
#######################################################
#                                                     #
#                        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  313 ( 2327),  selected  281 , name one
# Molecule2: number of CA atoms  281 ( 1997),  selected  281 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:B  -ch2:B  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   281       6_B - 313_B       3.97     3.97
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   120      33_B - 152_B       1.97     4.43
  LONGEST_CONTINUOUS_SEGMENT:   120      34_B - 153_B       1.99     4.51
  LCS_AVERAGE:     33.41

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    87      56_B - 142_B       1.00     5.63
  LCS_AVERAGE:     20.54

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  281
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     H     6_B     H     6_B      5    7  281      3    3    5    5    5    7    7    7    8    8    8   25  111  248  258  263  268  273  275  276 
LCS_GDT     H     7_B     H     7_B      5   16  281      3    4    5    9  126  161  189  228  242  247  251  254  258  261  265  272  273  275  275  276 
LCS_GDT     T     8_B     T     8_B     12   16  281      3    4   22   63  107  131  153  182  215  242  251  254  256  261  264  270  273  275  275  276 
LCS_GDT     K     9_B     K     9_B     12   16  281      4   61   87  109  126  149  184  226  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     I    10_B     I    10_B     12   16  281     24   61   78  107  129  161  199  228  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     T    11_B     T    11_B     12   16  281     11   56   88  119  143  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     N    12_B     N    12_B     12   18  281      5   33   88  119  143  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     S    13_B     S    13_B     12   32  281      5   60   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     I    14_B     I    14_B     12   33  281     21   60   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     V    15_B     V    15_B     12   33  281     21   58   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     N    16_B     N    16_B     12   33  281     39   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     L    17_B     L    17_B     12   33  281      7   55   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     I    18_B     I    18_B     16   33  281     10   64  103  121  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G    19_B     G    19_B     16   33  281      8   57  110  123  130  162  205  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     N    20_B     N    20_B     26   33  281      8   94  112  123  130  147  203  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     T    21_B     T    21_B     26   33  281     57   94  112  123  130  176  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     P    22_B     P    22_B     26   33  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     I    23_B     I    23_B     26   33  281     53   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     V    24_B     V    24_B     26   33  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     K    25_B     K    25_B     26   33  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     L    26_B     L    26_B     26   33  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     N    27_B     N    27_B     26   33  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     R    28_B     R    28_B     26   33  281     65   94  112  123  147  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     V    29_B     V    29_B     26   33  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     V    30_B     V    30_B     26   33  281     65   94  112  123  147  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     P    31_B     P    31_B     26   33  281     65   94  112  123  138  180  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     E    32_B     E    32_B     26   33  281     47   94  112  123  130  148  198  231  239  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     D    33_B     D    33_B     26  120  281     18   93  112  123  134  177  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     A    34_B     A    34_B     26  120  281      3    4   38   93  146  177  209  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     A    35_B     A    35_B     26  120  281     10   72  107  123  143  180  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     D    36_B     D    36_B     26  120  281     32   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     V    37_B     V    37_B     26  120  281     34   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     Y    38_B     Y    38_B     26  120  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     V    39_B     V    39_B     26  120  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     K    40_B     K    40_B     26  120  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     L    41_B     L    41_B     26  120  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     E    42_B     E    42_B     26  120  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     F    43_B     F    43_B     26  120  281     32   94  112  123  143  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     F    44_B     F    44_B     26  120  281     14   77  111  123  130  164  200  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     N    45_B     N    45_B     26  120  281     12   86  111  123  130  148  200  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     P    46_B     P    46_B     11  120  281      4    9   80  120  130  136  156  195  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G    47_B     G    47_B     23  120  281      4   52   82  105  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G    48_B     G    48_B     23  120  281      4    6   33   53   89  159  199  227  239  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     S    49_B     S    49_B     29  120  281      4   18   46   89  109  176  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     I    50_B     I    50_B     30  120  281      4   19   46   89  106  175  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     K    51_B     K    51_B     30  120  281      7   20   69   93  115  176  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     D    52_B     D    52_B     30  120  281     30   68   88  109  146  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     R    53_B     R    53_B     30  120  281     11   51   87  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     I    54_B     I    54_B     30  120  281      6   22   66  100  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     A    55_B     A    55_B     30  120  281      9   61   83  106  145  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     L    56_B     L    56_B     87  120  281     30   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     A    57_B     A    57_B     87  120  281     13   67   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     M    58_B     M    58_B     87  120  281     11   60   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     I    59_B     I    59_B     87  120  281     30   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     E    60_B     E    60_B     87  120  281     28   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     E    61_B     E    61_B     87  120  281     17   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     A    62_B     A    62_B     87  120  281     30   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     E    63_B     E    63_B     87  120  281     30   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     K    