
#######################################################
#                                                     #
#                        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  222 ( 1776),  selected  221 , name one
# Molecule2: number of CA atoms  260 ( 2069),  selected  221 , 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:   147      19_B - 165_B       4.81     7.59
  LCS_AVERAGE:     45.76

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    92      46_B - 137_B       1.96     7.95
  LONGEST_CONTINUOUS_SEGMENT:    92      47_B - 138_B       1.96     7.95
  LCS_AVERAGE:     22.58

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    62      47_B - 108_B       0.95     8.29
  LCS_AVERAGE:     10.96

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  221
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     D    19_B     D    19_B      4    4  147      0    4    4    5   12   16   24   31   37   45   64   73  101  120  131  150  160  192  196  197 
LCS_GDT     F    20_B     F    20_B      4    4  147      3    4    4    5    5    9   15   54   62   80  103  129  145  190  191  192  193  195  199  201 
LCS_GDT     D    21_B     D    21_B      4    5  147      3    4    4    5    6    9   10   54   62   67  107  129  183  190  191  192  193  196  200  202 
LCS_GDT     R    22_B     R    22_B      4    5  147      3    4    4    5    6    9   10   60   71   91  136  165  183  190  191  194  195  198  200  202 
LCS_GDT     G    23_B     G    23_B      3    5  147      3    3    3   49   59   74  117  143  174  182  184  188  192  193  194  196  200  202  202  202 
LCS_GDT     S    24_B     S    24_B      3   18  147      3   11   41   83  121  144  161  172  179  183  186  188  192  193  194  196  200  202  202  202 
LCS_GDT     N    25_B     N    25_B     16   85  147     17   67  112  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     Y    26_B     Y    26_B     16   85  147     15   67  112  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     E    27_B     E    27_B     16   85  147     15   67  112  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     N    28_B     N    28_B     16   85  147     15   67  112  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     V    29_B     V    29_B     16   85  147     15   67  112  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     L    30_B     L    30_B     16   85  147     21   67  115  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     H    31_B     H    31_B     16   85  147     20   67  115  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     L    32_B     L    32_B     16   85  147     16   67  112  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     T    33_B     T    33_B     16   85  147     13   66  112  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     D    34_B     D    34_B     16   85  147     15   67  115  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     A    35_B     A    35_B     16   85  147     21   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     L    36_B     L    36_B     16   85  147     24   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     G    37_B     G    37_B     16   85  147     10   63  111  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     A    38_B     A    38_B     16   85  147     21   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     L    39_B     L    39_B     16   85  147     14   67  112  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     V    40_B     V    40_B     16   85  147     12   56  112  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     P    41_B     P    41_B      5   85  147      3    4   14   19   87  124  142  163  172  180  184  187  188  192  194  197  200  202  202  202 
LCS_GDT     E    42_B     E    42_B      5   85  147      3    4   15   20   29   41   64   91  112  157  171  178  184  190  193  197  200  202  202  202 
LCS_GDT     S    43_B     S    43_B      5   85  147      3    4   18   23   36   49   62   91  145  168  179  183  187  190  193  197  200  202  202  202 
LCS_GDT     E    44_B     E    44_B      4   85  147      3    3    4    7   13   20  113  147  158  177  182  185  188  192  194  197  200  202  202  202 
LCS_GDT     T    45_B     T    45_B      4   85  147      3    3    4    4    5    7   17   64  139  172  179  184  187  191  194  196  200  202  202  202 
LCS_GDT     E    46_B     E    46_B      4   92  147      3    5   34   88  125  156  168  173  177  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     H    47_B     H    47_B     62   92  147      8   59  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     P    48_B     P    48_B     62   92  147     15   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     D    49_B     D    49_B     62   92  147     24   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     Q    50_B     Q    50_B     62   92  147     21   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     R    51_B     R    51_B     62   92  147     24   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     F    52_B     F    52_B     62   92  147     16   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     F    53_B     F    53_B     62   92  147     19   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     Q    54_B     Q    54_B     62   92  147     24   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     V    55_B     V    55_B     62   92  147     24   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     T    56_B     T    56_B     62   92  147     20   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     H    57_B     H    57_B     62   92  147     22   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     L    58_B     L    58_B     62   92  147     24   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     I    59_B     I    59_B     62   92  147     24   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     T    60_B     T    60_B     62   92  147     24   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     E    61_B     E    61_B     62   92  147     24   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     Y    62_B     Y    62_B     62   92  147     24   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     A    63_B     A    63_B     62   92  147     19   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     W    64_B     W    64_B     62   92  147     19   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     V    65_B     V    65_B     62   92  147     19   67  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     Q    66_B     Q    66_B     62   92  147     19   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     V    67_B     V    67_B     62   92  147     24   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     H    68_B     H    68_B     62   92  147     24   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     