
#######################################################
#                                                     #
#                        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  288 ( 2287),  selected  216 , name one
# Molecule2: number of CA atoms  216 ( 1714),  selected  216 , 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:   216      19_A - 267_A       3.81     3.81
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    74     160_A - 266_A       1.98     4.11
  LONGEST_CONTINUOUS_SEGMENT:    74     161_A - 267_A       1.99     4.14
  LCS_AVERAGE:     24.04

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    34      19_A - 52_A        1.00     5.08
  LCS_AVERAGE:      7.74

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  216
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     Q    19_A     Q    19_A     34   69  216      4   38   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     E    20_A     E    20_A     34   69  216     14   30   68  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     L    21_A     L    21_A     34   69  216     13   34   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     P    22_A     P    22_A     34   69  216     14   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     A    23_A     A    23_A     34   69  216      7   33   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     Q    24_A     Q    24_A     34   69  216     13   31   68  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     V    25_A     V    25_A     34   69  216     14   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     K    26_A     K    26_A     34   69  216     20   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     G    27_A     G    27_A     34   69  216     14   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     L    28_A     L    28_A     34   69  216     14   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     A    29_A     A    29_A     34   69  216     17   44   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     A    30_A     A    30_A     34   69  216     20   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     H    31_A     H    31_A     34   69  216     20   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     I    32_A     I    32_A     34   69  216     20   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     N    33_A     N    33_A     34   69  216     20   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     L    34_A     L    34_A     34   69  216     20   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     S    35_A     S    35_A     34   69  216     20   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     L    36_A     L    36_A     34   69  216     20   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     S    37_A     S    37_A     34   69  216     20   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     Q    38_A     Q    38_A     34   69  216     20   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     D    39_A     D    39_A     34   69  216     20   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     L    40_A     L    40_A     34   69  216     20   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     A    41_A     A    41_A     34   69  216     17   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     I    42_A     I    42_A     34   69  216     17   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     S    43_A     S    43_A     34   69  216     17   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     E    44_A     E    44_A     34   69  216     11   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     S    45_A     S    45_A     34   69  216     11   43   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     L    46_A     L    46_A     34   69  216     12   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     A    47_A     A    47_A     34   69  216     10   35   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     N    48_A     N    48_A     34   69  216      8   28   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     S    49_A     S    49_A     34   69  216     10   32   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     Y    50_A     Y    50_A     34   69  216      8   26   70  109  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     F    51_A     F    51_A     34   69  216      6   29   69  109  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     I    52_A     I    52_A     34   69  216      6   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     E    53_A     E    53_A     29   69  216      4   15   65  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     Q    54_A     Q    54_A      6   69  216      6   21   65  103  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     W    55_A     W    55_A      5   69  216     12   28   68  103  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     V    56_A     V    56_A      4   69  216      3    4   12   49  109  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     R    57_A     R    57_A      4   69  216      3   25   51   82  111  137  150  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     E    58_A     E    58_A      4   69  216      3   25   46   81  110  137  150  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     G    59_A     G    59_A      4   69  216      4   23   63  101  124  138  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     L    60_A     L    60_A      5   69  216      3    5    5    7    8   10   13   16   36   47   96  180  193  205  208  212  214  216  216  216 
LCS_GDT     P    61_A     P    61_A      5   69  216      3    5    5    7   10   31  146  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     E    62_A     E    62_A     18   69  216      4   27   68  107  127  141  152  160  166  179  185  195  199  205  210  212  214  216  216  216 
LCS_GDT     E    63_A     E    63_A     20   69  216      4   12   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     R    64_A     R    64_A     21   69  216      3   22   53   89  125  141  152  160  166  179  185  195  199  205  210  212  214  216  216  216 
LCS_GDT     Q    65_A     Q    65_A     21   69  216     12   22   53   82  125  141  152  160  166  179  185  194  199  205  210  212  214  216  216  216 