64_B     K    64_B     87  120  281     28   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     A    65_B     A    65_B     87  120  281     30   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G    66_B     G    66_B     87  120  281     30   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     K    67_B     K    67_B     87  120  281     30   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     L    68_B     L    68_B     87  120  281     30   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     Q    69_B     Q    69_B     87  120  281     43   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     A    70_B     A    70_B     87  120  281     33   68   88  119  145  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G    71_B     G    71_B     87  120  281      4   53   77  106  130  161  201  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G    72_B     G    72_B     87  120  281     39   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     T    73_B     T    73_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     I    74_B     I    74_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     V    75_B     V    75_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     E    76_B     E    76_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     P    77_B     P    77_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     T    78_B     T    78_B     87  120  281     33   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     S    79_B     S    79_B     87  120  281      3   45   87  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G    80_B     G    80_B     87  120  281     16   40   87  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     N    81_B     N    81_B     87  120  281      9   55   99  120  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     T    82_B     T    82_B     87  120  281     16   39   97  118  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G    83_B     G    83_B     87  120  281     16   65   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     V    84_B     V    84_B     87  120  281     16   66   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G    85_B     G    85_B     87  120  281     16   66   87  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     L    86_B     L    86_B     87  120  281     16   66   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     A    87_B     A    87_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     M    88_B     M    88_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     V    89_B     V    89_B     87  120  281     19   67   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     A    90_B     A    90_B     87  120  281     19   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     A    91_B     A    91_B     87  120  281     43   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     A    92_B     A    92_B     87  120  281     19   66   87  112  141  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     K    93_B     K    93_B     87  120  281     16   67   87  113  142  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G    94_B     G    94_B     87  120  281     43   68   88  119  145  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     Y    95_B     Y    95_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     H    96_B     H    96_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     L    97_B     L    97_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     V    98_B     V    98_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     I    99_B     I    99_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     T   100_B     T   100_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     M   101_B     M   101_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     P   102_B     P   102_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     E   103_B     E   103_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     T   104_B     T   104_B     87  120  281     30   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     M   105_B     M   105_B     87  120  281      8   66   88  119  146  180  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     S   106_B     S   106_B     87  120  281      3    3   35   97  143  176  209  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     V   107_B     V   107_B     87  120  281      4   18   72  106  145  180  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     E   108_B     E   108_B     87  120  281     24   61   87  119  146  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     R   109_B     R   109_B     87  120  281      9   64   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     R   110_B     R   110_B     87  120  281     38   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     K   111_B     K   111_B     87  120  281     43   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     L   112_B     L   112_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     M   113_B     M   113_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     Q   114_B     Q   114_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G   115_B     G   115_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     Y   116_B     Y   116_B     87  120  281     43   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G   117_B     G   117_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     A   118_B     A   118_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     E   119_B     E   119_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     L   120_B     L   120_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     I   121_B     I   121_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     L   122_B     L   122_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     T   123_B     T   123_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     P   124_B     P   124_B     87  120  281     44   68   88  119  146  178  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G   125_B     G   125_B     87  120  281     44   68   88  119  146  178  209  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     A   126_B     A   126_B     87  120  281     32   61   87  109  133  159  188  218  237  245  249  251  257  261  268  272  273  275  275  276 
LCS_GDT     D   127_B     D   127_B     87  120  281     44   68   88  119  143  178  206  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G   128_B     G   128_B     87  120  281     44   68   88  119  146  178  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     M   129_B     M   129_B     87  120  281     44   68   88  119  146  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     K   130_B     K   130_B     87  120  281     44   68   88  119  146  178  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G   131_B     G   131_B     87  120  281     41   68   88  119  146  178  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     A   132_B     A   132_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     I   133_B     I   133_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     A   134_B     A   134_B     87  120  281     44   68   88  119  146  180  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     K   135_B     K   135_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     A   136_B     A   136_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     E   137_B     E   137_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     E   138_B     E   138_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     L   139_B     L   139_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     V   140_B     V   140_B     87  120  281     43   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     K   141_B     K   141_B     87  