
#######################################################
#                                                     #
#                        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       4.28     4.28
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    71      19_A - 89_A        1.95     4.77
  LCS_AVERAGE:     17.69

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    36      21_A - 56_A        0.99     5.01
  LCS_AVERAGE:      6.74

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     35   71  216      4   22   47   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     E    20_A     E    20_A     35   71  216      8   20   49   74   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     L    21_A     L    21_A     36   71  216      9   31   50   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     P    22_A     P    22_A     36   71  216     10   35   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     A    23_A     A    23_A     36   71  216     11   22   52   76   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     Q    24_A     Q    24_A     36   71  216     11   31   52   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     V    25_A     V    25_A     36   71  216     11   33   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     K    26_A     K    26_A     36   71  216     11   33   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     G    27_A     G    27_A     36   71  216     11   31   52   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     L    28_A     L    28_A     36   71  216     11   33   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     A    29_A     A    29_A     36   71  216     17   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     A    30_A     A    30_A     36   71  216     11   33   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     H    31_A     H    31_A     36   71  216     12   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     I    32_A     I    32_A     36   71  216     17   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     N    33_A     N    33_A     36   71  216     16   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     L    34_A     L    34_A     36   71  216     12   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     S    35_A     S    35_A     36   71  216     17   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     L    36_A     L    36_A     36   71  216     16   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     S    37_A     S    37_A     36   71  216     17   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     Q    38_A     Q    38_A     36   71  216     17   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     D    39_A     D    39_A     36   71  216     17   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     L    40_A     L    40_A     36   71  216     17   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     A    41_A     A    41_A     36   71  216     17   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     I    42_A     I    42_A     36   71  216     17   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     S    43_A     S    43_A     36   71  216      7   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     E    44_A     E    44_A     36   71  216     17   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     S    45_A     S    45_A     36   71  216     17   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     L    46_A     L    46_A     36   71  216      7   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     A    47_A     A    47_A     36   71  216      7   37   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     N    48_A     N    48_A     36   71  216     11   37   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     S    49_A     S    49_A     36   71  216     11   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     Y    50_A     Y    50_A     36   71  216     11   36   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     F    51_A     F    51_A     36   71  216     11   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     I    52_A     I    52_A     36   71  216     17   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     E    53_A     E    53_A     36   71  216     17   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     Q    54_A     Q    54_A     36   71  216     11   33   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     W    55_A     W    55_A     36   71  216     12   33   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     V    56_A     V    56_A     36   71  216     11   25   54   77   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     R    57_A     R    57_A     34   71  216     11   25   51   77   97  121  137  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     E    58_A     E    58_A     34   71  216     11   16   48   76   97  121  137  150  159  171  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     G    59_A     G    59_A     17   71  216      3    5   22   65   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     L    60_A     L    60_A      3   71  216      3    3    4    5   25   59  137  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     P    61_A     P    61_A      4   71  216      3   21   40   74   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     E    62_A     E    62_A      4   71  216      3    4    5   21   27   45  105  121  133  160  173  184  193  199  201  208  211  214  215  216 
LCS_GDT     E    63_A     E    63_A     12   71  216      3    4    5   34   62   78  104  113  129  152  170  176  189  195  200  201  206  213  215  216 
LCS_GDT     R    64_A     R    64_A     16   71  216     11   31   52   75   97  121  137  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     Q    65_A     Q    65_A     16   71  216     11   31   52   75   97  121  137  150  161  172  185  193  196  202  207  210  212  214  215  216 
LCS_GDT     N    66_A     N    66_A     16   71  216     11   22   52   75   97  121  137  150  161  172  185  193  196  202  207  210  212  214  215  216 