Y    69_B     Y    69_B     62   92  147     22   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     E    70_B     E    70_B     62   92  147     24   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     L    71_B     L    71_B     62   92  147     24   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     R    72_B     R    72_B     62   92  147     21   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     R    73_B     R    73_B     62   92  147     21   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     A    74_B     A    74_B     62   92  147     20   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     I    75_B     I    75_B     62   92  147     12   67  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     G    76_B     G    76_B     62   92  147     14   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     H    77_B     H    77_B     62   92  147     16   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     L    78_B     L    78_B     62   92  147     12   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     D    79_B     D    79_B     62   92  147     12   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     E    80_B     E    80_B     62   92  147     11   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     D    81_B     D    81_B     62   92  147     20   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     R    82_B     R    82_B     62   92  147     20   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     Y    83_B     Y    83_B     62   92  147     21   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     H    84_B     H    84_B     62   92  147     24   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     Q    85_B     Q    85_B     62   92  147     24   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     A    86_B     A    86_B     62   92  147     24   67  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     V    87_B     V    87_B     62   92  147     24   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     R    88_B     R    88_B     62   92  147     14   67  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     M    89_B     M    89_B     62   92  147     15   67  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     F    90_B     F    90_B     62   92  147     15   67  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     D    91_B     D    91_B     62   92  147     15   67  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     R    92_B     R    92_B     62   92  147     15   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     A    93_B     A    93_B     62   92  147     15   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     T    94_B     T    94_B     62   92  147     15   66  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     G    95_B     G    95_B     62   92  147     15   67  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     L    96_B     L    96_B     62   92  147     15   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     S    97_B     S    97_B     62   92  147     15   60  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     E    98_B     E    98_B     62   92  147     15   58  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     V    99_B     V    99_B     62   92  147     15   63  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     T   100_B     T   100_B     62   92  147     21   58  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     V   101_B     V   101_B     62   92  147     21   60  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     Q   102_B     Q   102_B     62   92  147     21   49  117  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     A   103_B     A   103_B     62   92  147     18   51  117  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     V   104_B     V   104_B     62   92  147      7   36   95  145  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     R   105_B     R   105_B     62   92  147      4   19   85  140  154  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     L   106_B     L   106_B     62   92  147      9   67  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     L   107_B     L   107_B     62   92  147     20   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     T   108_B     T   108_B     62   92  147      5   66  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     D   109_B     D   109_B      7   92  147      4    6    8   97  126  159  169  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     H   110_B     H   110_B      5   92  147      3    5   20   66  126  149  167  173  178  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     L   111_B     L   111_B      5   92  147      3    8   18   51   87  124  156  171  174  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     P   112_B     P   112_B      5   92  147      3    6   18   43   96  145  168  171  177  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     Q   113_B     Q   113_B      3   92  147      3    4   14   25   83  107  158  173  178  184  186  188  192  193  194  196  200  202  202  202 
LCS_GDT     H   114_B     H   114_B      6   92  147      3   53  116  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     S   115_B     S   115_B      6   92  147     13   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     L   116_B     L   116_B      6   92  147      5   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     L   117_B     L   117_B      6   92  147      4   55  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     M   118_B     M   118_B      6   92  147      6   56  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     M   119_B     M   119_B      6   92  147      3   39  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     R   120_B     R   120_B      4   92  147      4    4    4    4    6   26   59  145  169  182  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     N   121_B     N   121_B      4   92  147      4   13   46   97  127  148  168  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     A   122_B     A   122_B      4   92  147      4   20   48   82  130  158  168  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     L   123_B     L   123_B      4   92  147      4   45  104  135  154  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     P   124_B     P   124_B      3   92  147      3    3   41   65  121  160  170  173  178  184  186  188  192  193  194  196  200  202  202  202 