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     E   142_B     E   142_B     87  120  281     39   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     K   143_B     K   143_B     86  120  281     14   54   86  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G   144_B     G   144_B     84  120  281      4   21   71  110  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     Y   145_B     Y   145_B     84  120  281     43   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     F   146_B     F   146_B     84  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     M   147_B     M   147_B     84  120  281     44   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     P   148_B     P   148_B     84  120  281     43   68   88  119  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     M   149_B     M   149_B     81  120  281      3   10   57   99  145  180  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     Q   150_B     Q   150_B     69  120  281      6   58   82  106  146  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     F   151_B     F   151_B      6  120  281      3    6   26   79  140  180  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     D   152_B     D   152_B      6  120  281      5   27   43   63   84  154  202  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     N   153_B     N   153_B      6  120  281      4    6   31   53   74  103  134  149  193  219  241  251  258  262  268  272  273  275  275  276 
LCS_GDT     P   154_B     P   154_B      6  118  281      4   12   29   46   60   90  108  136  158  212  233  248  256  262  268  272  273  275  275  276 
LCS_GDT     A   155_B     A   155_B      6  109  281      4    6    6    7    9   13   16   58   76   87  106  124  158  188  223  249  260  268  273  276 
LCS_GDT     H   160_B     H   160_B      4   19  281      3    4    5    7   15   20   24   28   34   44   54   98  113  165  242  259  265  270  273  275 
LCS_GDT     E   161_B     E   161_B      4   19  281      3    4    9   16   22   68   97  128  175  210  234  248  254  262  268  272  273  275  275  276 
LCS_GDT     E   162_B     E   162_B     14   19  281      3    9   17   42   68   97  111  134  187  227  243  251  258  262  268  272  273  275  275  276 
LCS_GDT     T   163_B     T   163_B     14   19  281      8   11   14   16   33   53   80  111  160  195  217  243  252  260  268  272  273  275  275  276 
LCS_GDT     T   164_B     T   164_B     14   19  281      8   12   14   16   21   27   40   66  106  169  205  229  249  258  267  272  273  275  275  276 
LCS_GDT     G   165_B     G   165_B     14   19  281      8   12   14   21   38   59  106  162  204  224  242  251  258  262  268  272  273  275  275  276 
LCS_GDT     K   166_B     K   166_B     14   47  281      8   12   14   40   54   92  135  177  211  235  245  252  258  262  268  272  273  275  275  276 
LCS_GDT     E   167_B     E   167_B     14   47  281      8   12   19   42   55   76   97  141  149  162  201  233  251  260  268  272  273  275  275  276 
LCS_GDT     I   168_B     I   168_B     14   47  281      8   12   14   23   46   73   94  132  147  156  187  230  250  260  268  272  273  275  275  276 
LCS_GDT     L   169_B     L   169_B     14   47  281      8   16   34   86  121  136  139  145  161  205  231  251  257  262  268  272  273  275  275  276 
LCS_GDT     E   170_B     E   170_B     14   47  281      8   15   33   67  106  131  139  142  149  156  175  217  243  260  268  272  273  275  275  276 
LCS_GDT     A   171_B     A   171_B     14   47  281      7   12   16   37   63   94  116  137  145  150  157  170  188  211  248  264  270  275  275  276 
LCS_GDT     F   172_B     F   172_B     14   47  281      7   12   22   44   75  107  128  142  147  154  167  199  239  255  267  272  273  275  275  276 
LCS_GDT     G   173_B     G   173_B     14   47  281      7   12   15   24   54   86  121  138  145  150  156  168  188  240  248  267  272  275  275  276 
LCS_GDT     D   174_B     D   174_B     14   47  281      7   12   26   64   97  117  137  142  147  156  175  242  248  260  268  272  273  275  275  276 
LCS_GDT     D   175_B     D   175_B     14   47  281      7   12   17   49   89  117  137  142  147  156  181  242  248  260  268  272  273  275  275  276 
LCS_GDT     I   176_B     I   176_B     37   47  281      3    9   23   87  124  136  142  177  216  244  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     P   177_B     P   177_B     37   47  281      4   85  112  123  130  177  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     D   178_B     D   178_B     37   47  281     65   94  112  123  146  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     A   179_B     A   179_B     37   47  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     F   180_B     F   180_B     37   47  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     V   181_B     V   181_B     37   47  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     A   182_B     A   182_B     37   47  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G   183_B     G   183_B     37   47  281     21   85  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     V   184_B     V   184_B     37   47  281     12   67  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G   185_B     G   185_B     37   47  281     13   59  104  121  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     T   186_B     T   186_B     37   47  281      7   25   63  107  127  137  159  222  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G   187_B     G   187_B     37   47  281      9   45  105  123  134  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G   188_B     G   188_B     37   47  281      7   37   76  100  127  151  199  231  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     T   189_B     T   189_B     37   47  281      7   29   63  105  129  175  206  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     L   190_B     L   190_B     37   47  281     14   82  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     T   191_B     T   191_B     37   47  281     36   66  110  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G   192_B     G   192_B     37   47  281     13   62  108  123  146  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     V   193_B     V   193_B     37   97  281     16   91  112  123  146  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G   194_B     G   194_B     37   97  281     19   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     H   195_B     H   195_B     37   97  281     13   83  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     A   196_B     A   196_B     37   97  281     35   94  112  123  146  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     L   197_B     L   197_B     37   97  281     35   94  112  123  146  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     K   198_B     K   198_B     37   97  281     24   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     K   199_B     K   199_B     37   97  281      9   85  112  123  146  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     A   200_B     A   200_B     37   97  281     26   75  111  123  143  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     N   201_B     N   201_B     37   97  281     30   87  112  123  146  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     P   202_B     P   202_B     37   97  281     30   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     N   203_B     N   203_B     37   97  281     36   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     V   204_B     V   204_B     37   97  281     53   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     Q   205_B     Q   205_B     37   97  281     53   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     I   206_B     I   206_B     37   97  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     Y   207_B     Y   207_B     37   97  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     A   208_B     A   208_B     37   97  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     L   209_B     L   209_B     37   97  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     E   210_B     E   210_B     37   97  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     P   211_B     P   211_B     37   97  281     30   86  112  123  141  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     A   212_B     A   212_B     37   97  281     32   86  111  123  139  173  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     P   236_B     P   236_B      3   97  281      0    3    3    8   11   26   47   56   90  132  147  151  158  168  178  193  214  250  268  273 