LCS_GDT     D    67_A     D    67_A     16   71  216     11   37   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     I    68_A     I    68_A     16   71  216     11   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     A    69_A     A    69_A     16   71  216     11   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     A    70_A     A    70_A     16   71  216     11   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     Y    71_A     Y    71_A     16   71  216     17   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     L    72_A     L    72_A     16   71  216     11   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     A    73_A     A    73_A     16   71  216     11   22   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     R    74_A     R    74_A     16   71  216     11   22   56   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     L    75_A     L    75_A     16   71  216      9   24   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     M    76_A     M    76_A     16   71  216      9   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     E    77_A     E    77_A     16   71  216     11   22   56   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     Q    78_A     Q    78_A     16   71  216      8   21   38   72   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     L    79_A     L    79_A     16   71  216      8   21   51   76   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     D    80_A     D    80_A     11   71  216      8   18   37   72   93  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     T    81_A     T    81_A     11   71  216      8   16   37   73   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     E    82_A     E    82_A     11   71  216      8   16   42   75   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     L    83_A     L    83_A     10   71  216      8   27   54   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     L    84_A     L    84_A     10   71  216      8   28   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     F    85_A     F    85_A     10   71  216      8   28   52   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     I    86_A     I    86_A     10   71  216      7   32   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     A    87_A     A    87_A     10   71  216      5   28   54   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     A    88_A     A    88_A     10   71  216      4   21   51   77   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     Q    89_A     Q    89_A     10   71  216      5   25   51   77   97  121  137  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     H    90_A     H    90_A      6   27  216      3    4    7   10   43   70   97  107  124  143  168  174  181  192  200  206  210  213  215  216 
LCS_GDT     Q    91_A     Q    91_A      6   25  216      4    4   10   29   66   88  105  125  142  158  170  184  191  203  207  210  212  214  215  216 
LCS_GDT     G    92_A     G    92_A      6    9  216      4    4    6   15   18   25   79  107  128  144  161  179  189  200  207  210  212  214  215  216 
LCS_GDT     R    93_A     R    93_A      6    9  216      4    5   11   22   47   82  111  133  156  169  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     G    94_A     G    94_A      6    9  216      4    6   11   20   44   72  106  129  156  169  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     Y    95_A     Y    95_A      6    9  216      3    7   24   45   76  103  129  148  160  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     Y    96_A     Y    96_A      6    9  216      3   10   30   48   64   84  109  131  153  169  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     F    97_A     F    97_A      5    9  216      3    6   23   58   88  116  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     Q    98_A     Q    98_A      5    9  216      3   19   41   54   70  101  129  148  160  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     L    99_A     L    99_A      5    8  216      4    7   24   62   96  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     R   100_A     R   100_A      3    8  216      3    5   19   52   96  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     N   101_A     N   101_A      3    8  216      3   10   19   47   93  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     G   102_A     G   102_A      3    8  216      3    3    8   16   30   51   82  106  133  152  171  188  196  203  207  210  212  214  215  216 
LCS_GDT     E   103_A     E   103_A      5    7  216      3    4    6   12   16   32   48   74  105  134  162  179  196  203  207  210  212  214  215  216 
LCS_GDT     F   104_A     F   104_A      5    7  216      3    4    4    9   16   27   46   63  105  129  158  178  196  203  207  210  212  214  215  216 
LCS_GDT     L   105_A     L   105_A      5    7  216      3    5   11   15   16   27   46   85  102  137  165  180  196  203  207  210  212  214  215  216 
LCS_GDT     Q   106_A     Q   106_A      5    7  216      3    4    6   15   16   30   46   76   99  131  161  179  196  203  207  210  212  214  215  216 
LCS_GDT     R   107_A     R   107_A      5    7  216      3    4   11   15   16   28   46   85  102  137  165  180  196  203  207  210  212  214  215  216 
LCS_GDT     I   108_A     I   108_A      4    7  216      3    4    4   10   11   20   28   46   69  120  141  172  189  203  207  210  212  214  215  216 
LCS_GDT     I   109_A     I   109_A      4    7  216      3    4    9   15   30   53   62   83  102  130  161  180  196  203  207  210  212  214  215  216 
LCS_GDT     Q   110_A     Q   110_A      4    7  216      3    8   13   22   37   53   62   74  101  124  160  176  193  203  207  210  212  214  215  216 
LCS_GDT     P   111_A     P   111_A      4    4  216      3    4    4    4   10   29   35   39   56   71   90  152  170  179  190  205  212  214  214  216 
LCS_GDT     P   112_A     P   112_A      4    4  216      3    4    4   10   13   19   33   37   60  111  135  154  176  197  205  210  212  214  215  216 
LCS_GDT     G   113_A     G   113_A      4    5  216      3    4    4    4    5    8    9   11   23   57   78  107  145  164  183  203  212  214  215  216 
