   1.408     7.059   40.476   35.476
LGA    A   198_A      A   198_A     4.306     0    0.553   0.593     6.122   48.690   42.381
LGA    T   199_A      T   199_A     3.436     0    0.677   0.768     6.160   46.786   35.986
LGA    D   200_A      D   200_A     2.666     0    0.068   0.205     3.292   59.167   59.167
LGA    Y   201_A      Y   201_A     1.991     0    0.157   0.913     5.017   66.905   52.778
LGA    R   202_A      R   202_A     2.499     0    0.245   1.466     7.326   66.786   47.835
LGA    V   203_A      V   203_A     2.143     0    0.041   0.887     3.932   68.810   61.905
LGA    Y   204_A      Y   204_A     1.698     0    0.143   1.368     9.571   70.833   49.325
LGA    Q   205_A      Q   205_A     1.856     0    0.065   1.316     6.561   72.857   52.963
LGA    L   206_A      L   206_A     1.877     0    0.216   1.174     3.643   63.214   60.655
LGA    N   207_A      N   207_A     4.470     0    0.085   0.943     6.536   29.405   48.571
LGA    P   208_A      P   208_A     6.129     0    0.303   0.236     9.361   12.262    9.320
LGA    A   209_A      A   209_A     4.785     0    0.324   0.331     5.490   32.976   35.048
LGA    I   210_A      I   210_A     3.220     0    0.722   0.943     4.954   43.690   46.131
LGA    C   211_A      C   211_A     2.160     0    0.195   0.323     2.575   66.786   64.841
LGA    V   212_A      V   212_A     1.015     0    0.094   0.198     1.277   85.952   84.014
LGA    Q   213_A      Q   213_A     1.259     0    0.185   1.043     4.358   75.357   66.772
LGA    E   214_A      E   214_A     4.698     0    0.501   1.079     6.939   31.548   30.952
LGA    L   215_A      L   215_A     2.560     0    0.716   1.447     5.962   48.690   48.036
LGA    Q   216_A      Q   216_A     7.842     0    0.533   1.436    10.627    7.976    3.598
LGA    L   217_A      L   217_A     7.326     0    0.545   0.772    10.014    5.714   18.750
LGA    N   218_A      N   218_A     9.562     0    0.433   0.597    11.375    1.310    2.143
LGA    Q   219_A      Q   219_A    15.431     0    0.113   1.118    17.229    0.000    0.000
LGA    E   220_A      E   220_A    19.427     0    0.128   0.954    25.251    0.000    0.000
LGA    A   221_A      A   221_A    18.586     0    0.454   0.434    18.586    0.000    0.000
LGA    S   222_A      S   222_A    14.452     0    0.415   0.590    15.560    0.000    0.000
LGA    L   223_A      L   223_A    18.048     0    0.644   1.366    24.006    0.000    0.000
LGA    L   224_A      L   224_A    19.972     0    0.511   0.648    23.119    0.000    0.000
LGA    V   225_A      V   225_A    24.518     0    0.496   0.881    27.890    0.000    0.000
LGA    S   226_A      S   226_A    25.016     0    0.650   0.751    26.166    0.000    0.000
LGA    N   227_A      N   227_A    27.252     0    0.296   1.275    30.765    0.000    0.000
LGA    L   228_A      L   228_A    26.873     0    0.107   0.837    28.080    0.000    0.000
LGA    E   229_A      E   229_A    26.643     0    0.099   1.321    29.572    0.000    0.000
LGA    Q   230_A      Q   230_A    28.857     0    0.142   0.703    31.081    0.000    0.000
LGA    E   231_A      E   231_A    32.114     0    0.092   0.929    34.501    0.000    0.000
LGA    R   232_A      R   232_A    31.266     0    0.049   1.807    35.588    0.000    0.000
LGA    K   233_A      K   233_A    30.802     0    0.385   1.763    31.764    0.000    0.000
LGA    I   234_A      I   234_A    29.130     0    0.228   1.145    31.681    0.000    0.000
LGA    N   235_A      N   235_A    35.315     0    0.231   0.984    37.993    0.000    0.000
LGA    L   236_A      L   236_A    34.642     0    0.174   1.120    36.643    0.000    0.000
LGA    K   237_A      K   237_A    36.810     0    0.251   0.567    40.554    0.000    0.000
LGA    Y   238_A      Y   238_A    40.032     0    0.233   1.615    43.447    0.000    0.000
LGA    E   239_A      E   239_A    42.099     0    0.371   0.961    43.092    0.000    0.000
LGA    K   240_A      K   240_A    42.551     0    0.533   1.477    44.633    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):    15.207         15.270                 15.902           41.963   36.942

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  251  239    4.0    144    2.44    45.607    40.250     5.670

LGA_LOCAL      RMSD:   2.439  Number of atoms:  144  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  15.513  Number of assigned atoms:  239 
Std_ASGN_ATOMS RMSD:  15.207  Standard rmsd on all 239 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.335637 * X  +  -0.699239 * Y  +   0.631199 * Z  +  -4.054485
  Y_new =  -0.873722 * X  +  -0.019355 * Y  +  -0.486040 * Z  + -31.756630
  Z_new =   0.352075 * X  +  -0.714626 * Y  +  -0.604445 * Z  + -12.939641 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -1.937562 -0.359787 -2.272859   [DEG: -111.0141  -20.6143 -130.2252 ]
ZXZ:  0.914601  2.219865  2.683826   [DEG:   52.4028  127.1889  153.7719 ]
 
# END of job