LCS_GDT     K   237_B     K   237_B      3   97  281      0    3    3    4    7    8   41   58   71  103  146  155  163  165  183  200  226  249  268  273 
LCS_GDT     V   238_B     V   238_B      5   97  281      3    5    8   11   19   25   41   58   69   86  112  153  158  163  178  197  214  221  259  273 
LCS_GDT     L   239_B     L   239_B      6   97  281      4    6   15   65   94  125  139  142  153  168  203  213  244  262  268  272  273  275  275  276 
LCS_GDT     D   240_B     D   240_B     69   97  281      4   22   63  105  126  136  139  168  196  223  245  251  258  262  268  272  273  275  275  276 
LCS_GDT     T   241_B     T   241_B     72   97  281     15   57  105  123  134  172  208  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     D   242_B     D   242_B     72   97  281     40   94  112  123  146  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     V   243_B     V   243_B     72   97  281     29   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     Y   244_B     Y   244_B     72   97  281     40   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     N   245_B     N   245_B     72   97  281     29   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G   246_B     G   246_B     72   97  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     I   247_B     I   247_B     72   97  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     L   248_B     L   248_B     72   97  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     E   249_B     E   249_B     72   97  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     I   250_B     I   250_B     72   97  281     65   94  112  123  141  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     K   251_B     K   251_B     72   97  281     65   94  112  123  138  171  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     S   252_B     S   252_B     72   97  281     65   94  112  123  130  170  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     D   253_B     D   253_B     72   97  281     65   94  112  123  130  170  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     D   254_B     D   254_B     72   97  281     65   94  112  123  138  173  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     A   255_B     A   255_B     72   97  281     65   94  112  123  141  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     I   256_B     I   256_B     72   97  281     65   94  112  123  130  170  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     T   257_B     T   257_B     72   97  281     65   94  112  123  130  171  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     M   258_B     M   258_B     72   97  281     65   94  112  123  141  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     A   259_B     A   259_B     72   97  281     65   94  112  123  141  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     R   260_B     R   260_B     72   97  281     65   94  112  123  138  173  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     E   261_B     E   261_B     72   97  281     65   94  112  123  141  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     V   262_B     V   262_B     72   97  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G   263_B     G   263_B     72   97  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     H   264_B     H   264_B     72   97  281     65   94  112  123  141  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     Q   265_B     Q   265_B     72   97  281     65   94  112  123  145  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     E   266_B     E   266_B     72   97  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G   267_B     G   267_B     72   97  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     I   268_B     I   268_B     72   97  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     L   269_B     L   269_B     72   97  281     65   94  112  123  144  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     V   270_B     V   270_B     72   97  281     11   93  112  123  141  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G   271_B     G   271_B     72   97  281     24   94  112  123  130  172  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     I   272_B     I   272_B     72   97  281     65   94  112  123  130  172  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     S   273_B     S   273_B     72   97  281     65   94  112  123  141  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     A   274_B     A   274_B     72   97  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G   275_B     G   275_B     72   97  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     A   276_B     A   276_B     72   97  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     N   277_B     N   277_B     72   97  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     I   278_B     I   278_B     72   97  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     K   279_B     K   279_B     72   97  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G   280_B     G   280_B     72   97  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     A   281_B     A   281_B     72   97  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     I   282_B     I   282_B     72   97  281     57   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     E   283_B     E   283_B     72   97  281     57   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     V   284_B     V   284_B     72   97  281     57   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     A   285_B     A   285_B     72   97  281     57   94  112  123  144  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     K   286_B     K   286_B     72   97  281     57   94  112  123  138  180  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     K   287_B     K   287_B     72   97  281     47   89  112  123  135  180  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     L   288_B     L   288_B     72   97  281     37   91  112  123  130  180  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G   289_B     G   289_B     72   97  281      8   30   66  110  127  170  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     K   290_B     K   290_B     72   97  281     13   65  112  123  130  168  206  232  239  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G   291_B     G   291_B     72   97  281     35   94  112  123  130  170  207  232  239  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     K   292_B     K   292_B     72   97  281     46   94  112  123  133  180  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     Q   293_B     Q   293_B     72   97  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     V   294_B     V   294_B     72   97  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     I   295_B     I   295_B     72   97  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     T   296_B     T   296_B     72   97  