LCS_GDT     N    66_A     N    66_A     21   69  216      8   24   53   82  123  141  152  160  166  179  185  194  199  205  210  212  214  216  216  216 
LCS_GDT     D    67_A     D    67_A     21   69  216     12   26   58  101  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     I    68_A     I    68_A     21   69  216     12   38   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     A    69_A     A    69_A     21   69  216     12   38   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     A    70_A     A    70_A     21   69  216      9   35   72  109  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     Y    71_A     Y    71_A     21   69  216     12   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     L    72_A     L    72_A     21   69  216     14   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     A    73_A     A    73_A     21   69  216     12   39   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     R    74_A     R    74_A     21   69  216     12   38   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     L    75_A     L    75_A     21   69  216     12   41   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     M    76_A     M    76_A     21   69  216     17   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     E    77_A     E    77_A     21   69  216     12   38   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     Q    78_A     Q    78_A     21   69  216     12   26   69  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     L    79_A     L    79_A     21   69  216      8   24   70  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     D    80_A     D    80_A     21   69  216      4   29   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     T    81_A     T    81_A     21   69  216     14   40   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     E    82_A     E    82_A     21   69  216     12   36   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     L    83_A     L    83_A     21   69  216     16   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     L    84_A     L    84_A     21   69  216     20   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     F    85_A     F    85_A     12   69  216      4   41   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     I    86_A     I    86_A      9   69  216      8   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     A    87_A     A    87_A      9   69  216      5   31   61  107  126  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     A    88_A     A    88_A      9   30  216      3   21   43   82  111  137  150  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     Q    89_A     Q    89_A      8   30  216      3   12   38   58   93  123  138  156  166  179  185  195  199  205  210  212  214  216  216  216 
LCS_GDT     H    90_A     H    90_A      8   30  216      3    9   23   46   66   98  119  138  159  175  185  193  199  204  210  212  214  216  216  216 
LCS_GDT     Q    91_A     Q    91_A      6    8  216      4    6    7   14   18   24   47   82  116  138  151  165  183  199  207  211  214  216  216  216 
LCS_GDT     G    92_A     G    92_A      6    8  216      4    6    7   14   18   24   33   53   70  118  151  165  175  188  203  211  214  216  216  216 
LCS_GDT     R    93_A     R    93_A      6    8  216      4    6    7   14   18   24   47   82  115  138  151  184  196  204  210  212  214  216  216  216 
LCS_GDT     G    94_A     G    94_A      6    8  216      4    6    8   12   25   36   78   99  147  172  184  195  199  205  210  212  214  216  216  216 
LCS_GDT     Y    95_A     Y    95_A      6    8  216      4    6    8   14   20   62   78  113  150  172  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     Y    96_A     Y    96_A      6    8  216      4    6   13   31   61   74   91  115  143  168  183  195  199  205  210  212  214  216  216  216 
LCS_GDT     F    97_A     F    97_A      6    8  216      3    4    8   11   18   62  103  136  161  176  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     Q    98_A     Q    98_A      6    8  216      5    5   13   22   50   61   86  113  151  169  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     L    99_A     L    99_A      6    8  216      5    5   10   24   50   63   99  138  161  176  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     R   100_A     R   100_A      6    9  216      5    5    6    8   34   63  112  141  161  178  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     N   101_A     N   101_A      6    9  216      5    7    7    9   18   28   62  117  159  175  185  194  199  205  210  212  214  216  216  216 
LCS_GDT     G   102_A     G   102_A      6    9  216      5    7    7    9   18   28   56  144  159  175  184  194  199  205  210  212  214  216  216  216 
LCS_GDT     E   103_A     E   103_A      6    9  216      4    7    7   13   18   33   54   82  132  162  179  189  199  204  210  212  214  216  216  216 
LCS_GDT     F   104_A     F   104_A      6    9  216      4    7    7   13   18   46   54   69  129  151  168  184  195  204  210  212  214  216  216  216 
LCS_GDT     L   105_A     L   105_A      6    9  216      4    7    7   13   18   33   50   61   81   92  161  178  192  203  209  212  214  216  216  216 
LCS_GDT     Q   106_A     Q   106_A      6    9  216      4    7    7   13   21   33   50   61   81   92  161  178  197  204  210  212  214  216  216  216 
LCS_GDT     R   107_A     R   107_A      6    9  216      3    5    7   18   72   96  131  148  163  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     I   108_A     I   108_A      6    9  216      3    8   19   38   55   97  133  150  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     I   109_A     I   109_A      6    8  216      3    5    7   14   25   42   83  106  121  158  182  195  199  205  210  212  214  216  216  216 
LCS_GDT     Q   110_A     Q   110_A      6    8  216      3    5    7    9   20   35   87  105  140  171  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     P   111_A     P   111_A      4    7  216      3    4    6    8   16   28   52  105  156  176  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     P   112_A     P   112_A      4    6  216      3    4    6    8   18   63   87  144  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     G   113_A     G   113_A      3    5  216      3    3    4   12   20   27   55   83   96  132  145  165  183  195  204  210  214  216  216  216 