LCS_GDT     S   114_A     S   114_A      4    5  216      3    3    4   54   68   87  113  139  157  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     E   115_A     E   115_A      4    5  216      5   20   57   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     D   116_A     D   116_A      4   12  216      4   16   28   54   86  113  134  147  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     D   117_A     D   117_A      9   12  216      4    5    9   23   33   54   77  108  131  157  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     W   118_A     W   118_A      9   12  216      3    8   10   16   52   84  112  139  160  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     Y   119_A     Y   119_A      9   12  216      7   15   38   72   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     Y   120_A     Y   120_A      9   12  216      7    8   37   66   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     H   121_A     H   121_A      9   12  216      7    8   25   65   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     F   122_A     F   122_A      9   12  216      7   14   37   65   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     T   123_A     T   123_A      9   12  216      7   21   41   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     D   124_A     D   124_A      9   12  216      7   17   51   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     S   125_A     S   125_A      9   12  216      7   14   37   70   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     D   126_A     D   126_A      8   12  216      4    5    8   14   37   76  107  136  155  171  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     N   127_A     N   127_A      6   12  216      3    8   18   44   71  114  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     A   128_A     A   128_A      6   12  216      3    5   22   61   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     Y   129_A     Y   129_A      6   12  216      3   28   51   77   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     E   130_A     E   130_A      5   12  216      3   12   51   71   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     L   131_A     L   131_A      7   12  216      3   16   29   45   96  119  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     N   132_A     N   132_A      7   12  216      4    6   32   53   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     L   133_A     L   133_A      7   12  216      4   11   48   77   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     D   134_A     D   134_A      7   12  216      3   14   48   75   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     S   135_A     S   135_A      7   12  216      4   11   48   72   97  121  137  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     D   136_A     D   136_A      7   12  216      4   16   52   77   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     T   137_A     T   137_A      7   12  216      4    5   20   42   61   98  124  140  156  169  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     F   138_A     F   138_A      7   11  216      4    6   38   72   96  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     S   139_A     S   139_A      6   10  216      4   19   43   57   90  120  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     P   140_A     P   140_A      5   10  216      4    5    6   21   31   55   81  106  138  158  176  189  196  203  207  210  212  214  215  216 
LCS_GDT     D   141_A     D   141_A      3   10  216      3    9   35   54   95  117  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     D   142_A     D   142_A      3   10  216      5   30   54   77   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     A   143_A     A   143_A      8   12  216      3    6   11   15   25   72  105  133  156  169  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     F   144_A     F   144_A      8   12  216      3    6   11   15   25   47   98  133  156  169  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     V   145_A     V   145_A      8   12  216      3    6   11   15   16   35   68  114  144  168  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     Y   146_A     Y   146_A      8   12  216      3    6   11   15   25   53   98  133  154  169  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     V   147_A     V   147_A      8   12  216      3    6   11   15   16   35   89  118  144  168  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     N   148_A     N   148_A      8   12  216      3    6   11   15   30   76  108  136  156  169  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     Y   149_A     Y   149_A      8   12  216      3    6   11   15   30   56  108  136  156  170  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     R   150_A     R   150_A      8   12  216      3    6   11   15   22   53   89  133  156  169  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     S   151_A     S   151_A      6   12  216      3    5   11   15   30   77  104  133  156  169  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     T   152_A     T   152_A     10   12  216      4    8   10   14   20   75  100  122  142  163  176  185  196  203  207  210  212  214  215  216 
LCS_GDT     V   153_A     V   153_A     10   12  216      5    8   10   15   35   72  108  137  156  169  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     N   154_A     N   154_A     10   12  216      5   13   36   70   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     A   155_A     A   155_A     10   12  216      5   21   39   63   89  112  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     A   156_A     A   156_A     10   12  216      4   18   39   56   79  103  125  145  160  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     N   157_A     N   157_A     10   12  216      4    8   25   51   73  101  114  134  151  166  177  184  194  199  201  207  211  214  215  216 