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     V   297_B     V   297_B     72   97  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     A   298_B     A   298_B     72   97  281     65   94  112  123  148  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     P   299_B     P   299_B     72   97  281     65   94  112  123  143  181  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     D   300_B     D   300_B     72   97  281     14   83  110  123  130  158  200  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G   301_B     G   301_B     72   97  281     14   91  112  123  130  165  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     G   302_B     G   302_B     72   97  281     47   93  112  123  130  163  200  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     D   303_B     D   303_B     72   97  281     49   94  112  123  130  165  210  233  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     R   304_B     R   304_B     72   97  281     13   90  112  123  130  138  197  228  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     Y   305_B     Y   305_B     72   97  281     19   93  112  123  130  138  162  228  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     L   306_B     L   306_B     72   97  281     52   94  112  123  130  138  192  228  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     S   307_B     S   307_B     72   97  281     11   66  107  122  130  136  144  156  193  243  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     T   308_B     T   308_B     72   97  281      9   32  102  120  130  136  142  154  169  214  248  254  258  262  268  272  273  275  275  276 
LCS_GDT     E   309_B     E   309_B     72   97  281      8   32   93  120  130  136  142  150  164  190  228  254  258  262  268  272  273  275  275  276 
LCS_GDT     L   310_B     L   310_B     72   97  281      9   48  100  120  130  136  147  176  204  242  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     F   311_B     F   311_B     72   97  281      7   32  100  123  130  140  166  219  242  247  251  254  258  262  268  272  273  275  275  276 
LCS_GDT     N   312_B     N   312_B     72   97  281      9   49  100  120  130  136  143  168  204  228  248  254  258  262  268  272  273  275  275  276 
LCS_GDT     Y   313_B     Y   313_B     14   77  281      3    3    4   29   47   83  130  150  165  179  213  238  250  262  268  272  273  275  275  276 
LCS_AVERAGE  LCS_A:  51.32  (  20.54   33.41  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     65     94    112    123    148    181    210    233    242    247    251    254    258    262    268    272    273    275    275    276 
GDT PERCENT_AT  23.13  33.45  39.86  43.77  52.67  64.41  74.73  82.92  86.12  87.90  89.32  90.39  91.81  93.24  95.37  96.80  97.15  97.86  97.86  98.22
GDT RMS_LOCAL    0.29   0.58   0.75   0.90   1.70   1.97   2.21   2.42   2.57   2.62   2.72   2.82   2.94   3.10   3.31   3.44   3.46   3.56   3.56   3.60
GDT RMS_ALL_AT   6.33   6.16   6.14   6.11   4.10   4.06   4.05   4.04   4.05   4.04   4.04   4.04   4.01   3.99   3.98   3.97   3.98   3.97   3.97   3.98

# Checking swapping
#   possible swapping detected:  Y    38_B      Y    38_B
#   possible swapping detected:  E    42_B      E    42_B
#   possible swapping detected:  F    44_B      F    44_B
#   possible swapping detected:  E    76_B      E    76_B
#   possible swapping detected:  Y    95_B      Y    95_B
#   possible swapping detected:  E   103_B      E   103_B
#   possible swapping detected:  E   108_B      E   108_B
#   possible swapping detected:  F   151_B      F   151_B
#   possible swapping detected:  E   161_B      E   161_B
#   possible swapping detected:  E   170_B      E   170_B
#   possible swapping detected:  F   172_B      F   172_B
#   possible swapping detected:  D   240_B      D   240_B
#   possible swapping detected:  D   242_B      D   242_B
#   possible swapping detected:  D   253_B      D   253_B
#   possible swapping detected:  E   261_B      E   261_B
#   possible swapping detected:  D   300_B      D   300_B
#   possible swapping detected:  Y   305_B      Y   305_B
#   possible swapping detected:  F   311_B      F   311_B

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    H     6_B      H     6_B     8.324     0    0.638   0.928    14.785   10.952    4.667
LGA    H     7_B      H     7_B     5.134     0    0.084   1.156     7.090   22.738   20.429
LGA    T     8_B      T     8_B     6.790     0    0.579   1.203    10.657   20.833   12.381
LGA    K     9_B      K     9_B     5.197     4    0.316   0.532     6.795   19.524   10.582
LGA    I    10_B      I    10_B     5.110     0    0.476   0.815     9.497   28.929   21.667
LGA    T    11_B      T    11_B     3.106     0    0.092   1.123     3.755   48.333   51.088
LGA    N    12_B      N    12_B     3.055     0    0.051   0.537     5.721   55.476   45.893
LGA    S    13_B      S    13_B     2.207     0    0.115   0.192     2.616   66.905   66.270
LGA    I    14_B      I    14_B     1.061     0    0.036   0.136     1.499   85.952   87.083
LGA    V    15_B      V    15_B     0.513     0    0.059   1.389     3.286   88.214   80.000
LGA    N    16_B      N    16_B     1.917     0    0.041   0.162     2.574   70.952   66.905
LGA    L    17_B      L    17_B     2.177     0    0.087   0.174     2.551   64.881   64.881
LGA    I    18_B      I    18_B     2.255     0    0.041   0.074     2.964   62.976   67.024
LGA    G    19_B      G    19_B     3.886     0    0.685   0.685     4.584   42.024   42.024
LGA    N    20_B      N    20_B     3.909     0    0.107   0.166     4.765   45.238   42.024
LGA    T    21_B      T    21_B     3.335     0    0.026   0.117     3.969   48.333   46.190
LGA    P    22_B      P    22_B     2.224     0    0.025   0.087     2.533   64.881   67.143
LGA    I    23_B      I    23_B     1.848     0    0.090   0.355     3.622   70.833   63.214
LGA    V    24_B      V    24_B     1.349     0    0.076   1.011     3.168   81.429   78.231
LGA    K    25_B      K    25_B     1.485     0    0.030   0.205     2.068   77.143   73.862
LGA    L    26_B      L    26_B     1.300     0    0.036   0.131     1.528   77.143   79.286
LGA    N    27_B      N    27_B     2.160     0    0.097   1.118     3.488   64.881   62.024
LGA    R    28_B      R    28_B     2.429     0    0.097   0.230     3.011   59.167   59.264
LGA    V    29_B      V    29_B     2.219     0    0.047   0.115     2.365   64.762   65.918
LGA    V    30_B      V    30_B     2.378     0    0.077   1.379     3.580   60.952   57.415
LGA    P    31_B      P    31_B     3.598     0    0.088   0.227     3.855   46.786   51.497
LGA    E    32_B      E    32_B     4.856     4    0.100   0.145     5.493   31.548   16.931
LGA    D    33_B      D    33_B     3.909     0    0.702   0.987     5.440   37.500   38.869
LGA    A    34_B      A    34_B     3.624     0    0.569   0.596     5.659   57.500   50.286
LGA    A    35_B      A    35_B     3.109     0    0.057   0.079     3.900   53.571   51.524
LGA    D    36_B      D    36_B     1.915     0    0.075   0.163     2.523   70.833   68.869
LGA    V    37_B      V    37_B     1.271     0    0.059   1.378     3.436   79.286   74.490
LGA    Y    38_B      Y    38_B     1.353     0    0.047   0.206     2.861   81.429   69.762
LGA    V    39_B      V    39_B     1.102     0    0.040   0.903     2.490   81.429   79.116
LGA    K    40_B      K    40_B     1.832     0    0.023   0.217     4.205   75.000   60.635
LGA    L    41_B      L    41_B     1.920     0    0.076   0.107     2.816   66.905   72.024
LGA    E    42_B      E    42_B     2.396     0    0.125   0.984     5.585   60.952   51.481
LGA    F    43_B      F    43_B     3.095     0    0.040   0.380     4.248   48.452   49.784
LGA    F    44_B      F    44_B     4.021     0    0.217   0.732     5.812   33.333   42.857