LCS_GDT     S   114_A     S   114_A      4    5  216      3   10   15   50   62   86   96  112  140  156  168  178  189  200  207  210  214  216  216  216 
LCS_GDT     E   115_A     E   115_A      4    5  216      3   20   39   70  105  126  147  158  165  169  184  189  199  205  210  212  214  216  216  216 
LCS_GDT     D   116_A     D   116_A     10   13  216      4   19   42   74  104  137  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     D   117_A     D   117_A     10   13  216      4   10   10   18   24   50   60  117  138  165  183  194  199  205  210  212  214  216  216  216 
LCS_GDT     W   118_A     W   118_A     10   13  216      4   10   14   43   74  119  139  156  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     Y   119_A     Y   119_A     10   13  216      7   13   66  109  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     Y   120_A     Y   120_A     10   13  216      7   10   23   55   90  137  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     H   121_A     H   121_A     10   13  216      7   10   14   50   99  127  149  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     F   122_A     F   122_A     10   16  216      7   32   54   99  123  140  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     T   123_A     T   123_A     10   16  216      8   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     D   124_A     D   124_A     10   16  216      7   21   72  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     S   125_A     S   125_A     10   16  216      7   32   55   99  126  140  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     D   126_A     D   126_A     10   16  216      4    5   22   51   82  121  139  153  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     N   127_A     N   127_A      6   16  216      4    8   37   81  114  129  148  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     A   128_A     A   128_A      6   16  216      3   13   38   97  124  140  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     Y   129_A     Y   129_A      6   16  216      5   21   71  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     E   130_A     E   130_A      4   16  216      3   12   40   98  126  140  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     L   131_A     L   131_A      4   16  216      5   21   60  102  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     N   132_A     N   132_A      7   16  216      5    7   28   62  125  140  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     L   133_A     L   133_A      7   16  216      5   25   67  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     D   134_A     D   134_A      7   16  216      5   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     S   135_A     S   135_A      7   16  216      8   45   72  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     D   136_A     D   136_A      7   16  216      8   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     T   137_A     T   137_A      7   16  216      3   18   49   92  122  135  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     F   138_A     F   138_A      7   16  216      4   33   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     S   139_A     S   139_A      5    9  216      8   28   44   61   82  112  128  141  158  168  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     P   140_A     P   140_A      5   10  216      4    5    7   28   38   57   95  120  149  161  182  195  199  205  210  212  214  216  216  216 
LCS_GDT     D   141_A     D   141_A      4   11  216      3    4    6   22   29   43   86  123  149  168  183  195  199  205  210  212  214  216  216  216 
LCS_GDT     D   142_A     D   142_A      8   11  216      5    6    8   19   42  114  139  156  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     A   143_A     A   143_A      8   11  216      5    6    8   19   42   92  132  151  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     F   144_A     F   144_A      8   11  216      5    7    8   21   45  101  119  149  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     V   145_A     V   145_A      8   11  216      5    6    8   13   21   41  105  130  159  176  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     Y   146_A     Y   146_A      8   11  216      5    6    8   11   32   64  119  145  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     V   147_A     V   147_A      8   11  216      4    6    8   11   13   35   66  105  151  175  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     N   148_A     N   148_A      8   11  216      4    6    8   21   43   67  127  147  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     Y   149_A     Y   149_A      8   11  216      3    6    8   11   32   55  113  145  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     R   150_A     R   150_A      8   11  216      3    6    8   14   18   50  107  143  165  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     S   151_A     S   151_A      5   12  216      3    6    8   14   32   57  104  148  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     T   152_A     T   152_A      9   12  216      3    6   10   11   12   54  105  130  153  174  182  192  199  204  210  212  214  216  216  216 
LCS_GDT     V   153_A     V   153_A      9   12  216      3    6   10   11   18   76  133  150  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     N   154_A     N   154_A      9   12  216      4   20   51  100  124  138  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     A   155_A     A   155_A      9   12  216     13   24   41   63   96  124  139  153  162  175  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     A   156_A     A   156_A      9   12  216      4    7   30   44   61   83  108  132  144  157  172  187  199  205  210  212  214  216  216  216 
LCS_GDT     N   157_A     N   157_A      9   12  216      4    6   10   11   56   75   97  129  143  155  167  185  198  205  210  212  214  216  216  216 
LCS_GDT     G   158_A     G   158_A      9   12  216      4    6   10   14   38   91  120  134  152  163  178  192  199  205  210  212  214  216  216  216 