LCS_GDT     G   158_A     G   158_A     10   15  216      5   18   35   58   88  104  125  146  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     R   159_A     R   159_A     10   17  216      3    8   10   29   56   70  120  147  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     P   160_A     P   160_A     10   19  216      5    8   10   56   95  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     L   161_A     L   161_A     11   19  216      5   21   54   77   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     V   162_A     V   162_A     11   19  216      3   16   29   68   96  119  137  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     V   163_A     V   163_A     11   20  216      5   30   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     A   164_A     A   164_A     11   20  216      4   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     G   165_A     G   165_A     11   37  216      5   21   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     A   166_A     A   166_A     12   38  216      9   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     G   167_A     G   167_A     12   40  216      7   30   57   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     L   168_A     L   168_A     12   40  216      7   30   54   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     D   169_A     D   169_A     14   40  216      5   30   56   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     L   170_A     L   170_A     14   40  216      9   31   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     S   171_A     S   171_A     14   40  216     17   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     Q   172_A     Q   172_A     14   40  216      8   36   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     M   173_A     M   173_A     14   40  216      6   28   54   77   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     A   174_A     A   174_A     14   40  216     12   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     S   175_A     S   175_A     14   40  216      6   27   43   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     L   176_A     L   176_A     14   40  216      6   22   43   57   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     I   177_A     I   177_A     14   40  216      6   27   43   76   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     D   178_A     D   178_A     14   40  216      8   27   43   66   97  120  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     D   179_A     D   179_A     14   40  216      4   19   43   52   67  104  128  148  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     F   180_A     F   180_A     14   40  216      6   20   43   57   82  111  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     R   181_A     R   181_A     14   40  216      5   22   43   57   82  108  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     L   182_A     L   182_A     14   40  216      5   22   43   57   82  108  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     G   183_A     G   183_A     14   40  216      4   12   36   52   68   96  126  143  160  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     G   184_A     G   184_A      4   40  216      3    5    9   18   36   63   75  103  137  168  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     S   185_A     S   185_A      4   40  216      3   13   43   54   68   98  126  145  160  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     G   186_A     G   186_A     16   40  216      9   27   52   75   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     H   187_A     H   187_A     16   40  216     17   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     A   188_A     A   188_A     16   40  216     17   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     S   189_A     S   189_A     16   40  216     12   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     L   190_A     L   190_A     16   40  216     12   27   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     L   191_A     L   191_A     16   40  216     12   27   44   76   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     S   192_A     S   192_A     16   40  216     12   27   43   69   89  114  137  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     A   193_A     A   193_A     16   40  216     12   27   43   57   86  107  129  146  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     E   194_A     E   194_A     16   40  216     12   27   43   57   86  107  126  146  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     G   195_A     G   195_A     16   40  216     11   27   43   62   86  107  129  146  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     E   196_A     E   196_A     16   40  216     12   26   43   69   89  114  137  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     L   197_A     L   197_A     16   40  216     12   27   53   75   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     L   198_A     L   198_A     16   40  216     12   27   53   76   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     V   199_A     V   199_A     16   40  216     12   27   57   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     R   200_A     R   200_A     16   40  216      9   31   55   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     S   201_A     S   201_A     16   40  216      3   17   34   68   92  119  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     L   235_A     L   235_A      4   40  216      3    9   29   65   97  119  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     Q   236_A     Q   236_A      4   40  216      3   20   46   70   97  119  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     V   237_A     V   237_A      4   40  216      3    6   29   45   74  103  129  144  160  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     H   238_A     H   238_A      4   40  216      3   12   29   59   82  106  138  149  160  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     E   239_A     E   239_A      4   40  216      3    4    7   26   44   70  109  132  152  168  184  193  196  203  207  210  212  214  215  216 
LCS_GDT     A   240_A     A   240_A      4   40  216      7   11   20   40   70   94  124  143  157  171  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     T   241_A     T   241_A      4   12  216      3    4    5   12   21   27   58   77  101  123  140  172  189  199  201  210  212  214  215  216 
LCS_GDT     R   242_A     R   242_A      3   12  216      3    3   17   26   44   58   77  101  140  156  177  186  195  199  206  210  212  214  215  216 
LCS_GDT     D   243_A     D   243_A      3   25  216      4   17   27   59   85  107  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     G   244_A     G   244_A     12   25  216      5   21   43   57   70   93  112  136  157  172  184  193  196  203  207  210  212  214  215  216 
