
#######################################################
#                                                     #
#                        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     4.42
  LONGEST_CONTINUOUS_SEGMENT:   120      34_B - 153_B       1.99     4.51
  LCS_AVERAGE:     32.17

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    87      56_B - 142_B       1.00     5.62
  LCS_AVERAGE:     20.38

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      4    5  281      3    3    4    4    5    7    7    7    7    8    8   19  176  248  259  263  268  273  275  276 
LCS_GDT     H     7_B     H     7_B      4   16  281      3    3    4    5  123  162  189  228  240  246  251  254  257  261  265  271  273  275  275  276 
LCS_GDT     T     8_B     T     8_B     12   16  281      3    9   23   86  106  130  150  181  215  241  251  254  256  260  265  270  273  275  275  276 
LCS_GDT     K     9_B     K     9_B     12   16  281      3   12   16   90  113  132  162  187  223  246  251  254  256  260  265  270  273  275  275  276 
LCS_GDT     I    10_B     I    10_B     12   16  281     40   67   89  114  134  167  203  232  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     T    11_B     T    11_B     12   16  281      3   64   89  118  147  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     N    12_B     N    12_B     12   19  281      4   50   89  118  147  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     S    13_B     S    13_B     12   31  281      6   61   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     I    14_B     I    14_B     12   33  281     20   61   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     V    15_B     V    15_B     12   33  281     20   59   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     N    16_B     N    16_B     12   33  281     40   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     L    17_B     L    17_B     12   33  281      7   54   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     I    18_B     I    18_B     16   33  281     10   58  105  121  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G    19_B     G    19_B     16   33  281      5   56  110  124  130  162  205  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     N    20_B     N    20_B     23   33  281     21   93  112  124  130  146  199  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     T    21_B     T    21_B     23   33  281     63   93  112  124  130  175  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     P    22_B     P    22_B     23   33  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     I    23_B     I    23_B     23   33  281     53   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     V    24_B     V    24_B     23   33  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     K    25_B     K    25_B     23   33  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     L    26_B     L    26_B     23   33  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     N    27_B     N    27_B     23   33  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     R    28_B     R    28_B     23   33  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     V    29_B     V    29_B     23   33  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     V    30_B     V    30_B     23   33  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     P    31_B     P    31_B     23   33  281     42   93  112  124  130  170  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     E    32_B     E    32_B     23   33  281     45   93  112  124  130  149  196  231  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     D    33_B     D    33_B     23  120  281      3   91  112  124  130  173  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     A    34_B     A    34_B     23  120  281      3    4   34   93  145  175  210  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     A    35_B     A    35_B     23  120  281      4   73  108  124  143  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     D    36_B     D    36_B     23  120  281     24   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     V    37_B     V    37_B     23  120  281     28   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     Y    38_B     Y    38_B     23  120  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     V    39_B     V    39_B     23  120  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     K    40_B     K    40_B     23  120  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     L    41_B     L    41_B     23  120  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     E    42_B     E    42_B     23  120  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     F    43_B     F    43_B     12  120  281     36   93  112  124  144  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     F    44_B     F    44_B     12  120  281     14   79  111  124  130  165  201  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     N    45_B     N    45_B     12  120  281     51   88  111  124  130  147  199  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     P    46_B     P    46_B     11  120  281      4   26   69  122  130  136  155  195  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G    47_B     G    47_B     23  120  281      4   51   82  105  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G    48_B     G    48_B     23  120  281      4    6   28   46   88  159  199  228  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     S    49_B     S    49_B     29  120  281      4   18   59   91  112  177  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     I    50_B     I    50_B     30  120  281      4   19   59   89  112  177  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     K    51_B     K    51_B     30  120  281      6   19   70   95  115  177  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     D    52_B     D    52_B     30  120  281     30   68   89  110  147  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     R    53_B     R    53_B     30  120  281     12   52   88  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     I    54_B     I    54_B     30  120  281      6   22   64  101  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     A    55_B     A    55_B     30  120  281      9   60   84  106  147  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     L    56_B     L    56_B     87  120  281     29   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     A    57_B     A    57_B     87  120  281     14   66   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     M    58_B     M    58_B     87  120  281     11   59   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     I    59_B     I    59_B     87  120  281     30   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     E    60_B     E    60_B     87  120  281     28   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     E    61_B     E    61_B     87  120  281     26   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     A    62_B     A    62_B     87  120  281     30   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     E    63_B     E    63_B     87  120  281     29   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     K    64_B     K    64_B     87  120  281     28   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     A    65_B     A    65_B     87  120  281     29   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G    66_B     G    66_B     87  120  281     29   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     K    67_B     K    67_B     87  120  281     29   