LCS_GDT     R   159_A     R   159_A      9   43  216      4    6   19   31   40   88  143  159  165  175  185  195  199  205  210  212  214  216  216  216 
LCS_GDT     P   160_A     P   160_A     17   74  216      4    6   49   92  125  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     L   161_A     L   161_A     18   74  216      8   25   58   87  119  138  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     V   162_A     V   162_A     18   74  216      5   18   48   81  111  137  150  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     V   163_A     V   163_A     18   74  216      8   34   72  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     A   164_A     A   164_A     18   74  216     13   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     G   165_A     G   165_A     18   74  216      4   29   66  108  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     A   166_A     A   166_A     19   74  216     20   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     G   167_A     G   167_A     19   74  216      9   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     L   168_A     L   168_A     19   74  216      9   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     D   169_A     D   169_A     19   74  216      6   39   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     L   170_A     L   170_A     19   74  216      7   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     S   171_A     S   171_A     19   74  216     17   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     Q   172_A     Q   172_A     19   74  216     20   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     M   173_A     M   173_A     19   74  216     11   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     A   174_A     A   174_A     19   74  216     19   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     S   175_A     S   175_A     19   74  216     20   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     L   176_A     L   176_A     19   74  216     14   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     I   177_A     I   177_A     19   74  216     20   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     D   178_A     D   178_A     19   74  216      7   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     D   179_A     D   179_A     19   74  216      6   31   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     F   180_A     F   180_A     19   74  216      5   26   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     R   181_A     R   181_A     19   74  216      4   32   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     L   182_A     L   182_A     19   74  216      6   28   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     G   183_A     G   183_A     19   74  216      6   32   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     G   184_A     G   184_A     19   74  216      3    8   37   86  115  138  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     S   185_A     S   185_A     19   74  216      3   15   48  100  126  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     G   186_A     G   186_A     16   74  216     10   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     H   187_A     H   187_A     16   74  216      9   36   67   96  126  140  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     A   188_A     A   188_A     16   74  216     11   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     S   189_A     S   189_A     16   74  216     13   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     L   190_A     L   190_A     16   74  216     13   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     L   191_A     L   191_A     16   74  216     13   39   73  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     S   192_A     S   192_A     16   74  216     13   35   70  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     A   193_A     A   193_A     16   74  216     13   32   70  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     E   194_A     E   194_A     16   74  216     13   29   52   99  126  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     G   195_A     G   195_A     16   74  216     13   32   70  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     E   196_A     E   196_A     16   74  216     13   32   70  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     L   197_A     L   197_A     16   74  216     13   40   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     L   198_A     L   198_A     16   74  216     13   39   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     V   199_A     V   199_A     16   74  216     13   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     R   200_A     R   200_A     16   74  216      6   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     S   201_A     S   201_A     16   74  216      3   21   73  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     L   235_A     L   235_A      4   74  216      3    6   15   39   84  119  140  156  165  176  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     Q   236_A     Q   236_A     17   74  216      8   29   68  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     V   237_A     V   237_A     17   74  216      8   34   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     H   238_A     H   238_A     17   74  216      9   43   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     E   239_A     E   239_A     17   74  216      8   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     A   240_A     A   240_A     17   74  216     10   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     T   241_A     T   241_A     17   74  216     10   23   52   99  126  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     R   242_A     R   242_A     17   74  216      5   20   46   84  124  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     D   243_A     D   243_A     17   74  216      4   20   38   73  103  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     G   244_A     G   244_A     17   74  216      3   27   50   86  122  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     Q   245_A     Q   245_A     17   74  216      3   18   50   90  123  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     E   246_A     E   246_A     21   74  216     11   