LCS_GDT     Q   245_A     Q   245_A     12   25  216      7   16   34   57   70  100  125  144  160  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     E   246_A     E   246_A     12   25  216      7   19   42   57   76  107  132  149  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     V   247_A     V   247_A     12   25  216      8   19   43   64   88  116  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     L   248_A     L   248_A     12   25  216      9   22   44   74   96  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     V   249_A     V   249_A     12   25  216      7   22   57   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     S   250_A     S   250_A     12   25  216     10   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     T   251_A     T   251_A     12   25  216      7   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     I   252_A     I   252_A     12   25  216      9   27   53   76   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     W   253_A     W   253_A     12   25  216      9   27   44   74   97  119  137  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     L   254_A     L   254_A     12   25  216      9   25   44   74   97  121  137  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     P   255_A     P   255_A     12   25  216      3   18   42   57   77  101  121  137  157  171  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     E   256_A     E   256_A      9   25  216      4    9   15   37   62   94  117  141  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     L   257_A     L   257_A      9   25  216      4   10   15   35   58   94  122  141  161  172  184  193  196  203  207  210  212  214  215  216 
LCS_GDT     Q   258_A     Q   258_A      8   25  216      4   10   24   45   81  102  127  146  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     R   259_A     R   259_A      8   25  216     12   25   51   76   97  121  137  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     Y   260_A     Y   260_A      8   25  216     12   27   53   76   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     L   261_A     L   261_A      8   25  216     12   27   53   76   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     M   262_A     M   262_A      8   25  216     12   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     V   263_A     V   263_A      8   25  216     12   38   58   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     E   264_A     E   264_A      8   25  216      6   26   57   78   97  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     V   265_A     V   265_A      8   25  216      4   27   49   74   96  121  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     D   266_A     D   266_A      8   25  216      8   22   43   59   83  111  138  150  161  172  185  193  196  203  207  210  212  214  215  216 
LCS_GDT     K   267_A     K   267_A      7   25  216      3    4   21   31   57   73   85  101  131  165  179  193  196  203  207  210  212  214  215  216 
LCS_AVERAGE  LCS_A:  41.48  (   6.74   17.69  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     17     38     58     78     97    121    138    150    161    172    185    193    196    203    207    210    212    214    215    216 
GDT PERCENT_AT   7.87  17.59  26.85  36.11  44.91  56.02  63.89  69.44  74.54  79.63  85.65  89.35  90.74  93.98  95.83  97.22  98.15  99.07  99.54 100.00
GDT RMS_LOCAL    0.39   0.69   0.97   1.29   1.56   1.89   2.24   2.35   2.60   2.85   3.19   3.35   3.43   3.82   3.92   4.03   4.14   4.20   4.22   4.28
GDT RMS_ALL_AT   4.74   4.88   4.80   4.66   4.69   4.60   4.43   4.51   4.55   4.50   4.37   4.37   4.35   4.29   4.28   4.28   4.28   4.28   4.28   4.28

# Checking swapping
#   possible swapping detected:  E    44_A      E    44_A
#   possible swapping detected:  Y    50_A      Y    50_A
#   possible swapping detected:  E    53_A      E    53_A
#   possible swapping detected:  E    58_A      E    58_A
#   possible swapping detected:  E    62_A      E    62_A
#   possible swapping detected:  D    67_A      D    67_A
#   possible swapping detected:  Y    71_A      Y    71_A
#   possible swapping detected:  E    77_A      E    77_A
#   possible swapping detected:  E    82_A      E    82_A
#   possible swapping detected:  Y    96_A      Y    96_A
#   possible swapping detected:  E   103_A      E   103_A
#   possible swapping detected:  F   104_A      F   104_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:  D   126_A      D   126_A
#   possible swapping detected:  E   130_A      E   130_A
#   possible swapping detected:  D   136_A      D   136_A
#   possible swapping detected:  F   138_A      F   138_A
#   possible swapping detected:  F   144_A      F   144_A
#   possible swapping detected:  Y   146_A      Y   146_A
#   possible swapping detected:  Y   149_A      Y   149_A
#   possible swapping detected:  E   239_A      E   239_A
#   possible swapping detected:  D   243_A      D   243_A
#   possible swapping detected:  Y   260_A      Y   260_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    Q    19_A      Q    19_A     1.874     0    0.575   0.922     4.816   63.929   62.116
LGA    E    20_A      E    20_A     2.497     0    0.033   0.336     4.871   64.762   53.016
LGA    L    21_A      L    21_A     1.861     0    0.036   0.868     2.618   75.119   70.000
LGA    P    22_A      P    22_A     0.655     0    0.034   0.384     2.424   83.690   81.633
LGA    A    23_A      A    23_A     2.135     0    0.024   0.038     2.880   70.833   68.095
LGA    Q    24_A      Q    24_A     1.912     0    0.026   0.898     3.677   77.143   66.190
LGA    V    25_A      V    25_A     0.837     0    0.029   0.132     1.175   88.214   90.544
LGA    K    26_A      K    26_A     1.122     0    0.066   0.671     4.402   83.690   69.524
LGA    G    27_A      G    27_A     1.468     0    0.831   0.831     3.939   69.762   69.762
LGA    L    28_A      L    28_A     0.756     0    0.087   0.893     2.656   92.976   84.226
LGA    A    29_A      A    29_A     0.313     0    0.050   0.075     0.518   97.619   98.095
LGA    A    30_A      A    30_A     0.881     0    0.082   0.091     1.249   90.476   88.667
LGA    H    31_A      H    31_A     0.396     0    0.026   1.219     5.525   97.619   69.619
LGA    I    32_A      I    32_A     0.376     0    0.872   0.894     3.776   81.190   89.405
LGA    N    33_A      N    33_A     0.588     0    0.082   1.097     2.740   95.238   86.488
LGA    L    34_A      L    34_A     0.195     0    0.038   0.943     4.062  100.000   83.393
LGA    S    35_A      S    35_A     0.651     0    0.060   0.606     2.876   92.857   86.508
LGA    L    36_A      L    36_A     1.004     0    0.053   1.218     3.506   88.214   78.988