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     L    68_B     L    68_B     87  120  281     29   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     Q    69_B     Q    69_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     A    70_B     A    70_B     87  120  281     32   68   89  118  147  181  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G    71_B     G    71_B     87  120  281     24   49   76  104  131  162  203  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G    72_B     G    72_B     87  120  281     40   67   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     T    73_B     T    73_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     I    74_B     I    74_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     V    75_B     V    75_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     E    76_B     E    76_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     P    77_B     P    77_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     T    78_B     T    78_B     87  120  281     31   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     S    79_B     S    79_B     87  120  281      3   46   88  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G    80_B     G    80_B     87  120  281     16   41   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     N    81_B     N    81_B     87  120  281      6   58  101  121  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     T    82_B     T    82_B     87  120  281     17   40   93  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G    83_B     G    83_B     87  120  281     17   67   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     V    84_B     V    84_B     87  120  281     17   67   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G    85_B     G    85_B     87  120  281     17   67   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     L    86_B     L    86_B     87  120  281     24   67   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     A    87_B     A    87_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     M    88_B     M    88_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     V    89_B     V    89_B     87  120  281     23   67   89  117  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     A    90_B     A    90_B     87  120  281     19   67   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     A    91_B     A    91_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     A    92_B     A    92_B     87  120  281     19   67   89  111  141  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     K    93_B     K    93_B     87  120  281     17   67   89  112  142  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G    94_B     G    94_B     87  120  281     43   68   89  117  147  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     Y    95_B     Y    95_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     H    96_B     H    96_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     L    97_B     L    97_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     V    98_B     V    98_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     I    99_B     I    99_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     T   100_B     T   100_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     M   101_B     M   101_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     P   102_B     P   102_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     E   103_B     E   103_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     T   104_B     T   104_B     87  120  281     35   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     M   105_B     M   105_B     87  120  281      7   66   89  117  147  181  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     S   106_B     S   106_B     87  120  281      3    3   35   99  144  177  208  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     V   107_B     V   107_B     87  120  281      4   18   74  105  147  178  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     E   108_B     E   108_B     87  120  281     20   60   89  118  147  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     R   109_B     R   109_B     87  120  281      9   63   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     R   110_B     R   110_B     87  120  281     40   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     K   111_B     K   111_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     L   112_B     L   112_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     M   113_B     M   113_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     Q   114_B     Q   114_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G   115_B     G   115_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     Y   116_B     Y   116_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G   117_B     G   117_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     A   118_B     A   118_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     E   119_B     E   119_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     L   120_B     L   120_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     I   121_B     I   121_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     L   122_B     L   122_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     T   123_B     T   123_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     P   124_B     P   124_B     87  120  281     44   68   89  118  147  181  209  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G   125_B     G   125_B     87  120  281     44   68   89  118  147  179  208  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     A   126_B     A   126_B     87  120  281     30   61   89  109  134  160  190  218  238  245  248  251  256  261  267  271  273  275  275  276 
LCS_GDT     D   127_B     D   127_B     87  120  281     44   68   89  118  144  178  208  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G   128_B     G   128_B     87  120  281     44   68   89  118  147  179  209  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     M   129_B     M   129_B     87  120  281     44   68   89  118  147  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     K   130_B     K   130_B     87  120  281     44   68   89  118  147  179  209  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G   131_B     G   131_B     87  120  281     43   68   89  118  147  180  209  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     A   132_B     A   132_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     I   133_B     I   133_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     A   134_B     A   134_B     87  120  281     44   68   89  118  147  181  210  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     K   135_B     K   135_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     A   136_B     A   136_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     E   137_B     E   137_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     E   138_B     E   138_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     L   139_B     L   139_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     V   140_B     V   140_B     87  120  281     39   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     K   141_B     K   141_B     87  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     E   142_B     E   142_B     87  120  281     37   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     K   143_B     K   143_B     85  120  281      3   43   85  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G   144_B     G   144_B     83  120  281      3   20   72  110  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     Y   145_B     Y   145_B     83  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     F   146_B     F   146_B     83  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     M   147_B     M   147_B     83  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     P   148_B     P   148_B     83  120  281     44   68   89  118  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     M   149_B     M   149_B     78  120  281      3    6   63   99  147  180  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     Q   150_B     Q   150_B     69  120  281      6   58   82  106  147  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     F   151_B     F   151_B      6  120  281      3    6   27   80  140  179  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     D   152_B     D   152_B      6  120  281      6   28   42   66   84  159  203  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     N   153_B     N   153_B      6  120  281      4    6   31   53   73   96  134  149  193  218  246  251  257  261  267  271  273  275  275  276 