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     V   247_A     V   247_A     21   74  216     16   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     L   248_A     L   248_A     21   74  216     20   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     V   249_A     V   249_A     21   74  216     20   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     S   250_A     S   250_A     21   74  216      9   41   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     T   251_A     T   251_A     21   74  216     12   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     I   252_A     I   252_A     21   74  216     12   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     W   253_A     W   253_A     21   74  216      9   29   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     L   254_A     L   254_A     21   74  216      9   29   65  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     P   255_A     P   255_A     21   74  216      4   27   44   79  122  140  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     E   256_A     E   256_A     21   74  216      8   17   41   75  103  139  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     L   257_A     L   257_A     21   74  216      8   27   49   97  126  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     Q   258_A     Q   258_A     21   74  216      8   27   67  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     R   259_A     R   259_A     21   74  216     12   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     Y   260_A     Y   260_A     21   74  216     12   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     L   261_A     L   261_A     21   74  216     13   45   73  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     M   262_A     M   262_A     21   74  216     13   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     V   263_A     V   263_A     21   74  216     13   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     E   264_A     E   264_A     21   74  216     20   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     V   265_A     V   265_A     21   74  216     11   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     D   266_A     D   266_A     21   74  216     12   45   74  110  127  141  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_GDT     K   267_A     K   267_A      8   74  216     12   29   47   79  118  138  152  160  166  179  186  195  199  205  210  212  214  216  216  216 
LCS_AVERAGE  LCS_A:  43.93  (   7.74   24.04  100.00 )

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     20     45     74    110    127    141    152    160    166    179    186    195    199    205    210    212    214    216    216    216 
GDT PERCENT_AT   9.26  20.83  34.26  50.93  58.80  65.28  70.37  74.07  76.85  82.87  86.11  90.28  92.13  94.91  97.22  98.15  99.07 100.00 100.00 100.00
GDT RMS_LOCAL    0.32   0.69   1.04   1.34   1.50   1.71   1.86   2.02   2.17   2.55   2.87   3.09   3.15   3.38   3.56   3.62   3.72   3.81   3.81   3.81
GDT RMS_ALL_AT   4.19   4.22   4.13   4.06   4.11   4.18   4.16   4.06   4.02   3.91   3.83   3.84   3.83   3.83   3.81   3.81   3.82   3.81   3.81   3.81

# Checking swapping
#   possible swapping detected:  E    58_A      E    58_A
#   possible swapping detected:  E    77_A      E    77_A
#   possible swapping detected:  F    85_A      F    85_A
#   possible swapping detected:  Y    96_A      Y    96_A
#   possible swapping detected:  F    97_A      F    97_A
#   possible swapping detected:  E   115_A      E   115_A
#   possible swapping detected:  D   117_A      D   117_A
#   possible swapping detected:  Y   119_A      Y   119_A
#   possible swapping detected:  F   122_A      F   122_A
#   possible swapping detected:  E   130_A      E   130_A
#   possible swapping detected:  D   134_A      D   134_A
#   possible swapping detected:  D   142_A      D   142_A
#   possible swapping detected:  F   144_A      F   144_A
#   possible swapping detected:  Y   146_A      Y   146_A
#   possible swapping detected:  E   194_A      E   194_A
#   possible swapping detected:  D   243_A      D   243_A
#   possible swapping detected:  E   246_A      E   246_A
#   possible swapping detected:  E   256_A      E   256_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    Q    19_A      Q    19_A     1.448     0    0.579   0.964     6.923   67.262   50.741
LGA    E    20_A      E    20_A     1.983     0    0.059   1.186     3.092   70.833   69.524
LGA    L    21_A      L    21_A     1.757     0    0.051   1.157     2.917   77.143   72.024
LGA    P    22_A      P    22_A     0.885     0    0.109   0.175     1.876   90.595   84.218
LGA    A    23_A      A    23_A     1.402     0    0.059   0.060     2.099   81.429   78.095
LGA    Q    24_A      Q    24_A     1.811     0    0.060   1.060     2.415   77.143   75.767
LGA    V    25_A      V    25_A     1.253     0    0.026   1.183     2.836   85.952   79.320
LGA    K    26_A      K    26_A     0.571     0    0.032   1.151     7.796   90.476   65.185
LGA    G    27_A      G    27_A     0.743     0    0.041   0.041     0.886   90.476   90.476
LGA    L    28_A      L    28_A     1.323     0    0.043   0.773     3.244   81.429   73.274
LGA    A    29_A      A    29_A     1.201     0    0.029   0.040     1.302   81.429   81.429
LGA    A    30_A      A    30_A     0.856     0    0.055   0.056     1.033   88.214   88.667
LGA    H    31_A      H    31_A     1.007     0    0.041   0.975     3.159   85.952   79.476
LGA    I    32_A      I    32_A     1.040     0    0.036   0.111     1.380   85.952   83.690
LGA    N    33_A      N    33_A     0.974     0    0.031   0.931     2.566   88.214   80.714
LGA    L    34_A      L    34_A     0.735     0    0.064   0.954     3.855   88.214   74.583
LGA    S    35_A      S    35_A     0.936     0    0.053   0.590     2.686   90.476   84.921
LGA    L    36_A      L    36_A     1.006     0    0.075   0.953     4.935   85.952   69.583
LGA    S    37_A      S    37_A     1.015     0    0.041   0.668     2.205   85.952   81.667
LGA    Q    38_A      Q    38_A     0.859     0    0.041   0.895     4.495   90.476   74.127
LGA    D    39_A      D    39_A     0.629     0    0.039   0.940     3.814   90.476   75.357
LGA    L    40_A      L    40_A     0.717     0    0.041   1.397     4.529   90.476   72.976