LGA    S    37_A      S    37_A     0.961     0    0.024   0.037     1.023   88.214   88.968
LGA    Q    38_A      Q    38_A     0.937     0    0.033   1.054     5.188   90.476   69.153
LGA    D    39_A      D    39_A     0.994     0    0.020   0.156     1.671   88.214   83.750
LGA    L    40_A      L    40_A     1.023     0    0.057   0.648     2.145   85.952   85.000
LGA    A    41_A      A    41_A     0.697     0    0.034   0.036     0.851   90.476   90.476
LGA    I    42_A      I    42_A     0.883     0    0.037   0.129     1.259   90.476   87.083
LGA    S    43_A      S    43_A     1.193     0    0.014   0.036     1.683   81.429   80.000
LGA    E    44_A      E    44_A     0.843     0    0.038   0.666     2.751   88.214   75.503
LGA    S    45_A      S    45_A     0.822     0    0.031   0.618     2.776   88.214   83.413
LGA    L    46_A      L    46_A     1.190     0    0.056   1.403     3.675   83.690   72.679
LGA    A    47_A      A    47_A     1.534     0    0.040   0.066     1.632   75.000   74.571
LGA    N    48_A      N    48_A     1.448     0    0.143   1.113     3.453   77.143   72.202
LGA    S    49_A      S    49_A     1.453     0    0.035   0.069     1.453   83.690   82.937
LGA    Y    50_A      Y    50_A     1.639     0    0.024   1.546     7.672   72.857   56.310
LGA    F    51_A      F    51_A     1.605     0    0.042   0.281     4.232   77.143   60.866
LGA    I    52_A      I    52_A     1.153     0    0.062   0.089     1.720   81.429   79.286
LGA    E    53_A      E    53_A     1.371     0    0.050   0.952     2.103   77.143   76.720
LGA    Q    54_A      Q    54_A     2.048     0    0.015   1.087     4.849   66.786   56.508
LGA    W    55_A      W    55_A     1.944     0    0.024   1.231     8.546   66.786   43.503
LGA    V    56_A      V    56_A     2.148     0    0.063   0.127     2.881   60.952   63.741
LGA    R    57_A      R    57_A     2.816     0    0.095   0.802     3.753   53.810   64.805
LGA    E    58_A      E    58_A     3.269     0    0.444   1.163     6.945   55.357   39.894
LGA    G    59_A      G    59_A     3.035     0    0.196   0.196     3.035   61.190   61.190
LGA    L    60_A      L    60_A     3.625     0    0.530   1.149     8.626   59.405   34.881
LGA    P    61_A      P    61_A     2.220     0    0.620   0.766     5.281   55.476   47.075
LGA    E    62_A      E    62_A     7.035     0    0.027   1.248    12.384   13.571    6.349
LGA    E    63_A      E    63_A     7.702     0    0.850   1.209    10.518   12.738    6.349
LGA    R    64_A      R    64_A     3.071     0    0.444   1.379     6.928   45.357   45.411
LGA    Q    65_A      Q    65_A     3.142     0    0.076   0.998     5.180   53.571   53.333
LGA    N    66_A      N    66_A     3.026     0    0.113   1.256     4.238   55.476   54.881
LGA    D    67_A      D    67_A     2.301     0    0.105   0.861     3.674   62.857   64.345
LGA    I    68_A      I    68_A     1.797     0    0.071   0.566     2.868   70.833   68.869
LGA    A    69_A      A    69_A     1.939     0    0.078   0.090     2.277   72.857   71.238
LGA    A    70_A      A    70_A     2.000     0    0.012   0.010     2.161   68.810   68.000
LGA    Y    71_A      Y    71_A     1.002     0    0.057   1.323     6.864   85.952   61.270
LGA    L    72_A      L    72_A     0.990     0    0.025   0.056     1.153   83.690   84.821
LGA    A    73_A      A    73_A     1.702     0    0.000   0.000     2.065   75.000   72.952
LGA    R    74_A      R    74_A     1.820     0    0.026   1.254     4.111   72.857   66.407
LGA    L    75_A      L    75_A     1.547     0    0.020   0.279     1.547   77.143   78.214
LGA    M    76_A      M    76_A     1.053     0    0.032   1.184     3.559   81.429   75.595
LGA    E    77_A      E    77_A     1.894     0    0.101   1.119     4.471   70.952   67.196
LGA    Q    78_A      Q    78_A     2.594     0    0.102   1.371     9.171   59.048   37.725
LGA    L    79_A      L    79_A     2.408     0    0.661   1.258     5.843   61.071   52.917
LGA    D    80_A      D    80_A     3.173     0    0.449   1.092     6.956   57.262   40.298
LGA    T    81_A      T    81_A     2.817     0    0.033   1.120     3.695   55.357   55.238
LGA    E    82_A      E    82_A     2.723     0    0.053   0.867     5.546   57.143   44.603
LGA    L    83_A      L    83_A     2.056     0    0.042   0.976     4.608   70.952   59.167
LGA    L    84_A      L    84_A     1.477     0    0.000   0.751     2.603   75.000   73.036
LGA    F    85_A      F    85_A     1.564     0    0.044   0.348     3.788   81.548   64.848
LGA    I    86_A      I    86_A     1.059     0    0.029   0.272     1.872   81.429   81.488
LGA    A    87_A      A    87_A     1.641     0    0.060   0.080     2.113   75.000   72.952
LGA    A    88_A      A    88_A     2.636     0    0.087   0.126     3.269   59.048   57.238
LGA    Q    89_A      Q    89_A     3.094     0    0.242   0.865     7.293   34.048   48.942
LGA    H    90_A      H    90_A     7.922     0    0.486   0.978    16.190   12.143    4.905
LGA    Q    91_A      Q    91_A     7.463     0    0.049   0.878     8.015    7.976   12.646
LGA    G    92_A      G    92_A    10.146     0    0.049   0.049    10.500    0.714    0.714
LGA    R    93_A      R    93_A     7.056     0    0.339   1.836    10.547   11.905   15.325
LGA    G    94_A      G    94_A     7.175     0    0.529   0.529     7.521   13.929   13.929
LGA    Y    95_A      Y    95_A     5.173     0    0.525   1.381    11.395   19.762   15.040
LGA    Y    96_A      Y    96_A     6.601     0    0.077   1.346    13.897   20.595    6.984
LGA    F    97_A      F    97_A     4.045     0    0.090   1.264    12.596   31.786   15.844
LGA    Q    98_A      Q    98_A     5.021     0    0.072   1.004    11.250   30.238   15.397
LGA    L    99_A      L    99_A     3.104     0    0.185   0.477     8.738   45.357   31.250
LGA    R   100_A      R   100_A     3.082     0    0.191   1.111     5.693   48.333   46.580
LGA    N   101_A      N   101_A     3.445     0    0.328   1.065     7.299   32.857   29.048
LGA    G   102_A      G   102_A     8.257     0    0.431   0.431     9.175    6.548    6.548
LGA    E   103_A      E   103_A    10.586     0    0.654   1.425    13.512    0.357    0.159
LGA    F   104_A      F   104_A    10.548     0    0.158   1.181    18.734    0.000    0.000
LGA    L   105_A      L   105_A    10.243     0    0.220   1.175    12.165    0.000    0.000