LCS_GDT     P   154_B     P   154_B      6  118  281      4   12   29   46   60   89  109  135  163  212  235  249  257  261  267  271  273  275  275  276 
LCS_GDT     A   155_B     A   155_B      6  109  281      4    6    6    7    9   13   16   58   76   88  106  125  156  189  220  251  260  269  273  276 
LCS_GDT     H   160_B     H   160_B      4   19  281      3    4    5    7   15   20   24   28   34   44   54   96  111  165  241  259  264  270  273  276 
LCS_GDT     E   161_B     E   161_B      4   19  281      3    4    9   16   22   48   98  130  174  211  234  248  254  261  267  271  273  275  275  276 
LCS_GDT     E   162_B     E   162_B     14   19  281      3    9   17   41   69   98  112  135  189  227  243  251  257  261  267  271  273  275  275  276 
LCS_GDT     T   163_B     T   163_B     14   19  281      8   11   14   16   34   53   78  111  161  195  217  244  253  260  267  271  273  275  275  276 
LCS_GDT     T   164_B     T   164_B     14   19  281      8   12   14   16   21   27   40   66  105  169  205  230  249  257  267  271  273  275  275  276 
LCS_GDT     G   165_B     G   165_B     14   19  281      8   12   14   21   37   59  105  160  204  224  243  251  257  261  267  271  273  275  275  276 
LCS_GDT     K   166_B     K   166_B     14   47  281      8   12   14   40   53   99  134  176  211  236  245  252  257  261  267  271  273  275  275  276 
LCS_GDT     E   167_B     E   167_B     14   47  281      8   12   19   42   55   75   96  141  150  164  201  233  251  260  267  271  273  275  275  276 
LCS_GDT     I   168_B     I   168_B     14   47  281      8   12   14   23   46   75   99  131  150  159  187  231  250  260  267  271  273  275  275  276 
LCS_GDT     L   169_B     L   169_B     14   47  281      8   16   34   87  122  136  139  145  161  208  231  251  257  261  267  271  273  275  275  276 
LCS_GDT     E   170_B     E   170_B     14   47  281      8   15   33   67  105  132  139  141  150  156  175  218  243  259  267  271  273  275  275  276 
LCS_GDT     A   171_B     A   171_B     14   47  281      7   12   15   37   63   94  119  137  146  149  159  170  188  213  248  263  271  275  275  276 
LCS_GDT     F   172_B     F   172_B     14   47  281      7   12   21   44   75  106  128  141  147  154  168  197  240  255  267  271  273  275  275  276 
LCS_GDT     G   173_B     G   173_B     14   47  281      7   12   15   25   54   86  118  138  146  149  156  168  188  240  252  265  271  275  275  276 
LCS_GDT     D   174_B     D   174_B     14   47  281      7   12   27   63   96  118  137  141  147  156  173  243  252  259  267  271  273  275  275  276 
LCS_GDT     D   175_B     D   175_B     14   47  281      7   12   17   50   90  117  137  141  147  156  183  243  252  259  267  271  273  275  275  276 
LCS_GDT     I   176_B     I   176_B     37   47  281      3    9   23   87  125  136  141  176  217  244  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     P   177_B     P   177_B     37   47  281      4   85  112  124  130  175  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     D   178_B     D   178_B     37   47  281     64   93  112  124  145  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     A   179_B     A   179_B     37   47  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     F   180_B     F   180_B     37   47  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     V   181_B     V   181_B     37   47  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     A   182_B     A   182_B     37   47  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G   183_B     G   183_B     37   47  281     22   86  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     V   184_B     V   184_B     37   47  281     21   69  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G   185_B     G   185_B     37   47  281     12   59  104  122  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     T   186_B     T   186_B     37   47  281      7   24   63  105  128  136  159  221  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G   187_B     G   187_B     37   47  281      9   47  105  124  134  181  210  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G   188_B     G   188_B     37   47  281      7   36   76   99  127  151  201  230  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     T   189_B     T   189_B     37   47  281      7   29   63  104  133  175  208  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     L   190_B     L   190_B     37   47  281     16   82  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     T   191_B     T   191_B     37   47  281     34   67  110  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G   192_B     G   192_B     37   47  281     13   63  108  124  145  182  210  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     V   193_B     V   193_B     37   47  281     16   90  112  124  145  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G   194_B     G   194_B     37   47  281     16   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     H   195_B     H   195_B     37   47  281     16   80  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     A   196_B     A   196_B     37   47  281     33   93  112  124  145  182  210  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     L   197_B     L   197_B     37   47  281     33   93  112  124  145  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     K   198_B     K   198_B     37   47  281     24   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     K   199_B     K   199_B     37   47  281     13   84  112  124  145  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     A   200_B     A   200_B     37   90  281     23   76  111  124  143  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     N   201_B     N   201_B     37   90  281     29   86  112  124  145  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     P   202_B     P   202_B     37   90  281     29   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     N   203_B     N   203_B     37   90  281     36   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     V   204_B     V   204_B     37   90  281     53   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     Q   205_B     Q   205_B     37   90  281     55   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     I   206_B     I   206_B     37   90  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     Y   207_B     Y   207_B     37   90  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     A   208_B     A   208_B     37   90  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     L   209_B     L   209_B     37   90  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     E   210_B     E   210_B     37   90  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     P   211_B     P   211_B     37   90  281     52   87  112  124  142  179  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     A   212_B     A   212_B     37   90  281     31   84  112  124  142  173  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     P   236_B     P   236_B      3   90  281      0    3    3    7   10   25   34   53   89  133  147  151  158  168  178  193  214  246  269  275 