LGA    A    41_A      A    41_A     0.478     0    0.033   0.046     0.560   97.619   98.095
LGA    I    42_A      I    42_A     0.172     0    0.040   0.733     3.635  100.000   91.726
LGA    S    43_A      S    43_A     0.745     0    0.037   0.711     3.214   88.214   80.714
LGA    E    44_A      E    44_A     1.020     0    0.054   0.472     1.632   83.690   81.481
LGA    S    45_A      S    45_A     1.044     0    0.057   0.622     2.235   85.952   81.667
LGA    L    46_A      L    46_A     0.877     0    0.043   0.225     1.371   85.952   88.274
LGA    A    47_A      A    47_A     1.552     0    0.042   0.046     2.174   72.976   72.952
LGA    N    48_A      N    48_A     2.200     0    0.248   0.960     6.025   68.810   50.655
LGA    S    49_A      S    49_A     1.808     0    0.090   0.707     2.075   75.000   72.937
LGA    Y    50_A      Y    50_A     2.036     0    0.028   1.503     7.386   70.952   53.889
LGA    F    51_A      F    51_A     2.194     0    0.076   0.169     4.970   70.833   50.693
LGA    I    52_A      I    52_A     1.307     0    0.066   0.678     1.897   79.286   78.214
LGA    E    53_A      E    53_A     2.177     0    0.070   0.233     4.165   67.024   57.037
LGA    Q    54_A      Q    54_A     2.744     0    0.036   1.173     7.829   57.262   41.376
LGA    W    55_A      W    55_A     2.723     0    0.620   1.227     6.963   52.619   38.673
LGA    V    56_A      V    56_A     3.323     0    0.592   0.832     7.730   67.500   45.102
LGA    R    57_A      R    57_A     4.149     0    0.089   1.152    15.104   38.214   15.671
LGA    E    58_A      E    58_A     4.357     0    0.585   1.075    10.894   59.405   29.471
LGA    G    59_A      G    59_A     3.745     0    0.652   0.652     3.911   46.786   46.786
LGA    L    60_A      L    60_A     6.897     0    0.538   1.273    14.502   19.524    9.821
LGA    P    61_A      P    61_A     4.278     0    0.642   0.655     5.502   34.524   32.585
LGA    E    62_A      E    62_A     2.627     0    0.203   1.159     6.144   60.952   46.561
LGA    E    63_A      E    63_A     1.656     0    0.093   1.269     6.110   67.262   53.862
LGA    R    64_A      R    64_A     3.004     0    0.201   1.702     7.015   53.690   45.498
LGA    Q    65_A      Q    65_A     3.259     0    0.062   1.165     4.215   51.786   56.296
LGA    N    66_A      N    66_A     3.364     0    0.063   1.142     4.096   53.571   52.083
LGA    D    67_A      D    67_A     2.540     0    0.105   0.966     3.140   60.952   59.107
LGA    I    68_A      I    68_A     1.842     0    0.080   0.711     3.496   70.833   67.976
LGA    A    69_A      A    69_A     1.828     0    0.082   0.104     1.990   72.857   72.857
LGA    A    70_A      A    70_A     2.199     0    0.037   0.058     2.452   68.810   68.000
LGA    Y    71_A      Y    71_A     1.153     0    0.061   0.397     2.220   81.548   83.175
LGA    L    72_A      L    72_A     0.840     0    0.021   0.957     2.292   90.476   84.048
LGA    A    73_A      A    73_A     1.409     0    0.035   0.059     1.655   79.286   78.000
LGA    R    74_A      R    74_A     1.479     0    0.098   1.154     4.071   79.286   69.913
LGA    L    75_A      L    75_A     1.180     0    0.033   1.067     3.863   81.429   73.512
LGA    M    76_A      M    76_A     0.687     0    0.030   1.165     5.048   90.476   75.060
LGA    E    77_A      E    77_A     1.502     0    0.070   1.076     4.403   75.000   68.995
LGA    Q    78_A      Q    78_A     1.997     0    0.025   1.157     5.957   68.810   51.587
LGA    L    79_A      L    79_A     1.913     0    0.648   1.172     6.244   69.286   59.226
LGA    D    80_A      D    80_A     1.707     0    0.062   1.073     6.537   71.071   52.500
LGA    T    81_A      T    81_A     1.647     0    0.063   1.122     3.618   81.548   74.830
LGA    E    82_A      E    82_A     1.413     0    0.132   0.714     4.820   77.143   58.942
LGA    L    83_A      L    83_A     1.305     0    0.069   1.349     5.631   88.214   64.405
LGA    L    84_A      L    84_A     0.739     0    0.035   1.309     3.603   83.810   74.702
LGA    F    85_A      F    85_A     1.459     0    0.092   0.293     4.415   83.690   59.351
LGA    I    86_A      I    86_A     1.253     0    0.039   0.156     1.954   77.143   77.143
LGA    A    87_A      A    87_A     2.647     0    0.050   0.056     3.292   55.476   55.810
LGA    A    88_A      A    88_A     4.018     0    0.030   0.053     4.636   40.357   38.571
LGA    Q    89_A      Q    89_A     5.300     0    0.615   1.219     9.273   18.095   34.762
LGA    H    90_A      H    90_A     7.053     0    0.561   1.055     7.886   11.429   12.095
LGA    Q    91_A      Q    91_A    10.847     0    0.334   1.147    14.271    0.357    0.159
LGA    G    92_A      G    92_A    11.224     0    0.107   0.107    11.673    0.000    0.000
LGA    R    93_A      R    93_A     9.772     0    0.150   1.430    14.201    2.024    1.948
LGA    G    94_A      G    94_A     8.403     0    0.132   0.132     9.141    3.452    3.452
LGA    Y    95_A      Y    95_A     8.204     0    0.143   1.429    18.315    4.286    1.825
LGA    Y    96_A      Y    96_A     8.228     0    0.079   1.236    11.802    6.548    3.810
LGA    F    97_A      F    97_A     7.461     0    0.070   1.243    10.783    6.786    4.935
LGA    Q    98_A      Q    98_A     7.920     0    0.191   0.745    11.064   10.357    5.503
LGA    L    99_A      L    99_A     7.258     0    0.077   0.154     9.352    7.976    5.952
LGA    R   100_A      R   100_A     6.565     0    0.363   1.053     6.885   14.286   24.935
LGA    N   101_A      N   101_A     6.720     0    0.360   0.463     7.224   14.286   15.952
LGA    G   102_A      G   102_A     6.730     0    0.106   0.106     7.658   10.952   10.952
LGA    E   103_A      E   103_A     8.136     0    0.073   0.527     8.772    4.405    5.397
LGA    F   104_A      F   104_A     9.088     0    0.158   0.165    10.918    1.548    0.909
LGA    L   105_A      L   105_A     9.376     0    0.074   0.998     9.486    1.429    5.060
LGA    Q   106_A      Q   106_A     9.271     0    0.061   1.103    11.580    3.690    2.540
LGA    R   107_A      R   107_A     6.848     0    0.022   1.503    11.632   10.952    6.537
LGA    I   108_A      I   108_A     6.671     0    0.167   1.208     7.793   12.619   11.488