LGA    Q   106_A      Q   106_A    10.681     0    0.203   0.815    14.001    0.000    0.000
LGA    R   107_A      R   107_A    10.131     0    0.267   1.414    17.487    0.000    0.087
LGA    I   108_A      I   108_A    11.151     0    0.675   1.130    15.761    0.833    0.417
LGA    I   109_A      I   109_A     9.916     0    0.058   1.313    12.611    0.119    0.060
LGA    Q   110_A      Q   110_A    10.315     0    0.693   1.258    11.309    0.000    0.053
LGA    P   111_A      P   111_A    13.059     0    0.064   0.232    15.475    0.000    0.000
LGA    P   112_A      P   112_A    11.421     0    0.560   0.645    14.209    0.000    0.000
LGA    G   113_A      G   113_A    11.382     0    0.143   0.143    11.382    0.357    0.357
LGA    S   114_A      S   114_A     6.017     0    0.667   0.722     7.123   26.905   25.159
LGA    E   115_A      E   115_A     1.737     0    0.785   1.277     4.007   71.429   63.862
LGA    D   116_A      D   116_A     4.034     0    0.599   1.065    10.864   35.000   20.893
LGA    D   117_A      D   117_A     6.278     0    0.190   1.063     8.136   23.929   15.714
LGA    W   118_A      W   118_A     5.030     0    0.117   0.125     5.145   28.929   42.755
LGA    Y   119_A      Y   119_A     2.347     0    0.026   0.118     3.857   61.071   59.246
LGA    Y   120_A      Y   120_A     2.722     0    0.056   1.477     9.918   59.048   35.992
LGA    H   121_A      H   121_A     2.782     0    0.106   0.145     4.212   57.143   48.952
LGA    F   122_A      F   122_A     2.668     0    0.039   1.446     4.605   60.952   54.632
LGA    T   123_A      T   123_A     1.885     0    0.180   1.233     2.814   72.857   69.456
LGA    D   124_A      D   124_A     1.567     0    0.116   0.149     2.578   66.905   68.869
LGA    S   125_A      S   125_A     2.615     0    0.649   0.729     2.879   60.952   60.952
LGA    D   126_A      D   126_A     5.512     0    0.030   0.839     9.470   27.619   17.798
LGA    N   127_A      N   127_A     3.605     0    0.265   1.245     7.830   58.214   41.369
LGA    A   128_A      A   128_A     2.859     0    0.658   0.628     3.896   59.167   56.000
LGA    Y   129_A      Y   129_A     2.577     0    0.049   1.326    12.197   52.143   22.698
LGA    E   130_A      E   130_A     2.663     0    0.103   1.061     9.228   57.500   33.439
LGA    L   131_A      L   131_A     3.118     0    0.327   1.228     9.759   63.333   36.250
LGA    N   132_A      N   132_A     3.225     0    0.173   1.175     5.698   55.357   42.143
LGA    L   133_A      L   133_A     2.638     0    0.028   0.892     3.284   55.357   56.250
LGA    D   134_A      D   134_A     3.047     0    0.038   0.735     4.334   51.786   47.619
LGA    S   135_A      S   135_A     3.600     0    0.088   0.639     6.866   46.667   39.524
LGA    D   136_A      D   136_A     2.157     0    0.303   0.989     3.053   57.262   61.071
LGA    T   137_A      T   137_A     5.193     0    0.274   0.270     7.857   31.667   22.925
LGA    F   138_A      F   138_A     2.843     0    0.353   0.377    11.275   67.619   30.390
LGA    S   139_A      S   139_A     3.095     0    0.502   0.645     5.444   53.690   45.397
LGA    P   140_A      P   140_A     7.399     0    0.063   0.241    10.462   12.857    8.095
LGA    D   141_A      D   141_A     3.530     0    0.420   0.388     4.457   43.452   43.452
LGA    D   142_A      D   142_A     2.393     0    0.058   0.536     4.247   53.810   53.929
LGA    A   143_A      A   143_A     6.247     0    0.581   0.534     7.949   26.786   22.857
LGA    F   144_A      F   144_A     6.290     0    0.141   0.292     8.078   16.190   13.160
LGA    V   145_A      V   145_A     6.354     0    0.179   0.994     7.865   16.190   16.667
LGA    Y   146_A      Y   146_A     6.103     0    0.103   0.210     7.034   16.190   15.278
LGA    V   147_A      V   147_A     6.167     0    0.343   0.375     7.153   16.190   14.490
LGA    N   148_A      N   148_A     5.523     0    0.095   1.005     6.905   25.000   22.798
LGA    Y   149_A      Y   149_A     5.465     0    0.078   0.503     5.719   22.619   29.563
LGA    R   150_A      R   150_A     5.963     0    0.044   1.449    11.914   21.429    8.745
LGA    S   151_A      S   151_A     5.347     0    0.105   0.624     6.221   25.000   23.095
LGA    T   152_A      T   152_A     6.778     0    0.624   1.036     8.449   18.333   13.197
LGA    V   153_A      V   153_A     5.334     0    0.472   0.718     7.991   38.690   29.252
LGA    N   154_A      N   154_A     2.603     0    0.114   0.937     4.468   46.905   52.083
LGA    A   155_A      A   155_A     4.229     0    0.088   0.101     4.942   37.500   36.286
LGA    A   156_A      A   156_A     6.721     0    0.480   0.471     8.719   11.190   12.381
LGA    N   157_A      N   157_A     8.991     0    0.359   0.941    10.173    6.071    3.571
LGA    G   158_A      G   158_A     5.989     0    0.392   0.392     6.955   24.524   24.524
LGA    R   159_A      R   159_A     5.038     0    0.129   0.823    12.162   38.214   15.714
LGA    P   160_A      P   160_A     2.691     0    0.108   0.225     4.749   53.571   45.782
LGA    L   161_A      L   161_A     2.364     0    0.066   1.372     4.386   60.952   62.619
LGA    V   162_A      V   162_A     3.363     0    0.185   1.010     5.252   53.571   48.707
LGA    V   163_A      V   163_A     1.271     0    0.177   0.857     2.986   77.143   74.286
LGA    A   164_A      A   164_A     0.728     0    0.071   0.091     1.105   88.214   88.667
LGA    G   165_A      G   165_A     1.575     0    0.137   0.137     1.575   86.071   86.071
LGA    A   166_A      A   166_A     1.064     0    0.098   0.096     1.736   85.952   83.333
LGA    G   167_A      G   167_A     1.510     0    0.108   0.108     2.491   72.976   72.976
LGA    L   168_A      L   168_A     1.740     0    0.026   1.397     3.453   72.857   66.131
LGA    D   169_A      D   169_A     1.707     0    0.101   1.078     5.001   72.857   62.381
LGA    L   170_A      L   170_A     1.462     0    0.057   0.833     5.685   81.429   61.845
LGA    S   171_A      S   171_A     0.560     0    0.067   0.677     2.101   90.476   87.778
LGA    Q   172_A      Q   172_A     0.920     0    0.041   1.079     5.239   83.810   64.392
LGA    M   173_A      M   173_A     2.210     0    0.066   0.933     4.035   68.810   64.643
LGA    A   174_A      A   174_A     0.719     0    0.021   0.049     1.231   85.952   86.857
LGA    S   175_A      S   175_A     1.805     0    0.124   0.662     3.455   69.048   66.508