LCS_GDT     K   237_B     K   237_B      3   90  281      1    3    3    4    7    8   41   56   70   84  146  154  163  165  184  201  229  249  269  275 
LCS_GDT     V   238_B     V   238_B      5   90  281      3    5    8   12   17   24   41   56   69   84  114  153  158  163  178  198  214  246  256  275 
LCS_GDT     L   239_B     L   239_B      6   90  281      4    7   17   65   94  125  139  141  153  166  203  234  245  261  267  271  273  275  275  276 
LCS_GDT     D   240_B     D   240_B     69   90  281      4   14   69  106  126  136  139  170  197  223  246  251  257  261  267  271  273  275  275  276 
LCS_GDT     T   241_B     T   241_B     72   90  281     17   55  104  124  133  173  208  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     D   242_B     D   242_B     72   90  281     39   93  112  124  145  182  210  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     V   243_B     V   243_B     72   90  281     27   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     Y   244_B     Y   244_B     72   90  281     41   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     N   245_B     N   245_B     72   90  281     27   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G   246_B     G   246_B     72   90  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     I   247_B     I   247_B     72   90  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     L   248_B     L   248_B     72   90  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     E   249_B     E   249_B     72   90  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     I   250_B     I   250_B     72   90  281     64   93  112  124  142  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     K   251_B     K   251_B     72   90  281     64   93  112  124  137  170  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     S   252_B     S   252_B     72   90  281     64   93  112  124  130  170  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     D   253_B     D   253_B     72   90  281     64   93  112  124  130  170  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     D   254_B     D   254_B     72   90  281     64   93  112  124  137  175  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     A   255_B     A   255_B     72   90  281     64   93  112  124  142  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     I   256_B     I   256_B     72   90  281     64   93  112  124  130  170  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     T   257_B     T   257_B     72   90  281     64   93  112  124  130  170  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     M   258_B     M   258_B     72   90  281     64   93  112  124  142  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     A   259_B     A   259_B     72   90  281     64   93  112  124  142  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     R   260_B     R   260_B     72   90  281     64   93  112  124  137  172  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     E   261_B     E   261_B     72   90  281     64   93  112  124  142  180  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     V   262_B     V   262_B     72   90  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G   263_B     G   263_B     72   90  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     H   264_B     H   264_B     72   90  281     64   93  112  124  142  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     Q   265_B     Q   265_B     72   90  281     64   93  112  124  145  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     E   266_B     E   266_B     72   90  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G   267_B     G   267_B     72   90  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     I   268_B     I   268_B     72   90  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     L   269_B     L   269_B     72   90  281     64   93  112  124  144  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     V   270_B     V   270_B     72   90  281     11   93  112  124  139  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G   271_B     G   271_B     72   90  281     24   93  112  124  130  173  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     I   272_B     I   272_B     72   90  281     64   93  112  124  130  173  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     S   273_B     S   273_B     72   90  281     64   93  112  124  142  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     A   274_B     A   274_B     72   90  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G   275_B     G   275_B     72   90  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     A   276_B     A   276_B     72   90  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     N   277_B     N   277_B     72   90  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     I   278_B     I   278_B     72   90  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     K   279_B     K   279_B     72   90  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G   280_B     G   280_B     72   90  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     A   281_B     A   281_B     72   90  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     I   282_B     I   282_B     72   90  281     63   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     E   283_B     E   283_B     72   90  281     63   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     V   284_B     V   284_B     72   90  281     63   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     A   285_B     A   285_B     72   90  281     56   93  112  124  144  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     K   286_B     K   286_B     72   90  281     63   93  112  124  139  178  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     K   287_B     K   287_B     72   90  281     45   89  112  124  136  178  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     L   288_B     L   288_B     72   90  281     37   93  112  124  130  178  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G   289_B     G   289_B     72   90  281      7   29   65  103  128  168  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     K   290_B     K   290_B     72   90  281     16   67  110  124  130  167  211  232  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G   291_B     G   291_B     72   90  281     42   93  112  124  130  167  211  232  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     K   292_B     K   292_B     72   90  281     49   93  112  124  136  178  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     Q   293_B     Q   293_B     72   90  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     V   294_B     V   294_B     72   90  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     I   295_B     I   295_B     72   90  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     T   296_B     T   296_B     72   90  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     