LGA    I   109_A      I   109_A     8.629     0    0.567   1.107    11.141    2.857    4.940
LGA    Q   110_A      Q   110_A     7.742     0    0.143   1.039    11.198   10.119    6.720
LGA    P   111_A      P   111_A     7.867     0    0.686   0.648     9.585   14.762    9.116
LGA    P   112_A      P   112_A     6.779     0    0.191   0.396    10.812   12.738    7.687
LGA    G   113_A      G   113_A    10.041     0    0.485   0.485    10.547    1.071    1.071
LGA    S   114_A      S   114_A     8.373     0    0.538   0.667     9.931    9.643    7.302
LGA    E   115_A      E   115_A     5.310     0    0.117   1.589     8.071   32.024   20.847
LGA    D   116_A      D   116_A     3.517     0    0.656   0.584     5.087   43.452   37.500
LGA    D   117_A      D   117_A     6.169     0    0.086   0.966     7.716   21.548   18.631
LGA    W   118_A      W   118_A     4.879     0    0.031   0.159     4.988   34.286   48.503
LGA    Y   119_A      Y   119_A     2.403     0    0.079   0.321     3.129   59.167   70.437
LGA    Y   120_A      Y   120_A     3.435     0    0.100   1.351     9.969   46.667   26.825
LGA    H   121_A      H   121_A     4.260     0    0.082   0.172     6.702   40.238   27.762
LGA    F   122_A      F   122_A     3.290     0    0.049   0.706     4.036   57.381   48.485
LGA    T   123_A      T   123_A     0.882     0    0.133   0.134     1.612   83.810   85.374
LGA    D   124_A      D   124_A     1.973     0    0.182   0.297     4.699   66.905   55.298
LGA    S   125_A      S   125_A     3.245     0    0.185   0.592     4.268   51.786   49.048
LGA    D   126_A      D   126_A     5.376     0    0.199   0.246     8.251   27.500   17.381
LGA    N   127_A      N   127_A     4.340     0    0.136   1.111     9.300   49.048   30.774
LGA    A   128_A      A   128_A     3.266     0    0.654   0.606     4.366   53.690   50.381
LGA    Y   129_A      Y   129_A     1.813     0    0.061   1.456     7.029   59.881   38.492
LGA    E   130_A      E   130_A     2.790     0    0.076   0.919    10.520   61.190   31.799
LGA    L   131_A      L   131_A     2.381     0    0.311   1.348     9.050   75.119   43.512
LGA    N   132_A      N   132_A     2.840     0    0.155   1.222     4.715   62.857   56.845
LGA    L   133_A      L   133_A     2.040     0    0.019   0.951     3.275   64.762   61.964
LGA    D   134_A      D   134_A     1.688     0    0.034   0.558     2.859   72.857   71.964
LGA    S   135_A      S   135_A     1.910     0    0.029   0.622     4.153   72.857   65.556
LGA    D   136_A      D   136_A     1.813     0    0.133   0.829     4.580   63.214   54.702
LGA    T   137_A      T   137_A     3.948     0    0.258   1.029     6.193   41.310   35.102
LGA    F   138_A      F   138_A     2.051     0    0.055   1.302     4.453   52.500   57.749
LGA    S   139_A      S   139_A     6.065     0    0.588   0.550     7.189   19.405   17.460
LGA    P   140_A      P   140_A     8.285     0    0.692   0.582     9.780    6.667    4.762
LGA    D   141_A      D   141_A     7.695     0    0.100   0.257    11.159    8.690    5.952
LGA    D   142_A      D   142_A     4.952     0    0.233   1.152     5.526   30.119   27.560
LGA    A   143_A      A   143_A     5.250     0    0.055   0.082     5.552   25.000   24.286
LGA    F   144_A      F   144_A     5.600     0    0.065   0.289     6.817   23.810   19.307
LGA    V   145_A      V   145_A     6.239     0    0.116   0.129     7.268   16.190   14.014
LGA    Y   146_A      Y   146_A     5.789     0    0.126   0.152     7.384   20.357   17.698
LGA    V   147_A      V   147_A     6.140     0    0.281   0.264     7.216   17.262   15.102
LGA    N   148_A      N   148_A     5.570     0    0.144   1.051     5.743   25.000   33.333
LGA    Y   149_A      Y   149_A     5.552     0    0.060   1.008    13.080   21.429   10.516
LGA    R   150_A      R   150_A     6.072     0    0.085   1.569    10.276   20.357    9.697
LGA    S   151_A      S   151_A     5.244     0    0.083   0.604     6.618   21.786   23.254
LGA    T   152_A      T   152_A     7.687     0    0.669   1.386    11.688   12.738    7.891
LGA    V   153_A      V   153_A     5.424     0    0.055   0.068     7.478   30.952   25.238
LGA    N   154_A      N   154_A     3.663     0    0.165   1.085     6.251   33.810   38.631
LGA    A   155_A      A   155_A     6.290     0    0.096   0.112     7.527   15.119   14.762
LGA    A   156_A      A   156_A     9.509     0    0.087   0.084    10.230    1.429    1.143
LGA    N   157_A      N   157_A     9.280     0    0.257   1.262    10.332    1.071    2.917
LGA    G   158_A      G   158_A     7.883     0    0.041   0.041     8.068   10.595   10.595
LGA    R   159_A      R   159_A     5.198     0    0.062   1.372    12.009   34.167   17.922
LGA    P   160_A      P   160_A     2.771     0    0.103   0.141     4.230   53.571   49.252
LGA    L   161_A      L   161_A     3.545     0    0.040   1.410     5.361   43.452   43.988
LGA    V   162_A      V   162_A     3.904     0    0.132   0.160     5.646   46.667   38.707
LGA    V   163_A      V   163_A     1.955     0    0.168   0.174     2.659   68.929   71.973
LGA    A   164_A      A   164_A     1.238     0    0.071   0.110     1.728   75.000   78.095
LGA    G   165_A      G   165_A     2.057     0    0.160   0.160     2.057   75.119   75.119
LGA    A   166_A      A   166_A     0.701     0    0.083   0.079     1.280   90.476   88.667
LGA    G   167_A      G   167_A     1.097     0    0.146   0.146     1.852   81.548   81.548
LGA    L   168_A      L   168_A     0.974     0    0.086   1.051     2.967   85.952   76.548
LGA    D   169_A      D   169_A     1.182     0    0.144   0.299     1.566   81.429   79.286
LGA    L   170_A      L   170_A     0.945     0    0.081   0.859     3.809   88.214   75.179
LGA    S   171_A      S   171_A     0.829     0    0.029   0.623     1.737   90.476   87.540
LGA    Q   172_A      Q   172_A     0.846     0    0.025   1.262     4.548   90.476   71.217
LGA    M   173_A      M   173_A     1.167     0    0.036   0.875     3.023   83.690   77.560
LGA    A   174_A      A   174_A     1.006     0    0.043   0.050     1.046   83.690   83.238
LGA    S   175_A      S   175_A     0.834     0    0.129   0.143     1.721   90.476   86.032
LGA    L   176_A      L   176_A     0.762     0    0.182   1.284     3.097   88.214   75.774
LGA    I   177_A      I   177_A     0.411     0    0.060   1.183     2.959   97.619   83.690