LGA    N    45_B      N    45_B     4.090     0    0.117   1.342     5.306   41.905   39.702
LGA    P    46_B      P    46_B     5.475     0    0.018   0.217     7.359   29.048   22.381
LGA    G    47_B      G    47_B     2.550     0    0.133   0.133     5.625   48.690   48.690
LGA    G    48_B      G    48_B     4.235     0    0.070   0.070     5.769   36.429   36.429
LGA    S    49_B      S    49_B     3.475     0    0.041   0.096     3.497   50.000   50.000
LGA    I    50_B      I    50_B     3.528     0    0.150   0.772     4.921   48.452   43.631
LGA    K    51_B      K    51_B     3.484     2    0.173   0.825     3.943   48.333   39.048
LGA    D    52_B      D    52_B     2.608     0    0.047   0.310     4.361   65.000   54.345
LGA    R    53_B      R    53_B     0.890     0    0.064   0.932     7.321   83.690   52.165
LGA    I    54_B      I    54_B     2.521     0    0.043   1.647     5.530   59.048   47.143
LGA    A    55_B      A    55_B     2.776     0    0.048   0.080     3.216   60.952   58.762
LGA    L    56_B      L    56_B     1.479     0    0.031   0.104     1.856   79.286   83.750
LGA    A    57_B      A    57_B     1.509     0    0.075   0.081     1.634   77.143   76.286
LGA    M    58_B      M    58_B     2.000     0    0.032   0.198     2.722   72.857   65.952
LGA    I    59_B      I    59_B     1.490     0    0.012   0.152     2.235   79.286   76.131
LGA    E    60_B      E    60_B     1.326     0    0.022   0.329     1.438   81.429   87.566
LGA    E    61_B      E    61_B     1.368     0    0.035   0.966     3.200   81.429   71.481
LGA    A    62_B      A    62_B     1.122     0    0.033   0.036     1.236   81.429   81.429
LGA    E    63_B      E    63_B     1.219     0    0.057   0.214     1.779   81.429   78.571
LGA    K    64_B      K    64_B     1.344     4    0.089   0.090     1.361   81.429   45.238
LGA    A    65_B      A    65_B     1.020     0    0.080   0.093     1.285   85.952   85.048
LGA    G    66_B      G    66_B     0.816     0    0.173   0.173     1.010   88.214   88.214
LGA    K    67_B      K    67_B     0.850     4    0.032   0.069     1.319   90.476   49.259
LGA    L    68_B      L    68_B     0.806     0    0.026   1.335     2.716   85.952   79.702
LGA    Q    69_B      Q    69_B     1.892     4    0.026   0.042     2.135   72.976   39.630
LGA    A    70_B      A    70_B     2.846     0    0.686   0.648     3.304   57.262   55.810
LGA    G    71_B      G    71_B     3.954     0    0.090   0.090     4.291   43.452   43.452
LGA    G    72_B      G    72_B     2.569     0    0.074   0.074     2.920   62.976   62.976
LGA    T    73_B      T    73_B     1.717     0    0.038   0.123     2.278   70.833   70.544
LGA    I    74_B      I    74_B     0.894     0    0.055   0.564     2.102   88.214   85.000
LGA    V    75_B      V    75_B     1.077     0    0.018   0.068     1.461   88.214   85.306
LGA    E    76_B      E    76_B     0.963     0    0.082   0.186     1.122   85.952   88.466
LGA    P    77_B      P    77_B     1.568     0    0.130   0.144     2.119   75.000   74.150
LGA    T    78_B      T    78_B     1.580     0    0.150   0.380     2.219   72.857   72.925
LGA    S    79_B      S    79_B     1.689     0    0.668   0.590     3.365   69.286   67.778
LGA    G    80_B      G    80_B     1.493     0    0.144   0.144     1.498   81.429   81.429
LGA    N    81_B      N    81_B     1.882     3    0.101   0.114     2.624   72.857   43.571
LGA    T    82_B      T    82_B     2.151     0    0.075   0.126     2.965   70.833   64.966
LGA    G    83_B      G    83_B     1.064     0    0.034   0.034     1.310   81.429   81.429
LGA    V    84_B      V    84_B     1.290     0    0.031   1.367     3.961   81.429   73.537
LGA    G    85_B      G    85_B     1.922     0    0.045   0.045     2.018   70.833   70.833
LGA    L    86_B      L    86_B     1.743     0    0.038   1.300     2.663   72.857   73.274
LGA    A    87_B      A    87_B     1.257     0    0.038   0.040     1.428   81.429   83.238
LGA    M    88_B      M    88_B     1.754     0    0.079   0.796     2.144   72.857   70.833
LGA    V    89_B      V    89_B     2.331     0    0.070   0.121     2.652   64.762   62.585
LGA    A    90_B      A    90_B     1.913     0    0.082   0.078     2.324   70.833   71.238
LGA    A    91_B      A    91_B     1.680     0    0.031   0.047     2.425   68.810   71.333
LGA    A    92_B      A    92_B     2.952     0    0.040   0.041     3.458   55.476   54.381
LGA    K    93_B      K    93_B     2.924     0    0.042   0.709     3.086   55.357   59.894
LGA    G    94_B      G    94_B     2.626     0    0.178   0.178     2.628   60.952   60.952
LGA    Y    95_B      Y    95_B     1.547     0    0.040   0.093     1.875   75.000   75.000
LGA    H    96_B      H    96_B     1.293     0    0.038   1.020     6.846   79.286   54.238
LGA    L    97_B      L    97_B     0.682     0    0.032   0.854     2.279   90.476   86.250
LGA    V    98_B      V    98_B     0.966     0    0.048   1.378     3.769   90.476   81.156
LGA    I    99_B      I    99_B     0.938     0    0.019   0.663     1.768   85.952   86.012
LGA    T   100_B      T   100_B     1.700     0    0.027   0.089     2.094   75.000   72.925
LGA    M   101_B      M   101_B     2.027     0    0.028   0.600     2.400   66.786   66.786
LGA    P   102_B      P   102_B     2.272     0    0.015   0.203     2.637   64.762   64.830
LGA    E   103_B      E   103_B     1.956     0    0.018   0.325     2.883   68.810   66.614
LGA    T   104_B      T   104_B     2.579     0    0.033   0.042     3.038   59.048   57.211
LGA    M   105_B      M   105_B     2.984     0    0.097   0.722     3.690   51.905   55.714
LGA    S   106_B      S   106_B     3.554     0    0.433   0.723     5.873   53.810   43.810
LGA    V   107_B      V   107_B     3.113     0    0.642   1.306     7.114   48.571   42.653
LGA    E   108_B      E   108_B     2.879     0    0.032   1.332     5.318   62.976   48.889
LGA    R   109_B      R   109_B     0.921     4    0.051   0.555     2.040   88.214   55.281
LGA    R   110_B      R   110_B     1.177     0    0.086   1.186     3.653   83.690   74.329
LGA    K   111_B      K   111_B     1.202     0    0.032   0.372     3.847   85.952   70.212
LGA    L   112_B      L   112_B     0.837     0    0.051   1.237     3.096   90.476   76.190
LGA    M   113_B      M   113_B     0.658     0    0.025   0.291     1.288   90.476   89.345
LGA    Q   114_B      Q   114_B     0.640     0    0.024   1.014     3.385   90.476   83.968
LGA    G   115_B      G   115_B     0.756     0    0.054   0.054     1.052   88.214   88.214
LGA    Y   116_B      Y   116_B     0.744     0    0.036   0.707     2.094   90.476   83.135
LGA    G   117_B      G   117_B     0.618     0    0.053   0.053     0.909   90.476   90.476
LGA    A   118_B      A   118_B     0.467     0    0.023   0.023     0.561   92.857   94.286
LGA    E   119_B      E   119_B     0.976     0    0.047   0.790     2.987   88.214   79.841
LGA    L   120_B      L   120_B     1.024     0    0.027   1.030     2.906   81.548   77.500
LGA    I   121_B      I   121_B     1.503     1    0.027   1.331     3.543   75.000   59.167
LGA    L   122_B      L   122_B     1.746     0    0.071   0.142     2.100   68.810   70.833
LGA    T   123_B      T   123_B     2.542     0    0.045   0.077     2.715   59.048   58.231
LGA    P   124_B      P   124_B     3.209     0    0.034   0.166     3.691   50.000   48.095
LGA    G   125_B      G   125_B     3.476     0    0.034   0.034     4.015   45.119   45.119
LGA    A   126_B      A   126_B     4.965     0    0.054   0.057     5.488   32.857   31.524
LGA    D   127_B      D   127_B     3.785     0    0.067   0.537     5.286   45.119   42.143
LGA    G   128_B      G   128_B     3.310     0    0.054   0.054     3.484   51.786   51.786