V   297_B     V   297_B     72   90  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     A   298_B     A   298_B     72   90  281     64   93  112  124  149  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     P   299_B     P   299_B     72   90  281     64   93  112  124  144  182  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     D   300_B     D   300_B     72   90  281     14   82  110  124  130  162  199  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G   301_B     G   301_B     72   90  281     14   90  112  124  130  167  210  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     G   302_B     G   302_B     72   90  281     45   93  112  124  130  167  199  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     D   303_B     D   303_B     72   90  281     48   93  112  124  130  167  211  233  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     R   304_B     R   304_B     72   90  281     12   89  112  124  130  139  196  228  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     Y   305_B     Y   305_B     72   90  281     18   93  112  124  130  139  159  228  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     L   306_B     L   306_B     72   90  281     42   93  112  124  130  139  194  228  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     S   307_B     S   307_B     72   90  281     12   67  107  122  130  136  143  158  196  242  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     T   308_B     T   308_B     72   90  281     10   31  100  119  130  136  141  154  167  218  246  254  257  261  267  271  273  275  275  276 
LCS_GDT     E   309_B     E   309_B     72   90  281     10   34   92  118  130  136  139  151  163  193  232  254  257  261  267  271  273  275  275  276 
LCS_GDT     L   310_B     L   310_B     72   90  281     10   44  101  120  130  136  150  185  207  242  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     F   311_B     F   311_B     72   90  281      7   68  102  124  130  142  184  218  240  246  251  254  257  261  267  271  273  275  275  276 
LCS_GDT     N   312_B     N   312_B     72   90  281     10   45  101  120  130  136  145  162  207  219  247  254  257  261  267  271  273  275  275  276 
LCS_GDT     Y   313_B     Y   313_B     14   77  281      3    3    4   34   51   93  129  151  166  178  213  237  249  261  267  271  273  275  275  276 
LCS_AVERAGE  LCS_A:  50.85  (  20.38   32.17  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     64     93    112    124    149    182    211    233    240    246    251    254    257    261    267    271    273    275    275    276 
GDT PERCENT_AT  22.78  33.10  39.86  44.13  53.02  64.77  75.09  82.92  85.41  87.54  89.32  90.39  91.46  92.88  95.02  96.44  97.15  97.86  97.86  98.22
GDT RMS_LOCAL    0.29   0.56   0.75   0.92   1.70   1.97   2.25   2.42   2.51   2.61   2.72   2.82   2.92   3.03   3.29   3.42   3.46   3.56   3.56   3.59
GDT RMS_ALL_AT   6.29   6.39   6.11   6.09   4.08   4.05   4.05   4.04   4.03   4.04   4.04   4.03   4.00   3.99   3.97   3.97   3.97   3.97   3.97   3.97

# 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:  E   119_B      E   119_B
#   possible swapping detected:  F   151_B      F   151_B
#   possible swapping detected:  E   161_B      E   161_B
#   possible swapping detected:  F   172_B      F   172_B
#   possible swapping detected:  D   174_B      D   174_B
#   possible swapping detected:  D   240_B      D   240_B
#   possible swapping detected:  D   242_B      D   242_B
#   possible swapping detected:  E   249_B      E   249_B
#   possible swapping detected:  D   253_B      D   253_B
#   possible swapping detected:  E   266_B      E   266_B
#   possible swapping detected:  D   300_B      D   300_B
#   possible swapping detected:  D   303_B      D   303_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     8.261     0    0.636   0.818    11.664   10.952    5.095
LGA    H     7_B      H     7_B     5.103     0    0.070   1.224     7.257   23.810   20.952
LGA    T     8_B      T     8_B     6.841     0    0.402   0.442     9.288   15.357   10.068
LGA    K     9_B      K     9_B     6.325     4    0.165   0.168     6.781   22.976   11.693
LGA    I    10_B      I    10_B     4.333     0    0.041   0.592     6.747   32.976   30.655
LGA    T    11_B      T    11_B     2.824     0    0.024   1.110     4.011   53.571   54.490
LGA    N    12_B      N    12_B     2.864     0    0.064   0.530     5.198   59.048   50.714
LGA    S    13_B      S    13_B     2.201     0    0.115   0.161     2.497   68.810   68.810
LGA    I    14_B      I    14_B     1.064     0    0.044   0.139     1.523   83.810   87.202
LGA    V    15_B      V    15_B     0.459     0    0.064   1.399     3.294   90.595   81.361
LGA    N    16_B      N    16_B     1.910     0    0.044   1.231     3.063   70.952   67.024
LGA    L    17_B      L    17_B     2.183     0    0.092   0.179     2.561   64.881   64.881
LGA    I    18_B      I    18_B     2.261     0    0.043   0.076     2.961   62.976   67.024
LGA    G    19_B      G    19_B     3.887     0    0.690   0.690     4.569   42.024   42.024
LGA    N    20_B      N    20_B     3.926     0    0.105   0.164     4.765   43.452   41.131
LGA    T    21_B      T    21_B     3.350     0    0.022   0.970     6.239   48.333   42.449
LGA    P    22_B      P    22_B     2.223     0    0.569   0.790     4.834   52.619   60.136
LGA    I    23_B      I    23_B     1.837     0    0.056   0.287     3.398   72.857   67.024
LGA    V    24_B      V    24_B     1.321     0    0.073   1.007     3.136   81.429   78.231
LGA    K    25_B      K    25_B     1.456     0    0.032   0.171     2.095   79.286   73.915
LGA    L    26_B      L    26_B     1.271     0    0.037   0.107     1.481   81.429   81.429
LGA    N    27_B      N    27_B     2.090     0    0.086   0.197     2.667   64.881   64.821
LGA    R    28_B      R    28_B     2.398     0    0.123   0.537     3.613   59.167   54.675
LGA    V    29_B      V    29_B     2.219     0    0.046   1.191     3.521   64.762   60.748
LGA    V    30_B      V    30_B     2.394     0    0.124   1.428     3.733   60.952   57.415
LGA    P    31_B      P    31_B     4.090     0    0.435   0.598     6.690   32.976   41.429
LGA    E    32_B      E    32_B     4.829     4    0.117   0.154     5.606   31.548   16.402
LGA    D    33_B      D    33_B     4.001     0    0.135   0.897     4.506   47.143   42.202
LGA    A    34_B      A    34_B     3.599     0    0.676   0.655     5.520   55.595   48.762
LGA    A    35_B      A    35_B     3.114     0    0.064   0.077     3.939   53.571   51.524
LGA    D    36_B      D    36_B     1.889     0    0.081   0.143     2.429   70.833   69.821
LGA    V    37_B      V    37_B     1.248     0    0.053   0.835     3.237   79.286   74.490
LGA    Y    38_B      Y    38_B     1.332     0    0.043   0.208     2.845   81.429   70.437
LGA    V    39_B      V    39_B     1.096     0    0.033   0.896     2.483   81.429   79.116
LGA    K    40_B      K    40_B     1.844     0    0.028   0.205     4.162   75.000   60.635
LGA    L    41_B      L    41_B     1.949     0    0.068   0.134     2.811   66.905   69.940
LGA    E    42_B      E    42_B     2.406     0    0.124   0.977     5.615   60.952   52.169
LGA    F    43_B      F    43_B     3.095     0    0.024   0.371     4.205   48.452   49.784
LGA    F    44_B      F    44_B     3.986     0    0.220   1.794     9.691   34.881   23.030
LGA    N    45_B      N    45_B     4.096     0    0.110   1.337     5.321   41.905   39.702
LGA    P    46_B      P    46_B     5.477     0    0.020   0.217     7.371   29.048   21.905
LGA    G    47_B      G    47_B     2.533     0    0.135   0.135     5.603   48.690   48.690