LGA    L   176_A      L   176_A     2.993     0    0.169   0.823     7.207   52.262   39.583
LGA    I   177_A      I   177_A     2.271     0    0.029   0.073     2.494   64.762   71.071
LGA    D   178_A      D   178_A     2.832     0    0.121   0.379     4.240   50.595   51.429
LGA    D   179_A      D   179_A     5.033     0    0.123   1.048     7.152   26.667   22.083
LGA    F   180_A      F   180_A     4.112     0    0.385   1.150     9.338   34.405   21.342
LGA    R   181_A      R   181_A     4.352     0    0.061   1.608     5.756   37.143   41.385
LGA    L   182_A      L   182_A     4.570     0    0.209   1.369     5.342   30.119   35.417
LGA    G   183_A      G   183_A     6.286     0    0.665   0.665     6.286   21.786   21.786
LGA    G   184_A      G   184_A     8.148     0    0.391   0.391     8.148   11.071   11.071
LGA    S   185_A      S   185_A     6.087     0    0.724   0.866     7.225   16.667   15.635
LGA    G   186_A      G   186_A     2.066     0    0.106   0.106     2.869   71.190   71.190
LGA    H   187_A      H   187_A     0.708     0    0.270   0.831     4.132   90.595   71.048
LGA    A   188_A      A   188_A     0.437     0    0.084   0.114     0.714   95.238   94.286
LGA    S   189_A      S   189_A     1.373     0    0.043   0.596     3.022   81.429   76.190
LGA    L   190_A      L   190_A     1.865     0    0.086   0.989     4.568   68.810   64.643
LGA    L   191_A      L   191_A     3.038     0    0.073   1.164     3.792   51.786   50.952
LGA    S   192_A      S   192_A     3.922     0    0.069   0.087     4.372   40.238   39.206
LGA    A   193_A      A   193_A     4.990     0    0.043   0.041     5.328   28.810   28.286
LGA    E   194_A      E   194_A     5.274     0    0.046   1.177     8.495   26.190   20.847
LGA    G   195_A      G   195_A     4.910     0    0.070   0.070     4.950   32.857   32.857
LGA    E   196_A      E   196_A     3.949     0    0.113   0.475     4.314   45.119   46.402
LGA    L   197_A      L   197_A     2.561     0    0.037   0.693     3.085   55.357   59.167
LGA    L   198_A      L   198_A     2.400     0    0.071   1.223     5.448   62.857   57.143
LGA    V   199_A      V   199_A     1.847     0    0.090   1.155     4.306   77.143   67.891
LGA    R   200_A      R   200_A     1.662     0    0.043   0.605     2.551   68.810   73.896
LGA    S   201_A      S   201_A     3.115     0    0.557   0.916     5.190   44.524   46.429
LGA    L   235_A      L   235_A     3.312     0    0.090   1.140     7.995   40.714   27.857
LGA    Q   236_A      Q   236_A     3.722     0    0.161   1.448    10.208   50.119   28.995
LGA    V   237_A      V   237_A     5.617     0    0.151   1.072     9.281   27.619   17.075
LGA    H   238_A      H   238_A     4.610     0    0.105   1.186     8.390   24.405   20.762
LGA    E   239_A      E   239_A     7.092     0    0.218   1.319    12.068   18.690    8.466
LGA    A   240_A      A   240_A     6.375     0    0.045   0.098     8.629   10.119   11.524
LGA    T   241_A      T   241_A     9.355     0    0.422   1.113    11.397    4.048    2.313
LGA    R   242_A      R   242_A     8.756     0    0.618   1.173     9.709    2.381    7.056
LGA    D   243_A      D   243_A     4.692     0    0.489   1.134     5.592   26.310   35.060
LGA    G   244_A      G   244_A     7.412     0    0.442   0.442     7.412   12.619   12.619
LGA    Q   245_A      Q   245_A     6.039     0    0.074   0.982     8.242   20.476   17.831
LGA    E   246_A      E   246_A     4.959     0    0.358   0.737     7.757   21.548   32.487
LGA    V   247_A      V   247_A     3.677     0    0.096   0.195     3.863   45.000   46.190
LGA    L   248_A      L   248_A     2.415     0    0.040   0.353     4.440   69.048   61.548
LGA    V   249_A      V   249_A     1.394     0    0.044   0.148     2.218   79.286   75.374
LGA    S   250_A      S   250_A     1.069     0    0.041   0.056     1.616   85.952   83.016
LGA    T   251_A      T   251_A     1.525     0    0.088   0.148     2.267   75.000   72.925
LGA    I   252_A      I   252_A     2.856     0    0.031   1.136     5.743   57.262   49.286
LGA    W   253_A      W   253_A     3.767     0    0.068   1.616    11.150   43.452   19.184
LGA    L   254_A      L   254_A     3.271     0    0.052   1.027     4.520   42.143   47.976
LGA    P   255_A      P   255_A     5.790     0    0.626   0.577     6.525   24.048   23.197
LGA    E   256_A      E   256_A     4.904     0    0.437   0.784     5.991   30.119   30.370
LGA    L   257_A      L   257_A     4.859     0    0.813   1.368     7.509   24.048   24.524
LGA    Q   258_A      Q   258_A     4.715     0    0.257   1.085    10.385   37.262   21.270
LGA    R   259_A      R   259_A     3.286     0    0.107   0.554     5.649   50.000   36.537
LGA    Y   260_A      Y   260_A     2.960     0    0.104   1.400     8.503   57.262   40.675
LGA    L   261_A      L   261_A     2.409     0    0.039   1.262     3.822   62.857   61.131
LGA    M   262_A      M   262_A     1.591     0    0.178   1.371     4.290   81.786   70.833
LGA    V   263_A      V   263_A     1.288     0    0.070   1.056     2.638   79.286   74.354
LGA    E   264_A      E   264_A     1.421     0    0.074   0.549     2.321   79.405   75.026
LGA    V   265_A      V   265_A     2.353     0    0.036   0.175     3.034   59.405   60.612
LGA    D   266_A      D   266_A     4.473     0    0.016   1.212     5.602   30.833   42.321
LGA    K   267_A      K   267_A     8.099     0    0.056   0.803    15.491    5.952    2.646

# 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):     4.275          4.225                  5.208           51.921   46.989

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  288  216    4.0    150    2.35    55.093    49.308     6.126

LGA_LOCAL      RMSD:   2.349  Number of atoms:  150  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   4.512  Number of assigned atoms:  216 
Std_ASGN_ATOMS RMSD:   4.275  Standard rmsd on all 216 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.554961 * X  +   0.786158 * Y  +  -0.271983 * Z  +  24.725052
  Y_new =   0.687597 * X  +   0.249475 * Y  +  -0.681889 * Z  + -31.393908
  Z_new =  -0.468219 * X  +  -0.565436 * Y  +  -0.679008 * Z  + 108.591934 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  2.249853  0.487274 -2.447206   [DEG:  128.9071   27.9188 -140.2145 ]
ZXZ: -0.379530  2.317207 -2.449970   [DEG:  -21.7454  132.7662 -140.3730 ]
 
# END of job