LGA    D   178_A      D   178_A     0.635     0    0.080   0.271     1.986   86.190   83.869
LGA    D   179_A      D   179_A     1.739     0    0.074   0.913     3.657   72.976   65.238
LGA    F   180_A      F   180_A     1.752     0    0.044   1.552     9.006   72.857   41.948
LGA    R   181_A      R   181_A     1.567     0    0.074   1.286     5.598   77.143   53.030
LGA    L   182_A      L   182_A     1.553     0    0.062   1.408     4.835   72.857   62.857
LGA    G   183_A      G   183_A     1.771     0    0.063   0.063     2.872   66.905   66.905
LGA    G   184_A      G   184_A     3.334     0    0.674   0.674     5.148   45.833   45.833
LGA    S   185_A      S   185_A     2.570     0    0.685   0.738     3.979   55.595   56.111
LGA    G   186_A      G   186_A     1.612     0    0.074   0.074     2.584   69.048   69.048
LGA    H   187_A      H   187_A     2.913     0    0.167   1.174     3.573   62.857   58.857
LGA    A   188_A      A   188_A     1.653     0    0.083   0.091     2.035   70.833   71.238
LGA    S   189_A      S   189_A     1.588     0    0.071   0.686     2.639   72.857   70.238
LGA    L   190_A      L   190_A     1.532     0    0.059   0.172     1.556   77.143   79.286
LGA    L   191_A      L   191_A     1.735     0    0.055   0.294     2.238   72.857   74.048
LGA    S   192_A      S   192_A     2.073     0    0.059   0.659     4.207   68.810   62.857
LGA    A   193_A      A   193_A     2.179     0    0.094   0.093     2.249   64.762   64.762
LGA    E   194_A      E   194_A     2.646     0    0.169   0.931     6.525   59.048   44.127
LGA    G   195_A      G   195_A     2.207     0    0.079   0.079     2.401   66.786   66.786
LGA    E   196_A      E   196_A     1.993     0    0.111   0.677     5.045   70.833   58.307
LGA    L   197_A      L   197_A     1.494     0    0.051   0.921     2.821   75.000   72.143
LGA    L   198_A      L   198_A     1.772     0    0.037   1.314     3.716   72.857   69.226
LGA    V   199_A      V   199_A     1.143     0    0.086   1.006     2.926   83.690   76.803
LGA    R   200_A      R   200_A     0.828     0    0.148   0.975     2.314   81.786   74.762
LGA    S   201_A      S   201_A     1.601     0    0.545   0.918     2.807   71.071   69.048
LGA    L   235_A      L   235_A     5.767     0    0.111   0.999    10.636   26.786   15.179
LGA    Q   236_A      Q   236_A     2.215     0    0.225   0.874     7.080   61.071   45.767
LGA    V   237_A      V   237_A     1.530     0    0.054   1.135     2.278   72.857   70.544
LGA    H   238_A      H   238_A     1.337     0    0.050   1.197     5.625   77.143   57.524
LGA    E   239_A      E   239_A     1.666     0    0.100   0.986     2.441   75.000   72.963
LGA    A   240_A      A   240_A     1.749     0    0.082   0.079     1.989   72.857   72.857
LGA    T   241_A      T   241_A     2.826     0    0.129   0.180     3.741   55.357   50.204
LGA    R   242_A      R   242_A     2.889     0    0.194   1.624     4.312   50.357   49.091
LGA    D   243_A      D   243_A     3.612     0    0.329   0.973     6.572   50.119   37.083
LGA    G   244_A      G   244_A     3.689     0    0.480   0.480     3.689   46.667   46.667
LGA    Q   245_A      Q   245_A     3.174     0    0.052   0.420     7.119   57.381   37.037
LGA    E   246_A      E   246_A     1.392     0    0.070   0.680     1.992   79.286   76.667
LGA    V   247_A      V   247_A     0.982     0    0.037   0.990     2.265   85.952   81.701
LGA    L   248_A      L   248_A     0.482     0    0.049   1.070     3.614   97.619   85.952
LGA    V   249_A      V   249_A     0.316     0    0.044   1.003     2.596  100.000   88.844
LGA    S   250_A      S   250_A     0.868     0    0.072   0.065     1.277   90.476   87.460
LGA    T   251_A      T   251_A     0.884     0    0.052   0.097     1.020   90.476   89.184
LGA    I   252_A      I   252_A     1.268     0    0.107   0.216     1.775   81.429   81.488
LGA    W   253_A      W   253_A     1.520     0    0.105   1.421     8.160   75.000   47.925
LGA    L   254_A      L   254_A     2.061     0    0.041   0.935     3.534   66.786   68.512
LGA    P   255_A      P   255_A     3.027     0    0.111   0.102     3.308   51.786   54.150
LGA    E   256_A      E   256_A     3.302     0    0.032   0.985     6.492   50.000   42.222
LGA    L   257_A      L   257_A     2.689     0    0.140   1.392     5.322   60.952   48.750
LGA    Q   258_A      Q   258_A     2.007     0    0.091   0.867     6.356   73.095   54.021
LGA    R   259_A      R   259_A     1.554     0    0.104   0.565     6.928   79.286   51.385
LGA    Y   260_A      Y   260_A     1.548     0    0.115   0.234     1.624   75.000   80.833
LGA    L   261_A      L   261_A     1.739     0    0.088   0.985     2.782   75.000   69.940
LGA    M   262_A      M   262_A     1.269     0    0.074   1.471     5.300   79.286   63.512
LGA    V   263_A      V   263_A     1.240     0    0.030   0.129     1.470   88.333   85.374
LGA    E   264_A      E   264_A     0.446     0    0.061   0.809     2.890   97.619   80.529
LGA    V   265_A      V   265_A     0.430     0    0.067   0.173     0.776   95.238   95.918
LGA    D   266_A      D   266_A     1.184     0    0.050   0.143     2.520   73.452   78.571
LGA    K   267_A      K   267_A     3.855     0    0.046   0.744    12.748   46.905   23.598

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      216     864    864  100.00    1714   1714  100.00               216
SUMMARY(RMSD_GDC):     3.813          3.772                  4.613           58.205   52.036

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  288  216    4.0    160    2.02    60.995    55.279     7.551

LGA_LOCAL      RMSD:   2.019  Number of atoms:  160  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   4.059  Number of assigned atoms:  216 
Std_ASGN_ATOMS RMSD:   3.813  Standard rmsd on all 216 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.053136 * X  +  -0.980582 * Y  +   0.188775 * Z  + -31.530952
  Y_new =   0.730043 * X  +   0.090837 * Y  +   0.677337 * Z  +  44.491703
  Z_new =  -0.681332 * X  +   0.173805 * Y  +   0.711040 * Z  +  25.293051 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  1.643453  0.749581  0.239736   [DEG:   94.1629   42.9478   13.7359 ]
ZXZ:  2.869789  0.779820 -1.321028   [DEG:  164.4268   44.6804  -75.6893 ]
 
# END of job