LGA    G    48_B      G    48_B     4.221     0    0.068   0.068     5.760   36.429   36.429
LGA    S    49_B      S    49_B     3.463     0    0.041   0.096     3.482   50.000   50.000
LGA    I    50_B      I    50_B     3.515     0    0.149   0.771     4.915   48.452   43.631
LGA    K    51_B      K    51_B     3.471     2    0.173   0.824     3.928   48.333   39.048
LGA    D    52_B      D    52_B     2.602     0    0.047   0.304     4.349   65.000   54.345
LGA    R    53_B      R    53_B     0.881     0    0.071   0.923     7.299   83.690   52.165
LGA    I    54_B      I    54_B     2.497     0    0.046   1.358     5.234   60.952   49.583
LGA    A    55_B      A    55_B     2.761     0    0.048   0.079     3.201   60.952   58.762
LGA    L    56_B      L    56_B     1.473     0    0.033   0.104     1.850   79.286   83.750
LGA    A    57_B      A    57_B     1.495     0    0.076   0.082     1.630   79.286   78.000
LGA    M    58_B      M    58_B     1.987     0    0.033   0.166     2.810   72.857   65.952
LGA    I    59_B      I    59_B     1.476     0    0.010   0.150     2.206   79.286   76.131
LGA    E    60_B      E    60_B     1.322     0    0.018   0.319     1.430   81.429   87.566
LGA    E    61_B      E    61_B     1.363     0    0.033   0.956     3.105   81.429   71.640
LGA    A    62_B      A    62_B     1.109     0    0.034   0.036     1.224   81.429   81.429
LGA    E    63_B      E    63_B     1.200     0    0.055   0.223     1.808   81.429   78.571
LGA    K    64_B      K    64_B     1.322     4    0.091   0.092     1.322   81.429   45.238
LGA    A    65_B      A    65_B     1.002     0    0.080   0.092     1.275   85.952   85.048
LGA    G    66_B      G    66_B     0.805     0    0.175   0.175     1.003   88.214   88.214
LGA    K    67_B      K    67_B     0.842     4    0.033   0.070     1.312   90.476   49.259
LGA    L    68_B      L    68_B     0.795     0    0.027   1.336     2.716   85.952   79.702
LGA    Q    69_B      Q    69_B     1.885     4    0.024   0.043     2.131   72.976   39.630
LGA    A    70_B      A    70_B     2.842     0    0.686   0.649     3.303   57.262   55.810
LGA    G    71_B      G    71_B     3.956     0    0.093   0.093     4.296   43.452   43.452
LGA    G    72_B      G    72_B     2.573     0    0.074   0.074     2.922   60.952   60.952
LGA    T    73_B      T    73_B     1.725     0    0.037   0.125     2.299   70.833   70.544
LGA    I    74_B      I    74_B     0.900     0    0.053   0.561     2.114   88.214   85.000
LGA    V    75_B      V    75_B     1.077     0    0.018   0.073     1.471   88.214   85.306
LGA    E    76_B      E    76_B     0.963     0    0.082   0.185     1.128   85.952   88.466
LGA    P    77_B      P    77_B     1.572     0    0.134   0.144     2.105   75.000   74.150
LGA    T    78_B      T    78_B     1.591     0    0.151   0.381     2.217   72.857   72.925
LGA    S    79_B      S    79_B     1.684     0    0.663   0.595     3.360   69.286   67.778
LGA    G    80_B      G    80_B     1.500     0    0.143   0.143     1.500   79.286   79.286
LGA    N    81_B      N    81_B     1.887     3    0.101   0.116     2.627   72.857   43.571
LGA    T    82_B      T    82_B     2.151     0    0.075   0.124     2.887   70.833   64.966
LGA    G    83_B      G    83_B     1.060     0    0.034   0.034     1.314   83.690   83.690
LGA    V    84_B      V    84_B     1.286     0    0.031   1.371     4.007   81.429   72.653
LGA    G    85_B      G    85_B     1.927     0    0.048   0.048     2.019   70.833   70.833
LGA    L    86_B      L    86_B     1.735     0    0.037   1.305     2.642   72.857   73.274
LGA    A    87_B      A    87_B     1.255     0    0.052   0.055     1.428   81.429   83.238
LGA    M    88_B      M    88_B     1.769     0    0.084   0.915     2.005   72.857   72.917
LGA    V    89_B      V    89_B     2.322     0    0.070   0.119     2.639   64.762   62.585
LGA    A    90_B      A    90_B     1.908     0    0.083   0.080     2.315   70.833   71.238
LGA    A    91_B      A    91_B     1.675     0    0.030   0.046     2.419   68.810   71.333
LGA    A    92_B      A    92_B     2.947     0    0.040   0.041     3.458   55.476   54.381
LGA    K    93_B      K    93_B     2.921     0    0.044   0.720     3.087   55.357   59.894
LGA    G    94_B      G    94_B     2.624     0    0.177   0.177     2.626   60.952   60.952
LGA    Y    95_B      Y    95_B     1.547     0    0.038   0.093     1.872   75.000   75.000
LGA    H    96_B      H    96_B     1.298     0    0.040   0.487     2.385   79.286   79.857
LGA    L    97_B      L    97_B     0.678     0    0.039   0.156     0.878   90.476   92.857
LGA    V    98_B      V    98_B     0.985     0    0.033   1.378     3.780   90.476   81.156
LGA    I    99_B      I    99_B     0.951     0    0.022   0.181     1.503   83.810   86.012
LGA    T   100_B      T   100_B     1.718     0    0.023   0.074     2.053   72.857   71.701
LGA    M   101_B      M   101_B     2.041     0    0.031   0.557     2.316   66.786   66.786
LGA    P   102_B      P   102_B     2.255     0    0.025   0.204     2.683   64.762   63.673
LGA    E   103_B      E   103_B     2.002     0    0.009   0.360     2.901   66.786   65.714
LGA    T   104_B      T   104_B     2.596     0    0.043   0.957     5.131   59.048   53.810
LGA    M   105_B      M   105_B     2.980     0    0.084   1.164     3.707   51.905   53.988
LGA    S   106_B      S   106_B     3.573     0    0.444   0.723     5.887   53.810   43.810
LGA    V   107_B      V   107_B     3.158     0    0.644   1.441     7.006   48.571   42.653
LGA    E   108_B      E   108_B     2.888     0    0.046   1.329     5.331   61.190   48.095
LGA    R   109_B      R   109_B     0.946     4    0.051   0.568     2.047   88.214   55.281
LGA    R   110_B      R   110_B     1.167     0    0.086   0.953     2.733   83.690   74.069
LGA    K   111_B      K   111_B     1.189     0    0.041   0.816     6.741   85.952   57.302
LGA    L   112_B      L   112_B     0.848     0    0.064   1.268     3.225   90.476   76.190
LGA    M   113_B      M   113_B     0.674     0    0.017   0.308     1.518   90.476   88.274
LGA    Q   114_B      Q   114_B     0.651     0    0.029   1.040     3.674   90.476   83.228
LGA    G   115_B      G   115_B     0.742     0    0.061   0.061     1.018   88.214   88.214
LGA    Y   116_B      Y   116_B     0.723     0    0.038   0.601     1.838   90.476   83.810
LGA    G   117_B      G   117_B     0.600     0    0.053   0.053     0.903   90.476   90.476
LGA    A   118_B      A   118_B     0.473     0    0.024   0.031     0.565   92.857   94.286
LGA    E   119_B      E   119_B     0.967     0    0.048   0.600     2.445   88.214   79.735
LGA    L   120_B      L   120_B     1.047     0    0.422   0.929     3.727   69.762   80.179
LGA    I   121_B      I   121_B     1.493     1    0.023   0.081     1.730   77.143   65.893
LGA    L   122_B      L   122_B     1.761     0    0.071   0.120     2.130   68.810   70.833
LGA    T   123_B      T   123_B     2.552     0    0.029   0.112     2.920   59.048   58.231
LGA    P   124_B      P   124_B     3.119     0    0.623   0.684     4.548   45.357   45.442
LGA    G   125_B      G   125_B     3.486     0    0.216   0.216     4.005   45.119   45.119
LGA    A   126_B      A   126_B     4.931     0    0.060   0.066     5.422   32.857   31.524
LGA    D   127_B      D   127_B     3.780     0    0.067   0.541     5.261   45.119   42.143
LGA    G   128_B      G   128_B     3.334     0    0.045   0.045     3.488   51.786   51.786
LGA    M   129_B      M   129_B     2.901     0    0.058   0.502     3.614   53.571   52.738
LGA    K   130_B      K   130_B     3.354     4    0.828   0.812     6.299   38.571   22.698