LGA    M   129_B      M   129_B     2.860     0    0.058   0.498     3.485   55.357   54.464
LGA    K   130_B      K   130_B     3.337     4    0.051   0.075     3.517   50.000   27.037
LGA    G   131_B      G   131_B     3.264     0    0.036   0.036     3.344   53.571   53.571
LGA    A   132_B      A   132_B     2.324     0    0.028   0.040     2.714   62.857   63.238
LGA    I   133_B      I   133_B     2.245     0    0.100   0.187     2.429   64.762   64.762
LGA    A   134_B      A   134_B     2.915     0    0.034   0.045     3.210   57.143   55.714
LGA    K   135_B      K   135_B     2.649     0    0.061   0.668     3.040   57.143   59.894
LGA    A   136_B      A   136_B     2.057     0    0.033   0.041     2.292   64.762   66.381
LGA    E   137_B      E   137_B     2.148     2    0.067   0.129     2.413   64.762   52.169
LGA    E   138_B      E   138_B     2.641     0    0.036   0.847     6.039   57.143   46.402
LGA    L   139_B      L   139_B     2.529     0    0.029   1.166     5.573   57.143   54.583
LGA    V   140_B      V   140_B     2.230     0    0.179   0.252     2.393   64.762   65.918
LGA    K   141_B      K   141_B     2.512     4    0.116   0.124     2.875   59.048   32.593
LGA    E   142_B      E   142_B     2.184     4    0.114   0.145     2.485   64.762   36.878
LGA    K   143_B      K   143_B     1.764     4    0.541   0.552     3.376   69.286   39.841
LGA    G   144_B      G   144_B     1.633     0    0.060   0.060     1.907   77.143   77.143
LGA    Y   145_B      Y   145_B     1.245     0    0.223   0.394     4.089   83.690   66.429
LGA    F   146_B      F   146_B     1.291     0    0.060   0.133     1.364   81.429   83.896
LGA    M   147_B      M   147_B     1.054     0    0.020   0.314     1.467   81.429   81.429
LGA    P   148_B      P   148_B     1.150     0    0.620   0.727     2.268   77.262   81.633
LGA    M   149_B      M   149_B     3.159     3    0.337   0.370     3.587   59.405   35.119
LGA    Q   150_B      Q   150_B     2.979     4    0.689   0.638     4.830   50.357   25.873
LGA    F   151_B      F   151_B     3.098     0    0.151   1.237    11.685   59.167   25.887
LGA    D   152_B      D   152_B     4.038     3    0.198   0.215     5.936   36.786   21.071
LGA    N   153_B      N   153_B     7.115     3    0.077   0.120     8.131   16.667    8.929
LGA    P   154_B      P   154_B     8.042     0    0.234   0.266     9.761    4.048    2.789
LGA    A   155_B      A   155_B    12.506     0    0.606   0.610    14.404    0.000    0.000
LGA    H   160_B      H   160_B    12.240     5    0.642   0.616    13.129    0.000    0.000
LGA    E   161_B      E   161_B     8.068     0    0.067   0.683     9.395    6.548    8.254
LGA    E   162_B      E   162_B     7.173     0    0.203   1.094     8.815   10.119    8.307
LGA    T   163_B      T   163_B     8.812     0    0.152   1.148    10.526    3.333    2.993
LGA    T   164_B      T   164_B     9.647     0    0.053   0.188    10.483    1.548    0.884
LGA    G   165_B      G   165_B     7.282     0    0.037   0.037     7.990    9.286    9.286
LGA    K   166_B      K   166_B     6.966     4    0.060   0.095     7.734   10.238    6.032
LGA    E   167_B      E   167_B     9.369     0    0.026   0.871    10.103    1.667    1.217
LGA    I   168_B      I   168_B     9.235     0    0.030   0.108     9.726    1.786    1.548
LGA    L   169_B      L   169_B     7.795     0    0.033   0.815     8.837    4.405   10.179
LGA    E   170_B      E   170_B     9.682     0    0.036   0.924    11.743    0.833    0.423
LGA    A   171_B      A   171_B    11.015     0    0.075   0.072    11.441    0.000    0.000
LGA    F   172_B      F   172_B     9.566     0    0.033   0.456     9.864    0.476    1.472
LGA    G   173_B      G   173_B    10.753     0    0.134   0.134    10.885    0.000    0.000
LGA    D   174_B      D   174_B     9.098     0    0.029   0.217    11.004    1.905    1.250
LGA    D   175_B      D   175_B     8.753     0    0.147   0.308    10.255    3.929    2.381
LGA    I   176_B      I   176_B     6.043     0    0.179   0.596     6.655   19.524   21.131
LGA    P   177_B      P   177_B     3.536     0    0.284   0.678     5.830   47.262   42.721
LGA    D   178_B      D   178_B     2.618     0    0.103   0.180     3.688   60.952   55.536
LGA    A   179_B      A   179_B     1.880     0    0.043   0.042     2.265   70.833   71.238
LGA    F   180_B      F   180_B     1.589     0    0.023   0.130     2.438   77.143   71.472
LGA    V   181_B      V   181_B     1.143     0    0.023   0.092     1.397   81.429   85.306
LGA    A   182_B      A   182_B     1.650     0    0.081   0.101     2.025   75.000   72.952
LGA    G   183_B      G   183_B     1.613     0    0.054   0.054     1.644   77.143   77.143
LGA    V   184_B      V   184_B     1.816     0    0.082   1.115     3.813   70.833   66.327
LGA    G   185_B      G   185_B     2.410     0    0.102   0.102     3.751   55.714   55.714
LGA    T   186_B      T   186_B     4.908     0    0.065   0.096     6.400   31.905   26.803
LGA    G   187_B      G   187_B     3.404     0    0.035   0.035     3.739   46.667   46.667
LGA    G   188_B      G   188_B     4.569     0    0.106   0.106     4.569   35.714   35.714
LGA    T   189_B      T   189_B     3.859     0    0.029   0.116     4.721   46.667   41.769
LGA    L   190_B      L   190_B     2.423     0    0.028   0.432     3.184   62.857   62.976
LGA    T   191_B      T   191_B     2.515     0    0.025   0.116     2.988   59.048   58.231
LGA    G   192_B      G   192_B     3.135     0    0.020   0.020     3.135   53.571   53.571
LGA    V   193_B      V   193_B     2.975     0    0.042   0.106     3.280   57.143   54.082
LGA    G   194_B      G   194_B     2.254     0    0.071   0.071     2.450   64.762   64.762
LGA    H   195_B      H   195_B     2.254     0    0.037   0.593     2.889   62.857   60.952
LGA    A   196_B      A   196_B     3.210     0    0.020   0.028     3.606   51.786   50.095
LGA    L   197_B      L   197_B     2.695     0    0.022   0.114     3.358   57.143   58.155
LGA    K   198_B      K   198_B     2.260     0    0.069   0.656     2.505   62.857   71.481
LGA    K   199_B      K   199_B     2.954     2    0.058   0.279     3.052   55.357   43.651
LGA    A   200_B      A   200_B     2.966     0    0.028   0.037     3.002   55.357   55.714
LGA    N   201_B      N   201_B     2.550     0    0.140   0.273     2.925   59.048   59.048
LGA    P   202_B      P   202_B     2.443     0    0.741   0.858     4.921   54.524   56.735
LGA    N   203_B      N   203_B     2.363     0    0.145   1.051     3.932   64.762   60.179
LGA    V   204_B      V   204_B     2.277     0    0.049   1.072     3.740   68.810   60.952
LGA    Q   205_B      Q   205_B     1.669     0    0.041   1.245     3.558   72.857   68.783
LGA    I   206_B      I   206_B     1.566     0    0.023   0.384     1.841   77.143   76.071
LGA    Y   207_B      Y   207_B     1.198     0    0.018   0.441     2.903   81.429   76.706
LGA    A   208_B      A   208_B     1.491     0    0.036   0.037     1.874   81.429   79.714
LGA    L   209_B      L   209_B     1.511     0    0.014   1.113     3.618   75.000   69.226
LGA    E   210_B      E   210_B     2.390     0    0.054   0.397     2.639   62.976   66.667
LGA    P   211_B      P   211_B     3.123     0    0.057   0.269     3.541   51.786   50.068
LGA    A   212_B      A   212_B     3.296     0    0.566   0.512     3.619   48.333   48.667
LGA    P   236_B      P   236_B    14.136     0    0.484   0.768    15.414    0.000    0.000
LGA    K   237_B      K   237_B    14.536     0    0.532   0.999    16.150    0.000    0.000
LGA    V   238_B      V   238_B    14.326     0    0.624   1.337    17.438    0.000    0.000
LGA    L   239_B      L   239_B     8.663     0    0.118   1.436    10.680    2.619    7.738
LGA    D   240_B      D   240_B     7.160     0    0.053   0.200     8.727   16.190   12.381
LGA    T   241_B      T   241_B     3.779     0    0.178   0.248     5.796   51.190   40.544
LGA    D   242_B      D   242_B     2.996     0    0.146   0.457     4.629   55.357   47.083
LGA    V   243_B      V   243_B     2.102     0    0.082   0.223     2.531   69.048   70.680
LGA    Y   244_B      Y   244_B     1.141     0    0.083   1.044     6.737   85.952   59.444
LGA    N   245_B      N   245_B     0.978     0    0.088   0.295     2.012   85.952   80.536
LGA    G   246_B      G   246_B     0.997     0    0.029   0.029     0.997   90.476   90.476
LGA    I   247_B      I   247_B     1.214     0    0.053   1.130     3.515   81.429   75.595
LGA    L   248_B      L   248_B     1.222     0    0.042   0.847     4.117   81.429   72.738
LGA    E   249_B      E   249_B     2.216     0    0.043   1.039     4.405   66.786   57.884
LGA    I   250_B      I   250_B     2.774     0    0.031   0.184     3.112   53.571   57.262
LGA    K   251_B      K   251_B     3.600     2    0.061   0.113     3.904   45.000   34.444
LGA    S   252_B      S   252_B     3.786     0    0.026   0.550     4.915   43.333   41.349
LGA    D   253_B      D   253_B     4.017     0    0.017   1.002     6.801   41.786   32.024
LGA    D   254_B      D   254_B     3.338     0    0.031   0.613     4.348   48.333   45.893
LGA    A   255_B      A   255_B     2.931     0    0.039   0.070     3.107   51.786   51.429
LGA    I   256_B      I   256_B     3.744     0    0.012   0.140     4.596   45.000   40.357
LGA    T   257_B      T   257_B     3.749     0    0.077   1.155     6.362   46.667   40.612
LGA    M   258_B      M   258_B     2.806     0    0.045   0.921     3.628   55.357   57.381
LGA    A   259_B      A   259_B     2.774     0    0.040   0.044     2.910   57.143   57.143
LGA    R   260_B      R   260_B     3.407     0    0.033   1.327     8.235   50.000   33.030
LGA    E   261_B      E   261_B     3.138     0    0.056   0.372     3.813   53.571   50.899
LGA    V   262_B      V   262_B     2.111     0    0.027   0.404     2.501   66.786   64.830
LGA    G   263_B      G   263_B     2.189     0    0.094   0.094     2.291   64.762   64.762
LGA    H   264_B      H   264_B     2.800     0    0.107   0.804     4.860   57.143   51.905
LGA    Q   265_B      Q   265_B     2.522     0    0.072   1.081     4.727   60.952   56.931
LGA    E   266_B      E   266_B     1.594     0    0.051   0.839     3.301   72.857   71.640
LGA    G   267_B      G   267_B     1.748     0    0.064   0.064     1.748   72.857   72.857
LGA    I   268_B      I   268_B     1.487     0    0.034   0.217     1.872   75.000   77.143
LGA    L   269_B      L   269_B     2.491     0    0.034   0.201     4.061   60.952   53.095
LGA    V   270_B      V   270_B     2.837     0    0.051   0.128     3.356   53.571   55.102
LGA    G   271_B      G   271_B     3.519     0    0.037   0.037     3.519   48.333   48.333
LGA    I   272_B      I   272_B     3.508     0    0.037   0.225     5.519   48.452   40.893
LGA    S   273_B      S   273_B     2.770     0    0.127   0.539     3.109   59.167   56.111
LGA    A   274_B      A   274_B     1.750     0    0.035   0.046     2.044   72.976   72.952
LGA    G   275_B      G   275_B     2.122     0    0.045   0.045     2.149   66.786   66.786
LGA    A   276_B      A   276_B     2.224     0    0.034   0.043     2.544   68.810   66.476
LGA    N   277_B      N   277_B     1.404     0    0.021   0.072     1.883   79.286   77.143
LGA    I   278_B      I   278_B     1.241     0    0.060   0.253     1.467   81.429   82.560
LGA    K   279_B      K   279_B     1.920     0    0.040   0.787     5.569   72.857   57.196
LGA    G   280_B      G   280_B     1.213     0    0.026   0.026     1.429   81.429   81.429
LGA    A   281_B      A   281_B     1.082     0    0.026   0.033     1.751   81.548   83.333
LGA    I   282_B      I   282_B     2.053     0    0.023   1.443     4.975   64.881   53.810
LGA    E   283_B      E   283_B     2.282     0    0.053   0.321     2.703   62.857   64.815
LGA    V   284_B      V   284_B     2.038     0    0.015   0.115     2.719   64.881   68.367
LGA    A   285_B      A   285_B     2.658     0    0.034   0.040     3.405   55.476   55.810
LGA    K   286_B      K   286_B     3.355     0    0.067   0.802     5.359   45.119   44.444
LGA    K   287_B      K   287_B     3.572     2    0.229   0.400     3.961   45.000   37.460
LGA    L   288_B      L   288_B     3.736     0    0.622   0.610     5.552   37.857   41.429
LGA    G   289_B      G   289_B     3.400     0    0.091   0.091     3.576   48.333   48.333
LGA    K   290_B      K   290_B     4.195     2    0.120   0.373     6.681   40.238   25.238
LGA    G   291_B      G   291_B     4.162     0    0.036   0.036     4.182   40.238   40.238
LGA    K   292_B      K   292_B     3.496     0    0.040   0.631     4.481   48.333   44.180
LGA    Q   293_B      Q   293_B     2.445     0    0.055   1.293     8.432   62.857   41.270
LGA    V   294_B      V   294_B     1.679     0    0.041   0.795     3.502   75.000   69.864
LGA    I   295_B      I   295_B     1.604     0    0.037   1.338     3.838   77.143   69.643
LGA    T   296_B      T   296_B     1.119     0    0.117   0.243     1.237   81.429   85.306
LGA    V   297_B      V   297_B     1.919     0    0.041   0.333     2.930   72.857   68.299
LGA    A   298_B      A   298_B     2.051     0    0.069   0.066     2.664   64.881   64.857
LGA    P   299_B      P   299_B     2.792     0    0.045   0.200     3.879   53.810   56.327
LGA    D   300_B      D   300_B     4.167     0    0.097   0.221     6.521   45.119   35.417
LGA    G   301_B      G   301_B     3.736     0    0.047   0.047     4.364   41.786   41.786
LGA    G   302_B      G   302_B     4.058     0    0.104   0.104     4.298   38.690   38.690
LGA    D   303_B      D   303_B     3.690     0    0.182   1.178     4.820   37.262   40.476
LGA    R   304_B      R   304_B     4.980     6    0.103   0.107     5.606   29.048   12.944
LGA    Y   305_B      Y   305_B     5.369     0    0.066   0.195     5.751   23.810   26.270
LGA    L   306_B      L   306_B     5.118     0    0.048   0.212     5.924   23.810   29.762
LGA    S   307_B      S   307_B     7.174     0    0.084   0.647     8.301    8.810    8.254
LGA    T   308_B      T   308_B     7.669     0    0.057   0.135     7.669    8.571    9.660
LGA    E   309_B      E   309_B     8.053     3    0.061   0.676     9.746    6.548    3.280
LGA    L   310_B      L   310_B     6.400     0    0.045   0.100     7.016   16.429   20.774
LGA    F   311_B      F   311_B     4.876     0    0.422   0.819     5.339   33.095   42.771
LGA    N   312_B      N   312_B     7.280     0    0.240   1.222    12.761   14.524    7.440
LGA    Y   313_B      Y   313_B     8.834     0    0.405   1.295     9.394    3.452   14.921

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      281    1124   1124  100.00    1997   1997  100.00               281
SUMMARY(RMSD_GDC):     3.967          3.940                  4.240           56.926   53.029

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  313  281    4.0    233    2.42    64.235    59.418     9.232

LGA_LOCAL      RMSD:   2.424  Number of atoms:  233  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   4.044  Number of assigned atoms:  281 
Std_ASGN_ATOMS RMSD:   3.967  Standard rmsd on all 281 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.672660 * X  +   0.670709 * Y  +   0.312535 * Z  +  47.189732
  Y_new =   0.701560 * X  +   0.443794 * Y  +   0.557549 * Z  +   4.343757
  Z_new =   0.235252 * X  +   0.594303 * Y  +  -0.769065 * Z  +  18.961878 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  2.335167 -0.237477  2.483683   [DEG:  133.7952  -13.6065  142.3046 ]
ZXZ:  2.630684  2.448173  0.376919   [DEG:  150.7271  140.2700   21.5959 ]
 
# END of job