LGA    G   131_B      G   131_B     3.276     0    0.124   0.124     3.276   53.571   53.571
LGA    A   132_B      A   132_B     2.343     0    0.029   0.041     2.748   62.857   63.238
LGA    I   133_B      I   133_B     2.240     0    0.100   0.660     3.070   64.762   62.917
LGA    A   134_B      A   134_B     2.943     0    0.032   0.044     3.229   57.143   55.714
LGA    K   135_B      K   135_B     2.657     0    0.029   0.583     3.096   57.143   59.894
LGA    A   136_B      A   136_B     2.063     0    0.038   0.043     2.286   64.762   66.381
LGA    E   137_B      E   137_B     2.155     2    0.061   0.134     2.415   64.762   52.169
LGA    E   138_B      E   138_B     2.668     0    0.039   0.829     5.841   57.143   46.878
LGA    L   139_B      L   139_B     2.539     0    0.035   0.122     2.901   57.143   58.095
LGA    V   140_B      V   140_B     2.277     0    0.190   0.252     2.393   64.762   65.918
LGA    K   141_B      K   141_B     2.483     4    0.125   0.129     2.884   60.952   33.439
LGA    E   142_B      E   142_B     2.158     4    0.101   0.128     2.523   62.857   36.032
LGA    K   143_B      K   143_B     1.777     4    0.543   0.555     3.414   69.286   38.889
LGA    G   144_B      G   144_B     1.614     0    0.057   0.057     1.896   77.143   77.143
LGA    Y   145_B      Y   145_B     1.241     0    0.224   0.377     3.967   83.690   66.230
LGA    F   146_B      F   146_B     1.302     0    0.060   0.132     1.367   81.429   84.719
LGA    M   147_B      M   147_B     1.060     0    0.020   0.263     1.424   81.429   81.429
LGA    P   148_B      P   148_B     1.144     0    0.620   0.726     2.272   77.262   81.633
LGA    M   149_B      M   149_B     3.148     3    0.340   0.371     3.583   59.405   35.119
LGA    Q   150_B      Q   150_B     2.980     4    0.688   0.636     4.808   50.357   25.873
LGA    F   151_B      F   151_B     3.108     0    0.147   1.237    11.686   59.167   25.628
LGA    D   152_B      D   152_B     4.046     3    0.195   0.205     5.935   36.786   21.071
LGA    N   153_B      N   153_B     7.109     3    0.078   0.124     8.126   16.667    8.929
LGA    P   154_B      P   154_B     8.032     0    0.235   0.266     9.748    4.048    2.789
LGA    A   155_B      A   155_B    12.497     0    0.607   0.610    14.395    0.000    0.000
LGA    H   160_B      H   160_B    12.229     5    0.642   0.616    13.121    0.000    0.000
LGA    E   161_B      E   161_B     8.053     0    0.068   0.690     9.384    7.381    8.995
LGA    E   162_B      E   162_B     7.145     0    0.202   1.105     8.775   10.119    8.307
LGA    T   163_B      T   163_B     8.791     0    0.155   1.149    10.512    3.333    2.993
LGA    T   164_B      T   164_B     9.635     0    0.050   0.190    10.468    1.548    0.952
LGA    G   165_B      G   165_B     7.268     0    0.044   0.044     7.989    9.286    9.286
LGA    K   166_B      K   166_B     6.939     4    0.059   0.092     7.725   10.238    6.032
LGA    E   167_B      E   167_B     9.357     0    0.027   0.870    10.091    1.667    1.217
LGA    I   168_B      I   168_B     9.225     0    0.028   0.098     9.706    1.786    1.726
LGA    L   169_B      L   169_B     7.788     0    0.041   0.815     8.838    4.405    9.405
LGA    E   170_B      E   170_B     9.683     0    0.036   0.543    11.889    0.833    0.423
LGA    A   171_B      A   171_B    11.009     0    0.052   0.049    11.443    0.000    0.000
LGA    F   172_B      F   172_B     9.575     0    0.031   0.309     9.875    0.476    2.338
LGA    G   173_B      G   173_B    10.758     0    0.125   0.125    10.863    0.000    0.000
LGA    D   174_B      D   174_B     9.095     0    0.025   1.067    14.083    1.905    1.012
LGA    D   175_B      D   175_B     8.722     0    0.185   0.812     9.224    3.929    3.274
LGA    I   176_B      I   176_B     6.005     0    0.196   0.564     6.633   19.524   21.131
LGA    P   177_B      P   177_B     3.518     0    0.290   0.650     5.599   47.262   41.973
LGA    D   178_B      D   178_B     2.596     0    0.103   0.193     3.670   60.952   55.536
LGA    A   179_B      A   179_B     1.871     0    0.045   0.042     2.251   70.833   71.238
LGA    F   180_B      F   180_B     1.582     0    0.024   0.128     2.416   77.143   71.472
LGA    V   181_B      V   181_B     1.138     0    0.022   0.087     1.393   81.429   85.306
LGA    A   182_B      A   182_B     1.647     0    0.079   0.095     2.012   75.000   72.952
LGA    G   183_B      G   183_B     1.609     0    0.056   0.056     1.641   77.143   77.143
LGA    V   184_B      V   184_B     1.811     0    0.082   1.109     3.770   70.833   66.327
LGA    G   185_B      G   185_B     2.405     0    0.103   0.103     3.736   55.714   55.714
LGA    T   186_B      T   186_B     4.892     0    0.064   0.101     6.377   31.905   26.803
LGA    G   187_B      G   187_B     3.391     0    0.036   0.036     3.726   46.667   46.667
LGA    G   188_B      G   188_B     4.553     0    0.106   0.106     4.553   35.714   35.714
LGA    T   189_B      T   189_B     3.847     0    0.028   0.116     4.707   46.667   41.769
LGA    L   190_B      L   190_B     2.409     0    0.027   0.430     3.051   62.857   63.988
LGA    T   191_B      T   191_B     2.494     0    0.029   0.129     2.965   60.952   59.320
LGA    G   192_B      G   192_B     3.117     0    0.021   0.021     3.117   55.357   55.357
LGA    V   193_B      V   193_B     2.961     0    0.040   0.096     3.290   57.143   54.082
LGA    G   194_B      G   194_B     2.234     0    0.070   0.070     2.429   64.762   64.762
LGA    H   195_B      H   195_B     2.243     0    0.038   0.580     3.114   64.762   63.381
LGA    A   196_B      A   196_B     3.195     0    0.020   0.029     3.596   51.786   50.095
LGA    L   197_B      L   197_B     2.689     0    0.022   0.125     3.399   57.143   58.155
LGA    K   198_B      K   198_B     2.248     0    0.067   0.535     2.505   62.857   69.524
LGA    K   199_B      K   199_B     2.959     2    0.056   0.316     3.076   53.571   42.063
LGA    A   200_B      A   200_B     2.956     0    0.018   0.030     2.965   57.143   57.143
LGA    N   201_B      N   201_B     2.562     0    0.117   0.312     3.386   57.143   58.155
LGA    P   202_B      P   202_B     2.417     0    0.037   0.271     3.225   62.857   61.565
LGA    N   203_B      N   203_B     2.376     0    0.048   0.691     3.642   64.762   62.083
LGA    V   204_B      V   204_B     2.277     0    0.041   1.284     3.863   68.810   62.925
LGA    Q   205_B      Q   205_B     1.648     0    0.056   0.654     3.204   75.000   74.180
LGA    I   206_B      I   206_B     1.547     0    0.025   0.135     1.831   77.143   75.000
LGA    Y   207_B      Y   207_B     1.178     0    0.026   0.415     1.584   81.429   82.976
LGA    A   208_B      A   208_B     1.439     0    0.048   0.061     1.810   81.429   79.714
LGA    L   209_B      L   209_B     1.476     0    0.028   0.941     3.978   77.143   71.369
LGA    E   210_B      E   210_B     2.400     0    0.053   0.392     2.623   62.976   66.667
LGA    P   211_B      P   211_B     3.119     0    0.056   0.268     3.524   51.786   50.068
LGA    A   212_B      A   212_B     3.286     0    0.567   0.513     3.595   48.333   48.667
LGA    P   236_B      P   236_B    14.134     0    0.492   0.776    15.418    0.000    0.000
LGA    K   237_B      K   237_B    14.536     0    0.527   1.018    16.117    0.000    0.000
LGA    V   238_B      V   238_B    14.324     0    0.616   1.133    16.393    0.000    0.000
LGA    L   239_B      L   239_B     8.626     0    0.117   1.442    10.651    2.619    7.738
LGA    D   240_B      D   240_B     7.129     0    0.051   0.157     8.586   16.190   12.381
LGA    T   241_B      T   241_B     3.781     0    0.158   0.241     5.767   49.167   39.388
LGA    D   242_B      D   242_B     3.012     0    0.136   0.137     4.634   55.476   47.143
LGA    V   243_B      V   243_B     2.092     0    0.057   1.322     3.832   69.048   66.531
LGA    Y   244_B      Y   244_B     1.124     0    0.098   1.067     6.807   85.952   59.444
LGA    N   245_B      N   245_B     0.978     0    0.086   1.011     2.752   85.952   79.583
LGA    G   246_B      G   246_B     0.983     0    0.026   0.026     0.983   90.476   90.476
LGA    I   247_B      I   247_B     1.190     0    0.053   1.644     3.868   81.429   72.738
LGA    L   248_B      L   248_B     1.226     0    0.048   0.480     1.957   81.429   80.357
LGA    E   249_B      E   249_B     2.193     0    0.024   1.249     4.257   66.786   65.450
LGA    I   250_B      I   250_B     2.786     0    0.037   1.303     3.975   53.571   52.738
LGA    K   251_B      K   251_B     3.595     2    0.066   0.720     5.164   45.000   32.540
LGA    S   252_B      S   252_B     3.770     0    0.027   0.552     4.883   43.333   41.349
LGA    D   253_B      D   253_B     3.982     0    0.018   0.960     6.631   43.333   32.798
LGA    D   254_B      D   254_B     3.321     0    0.026   0.645     4.424   48.333   45.893
LGA    A   255_B      A   255_B     2.931     0    0.039   0.058     3.107   51.786   51.429
LGA    I   256_B      I   256_B     3.731     0    0.017   0.094     4.495   45.000   41.071
LGA    T   257_B      T   257_B     3.727     0    0.074   0.148     4.254   46.667   44.354
LGA    M   258_B      M   258_B     2.791     0    0.045   0.939     3.847   55.357   57.381
LGA    A   259_B      A   259_B     2.772     0    0.050   0.054     2.902   57.143   57.143
LGA    R   260_B      R   260_B     3.399     0    0.023   0.524     5.882   50.000   33.810
LGA    E   261_B      E   261_B     3.135     0    0.056   0.666     4.429   53.571   50.265
LGA    V   262_B      V   262_B     2.115     0    0.025   0.391     2.487   66.786   65.918
LGA    G   263_B      G   263_B     2.199     0    0.095   0.095     2.300   64.762   64.762
LGA    H   264_B      H   264_B     2.819     0    0.105   0.774     4.892   57.143   51.333
LGA    Q   265_B      Q   265_B     2.534     0    0.084   1.077     4.680   60.952   56.931
LGA    E   266_B      E   266_B     1.583     0    0.047   0.122     1.854   72.857   77.619
LGA    G   267_B      G   267_B     1.768     0    0.056   0.056     1.768   72.857   72.857
LGA    I   268_B      I   268_B     1.494     0    0.022   0.599     2.129   75.000   76.131
LGA    L   269_B      L   269_B     2.505     0    0.033   0.504     4.184   59.048   55.655
LGA    V   270_B      V   270_B     2.850     0    0.049   0.128     3.355   53.571   55.102
LGA    G   271_B      G   271_B     3.517     0    0.039   0.039     3.517   48.333   48.333
LGA    I   272_B      I   272_B     3.507     0    0.038   0.222     5.490   48.452   41.488
LGA    S   273_B      S   273_B     2.764     0    0.127   0.539     3.102   59.167   56.111
LGA    A   274_B      A   274_B     1.752     0    0.036   0.045     2.041   72.976   72.952
LGA    G   275_B      G   275_B     2.118     0    0.045   0.045     2.141   66.786   66.786
LGA    A   276_B      A   276_B     2.216     0    0.035   0.046     2.542   68.810   66.476
LGA    N   277_B      N   277_B     1.400     0    0.020   0.068     1.929   79.286   77.143
LGA    I   278_B      I   278_B     1.236     0    0.061   0.280     1.457   81.429   82.560
LGA    K   279_B      K   279_B     1.906     0    0.039   0.576     3.954   72.857   64.286
LGA    G   280_B      G   280_B     1.203     0    0.026   0.026     1.412   81.429   81.429
LGA    A   281_B      A   281_B     1.073     0    0.028   0.034     1.732   81.548   83.333
LGA    I   282_B      I   282_B     2.032     0    0.023   0.896     4.268   64.881   57.679
LGA    E   283_B      E   283_B     2.252     0    0.052   0.223     2.661   62.857   63.915
LGA    V   284_B      V   284_B     2.011     0    0.013   0.113     2.695   64.881   68.367
LGA    A   285_B      A   285_B     2.628     0    0.030   0.036     3.366   57.262   57.238
LGA    K   286_B      K   286_B     3.308     0    0.067   0.869     5.480   48.452   45.926
LGA    K   287_B      K   287_B     3.523     2    0.215   0.364     3.914   45.000   37.460
LGA    L   288_B      L   288_B     3.682     0    0.619   0.633     5.493   39.048   42.857
LGA    G   289_B      G   289_B     3.384     0    0.095   0.095     3.534   48.333   48.333
LGA    K   290_B      K   290_B     4.127     2    0.118   0.413     6.742   41.786   27.090
LGA    G   291_B      G   291_B     4.102     0    0.032   0.032     4.138   40.238   40.238
LGA    K   292_B      K   292_B     3.424     0    0.042   0.597     4.886   48.333   43.069
LGA    Q   293_B      Q   293_B     2.399     0    0.057   1.275     8.280   62.857   41.693
LGA    V   294_B      V   294_B     1.656     0    0.039   0.808     3.490   75.000   72.041
LGA    I   295_B      I   295_B     1.584     0    0.041   1.169     4.360   77.143   63.810
LGA    T   296_B      T   296_B     1.116     0    0.120   0.248     1.232   81.429   85.306
LGA    V   297_B      V   297_B     1.928     0    0.040   0.335     2.941   72.857   68.299
LGA    A   298_B      A   298_B     2.059     0    0.068   0.066     2.659   62.857   63.238
LGA    P   299_B      P   299_B     2.795     0    0.045   0.199     3.881   53.810   56.327
LGA    D   300_B      D   300_B     4.166     0    0.097   0.220     6.501   45.119   35.417
LGA    G   301_B      G   301_B     3.744     0    0.044   0.044     4.371   41.786   41.786
LGA    G   302_B      G   302_B     4.064     0    0.103   0.103     4.310   38.690   38.690
LGA    D   303_B      D   303_B     3.704     0    0.181   0.935     5.340   37.262   40.655
LGA    R   304_B      R   304_B     4.993     6    0.106   0.106     5.612   27.619   12.424
LGA    Y   305_B      Y   305_B     5.376     0    0.063   0.193     5.744   23.810   26.270
LGA    L   306_B      L   306_B     5.127     0    0.048   0.216     5.923   23.810   29.762
LGA    S   307_B      S   307_B     7.173     0    0.085   0.649     8.297    8.810    8.254
LGA    T   308_B      T   308_B     7.655     0    0.055   0.137     7.655    8.571    9.660
LGA    E   309_B      E   309_B     8.044     3    0.062   0.676     9.736    7.262    3.598
LGA    L   310_B      L   310_B     6.385     0    0.031   0.100     7.007   16.429   20.774
LGA    F   311_B      F   311_B     4.886     0    0.427   0.858     5.330   33.095   42.771
LGA    N   312_B      N   312_B     7.295     0    0.247   1.069    12.699   13.690    7.024
LGA    Y   313_B      Y   313_B     8.837     0    0.392   1.265     9.567    3.214   15.159

# 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):     3.965          3.947                  4.225           56.889   53.184

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  313  281    4.0    233    2.42    64.146    59.086     9.243

LGA_LOCAL      RMSD:   2.421  Number of atoms:  233  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   4.042  Number of assigned atoms:  281 
Std_ASGN_ATOMS RMSD:   3.965  Standard rmsd on all 281 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.600209 * X  +   0.734836 * Y  +   0.315857 * Z  +  46.013653
  Y_new =   0.746577 * X  +   0.373004 * Y  +   0.550900 * Z  +   2.530741
  Z_new =   0.287005 * X  +   0.566466 * Y  +  -0.772492 * Z  +  16.745619 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  2.247940 -0.291099  2.508867   [DEG:  128.7975  -16.6788  143.7475 ]
ZXZ:  2.621002  2.453552  0.468961   [DEG:  150.1723  140.5782   26.8695 ]
 
# END of job