LCS_GDT     E   125_B     E   125_B     11   92  147      4   15   70  125  144  160  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     D   126_B     D   126_B     11   92  147      4   49  116  142  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     A   127_B     A   127_B     11   92  147     20   67  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     T   128_B     T   128_B     11   92  147     14   64  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     G   129_B     G   129_B     11   92  147     15   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     L   130_B     L   130_B     11   92  147     15   64  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     D   131_B     D   131_B     11   92  147     15   67  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     S   132_B     S   132_B     11   92  147      9   60  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     P   133_B     P   133_B     11   92  147      5   17   79  143  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     G   134_B     G   134_B     11   92  147      7   16   65  131  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     Y   135_B     Y   135_B     11   92  147     19   63  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     R   136_B     R   136_B     11   92  147     21   67  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     N   137_B     N   137_B     11   92  147      6   33   87  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     L   138_B     L   138_B      6   92  147      5   22   40   49   89  143  160  172  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     R   139_B     R   139_B      6   19  147      4    8   21   40   89  146  162  172  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     R   140_B     R   140_B      6   19  147      3   28   38   86  142  157  168  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     V   141_B     V   141_B      6   19  147      3   10   16   44   86  151  162  172  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     A   142_B     A   142_B      4    7  147      3    4    5    9   15   21   37   46   62   94  151  171  181  187  192  197  200  202  202  202 
LCS_GDT     R   143_B     R   143_B      4   18  147      3    3    7   21   58   98  152  170  177  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     P   144_B     P   144_B     15   18  147     10   56  115  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     V   145_B     V   145_B     15   18  147     21   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     W   146_B     W   146_B     15   18  147     21   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     K   147_B     K   147_B     15   18  147     15   67  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     A   148_B     A   148_B     15   18  147     15   65  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     Y   149_B     Y   149_B     15   18  147     20   62  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     E   150_B     E   150_B     15   18  147     12   62  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     Q   151_B     Q   151_B     15   18  147     18   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     A   152_B     A   152_B     15   18  147     13   62  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     V   153_B     V   153_B     15   18  147     12   58  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     E   154_B     E   154_B     15   18  147     12   56  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     R   155_B     R   155_B     15   18  147     17   63  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     A   156_B     A   156_B     15   18  147     15   63  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     G   157_B     G   157_B     15   18  147     12   25  110  143  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     L   158_B     L   158_B     15   18  147      3   13   64  113  148  157  166  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     S   159_B     S   159_B      6   18  147      3    6   12   17   33   81  134  162  171  177  184  188  189  191  194  197  200  202  202  202 
LCS_GDT     L   160_B     L   160_B      5   18  147      3    5    7   14   21   28   59   91  136  163  173  181  184  188  192  197  200  202  202  202 
LCS_GDT     Q   161_B     Q   161_B      7    8  147      3    6   10   14   19   23   35   51   84  105  123  140  163  178  183  187  190  195  196  201 
LCS_GDT     D   162_B     D   162_B      7    8  147      4    6    7    7    8   10   29   37   45   51   64   99  115  130  144  159  171  182  189  190 
LCS_GDT     V   163_B     V   163_B      7    8  147      4    6    7    8    8    9   35   37   40   48   53   59   82   89   95  120  134  146  163  173 
LCS_GDT     I   164_B     I   164_B      7    8  147      4    6    7    7    8   31   35   37   41   48   63   70   82  106  130  141  158  171  179  188 
LCS_GDT     A   165_B     A   165_B      7    8  147      4    6    7    7    7    8   28   33   37   41   46   49   57   60   79  103  111  116  125  159 
LCS_GDT     Q   166_B     Q   166_B      7    8  146      4    6    7    8   11   11   19   21   22   25   29   37   40   60   67   86   93   98  103  108 
LCS_GDT     Q   167_B     Q   167_B      7    8   23      5    6    7    8    8   11   19   21   22   25   29   35   40   47   51   71   80   86   92  103 
LCS_GDT     D   168_B     D   168_B      7    8   23      5    6    7    8    8   11   12   13   15   19   21   23   29   30   32   49   49   68   77   82 
LCS_GDT     D   169_B     D   169_B      7    8   23      4    6    7    8    8   11   12   13   15   19   21   23   24   26   28   32   36   40   42   47 
LCS_GDT     G   170_B     G   170_B      7    8   23      5    6    7    8    8   11   12   13   15   19   21   22   24   26   28   28   31   35   38   43 
LCS_GDT     Y   171_B     Y   171_B      7    8   23      5    6    7    8    8   11   12   13   15   19   21   23   24   26   28   33   39   41   45   48 
LCS_GDT     D   172_B     D   172_B      7    8   23      5    6    7    8    8   11   12   13   15   19   21   23   24   26   28   28   31   35   39   40 
LCS_GDT     G   173_B     G   173_B      7    8   46      3    4    7    8    8   11   12   13   15   19   21   23   24   26   28   28   31   35   39   40 
LCS_GDT     P   174_B     P   174_B      4    8   66      0    3    4    6   12   26   51   63   91  103  183  187  192  193  194  197  200  202  202  202 
LCS_GDT     R   175_B     R   175_B      4   39   66      2    6   13   69  115  140  156  172  179  183  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     S   176_B     S   176_B      5   39   66      4    5    9   13   29   41   96  126  151  178  183  188  192  193  194  197  200  202  202  202 
LCS_GDT     G   177_B     G   177_B      5   39   66      4    5   16   38   58   90  133  151  167  180  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     G   178_B     G   178_B      5   39   66      4    5   17   31   56   86  126  146  164  180  183  188  192  193  194  197  200  202  202  202 
LCS_GDT     S   179_B     S   179_B     35   39   66     15   48  111  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     Q   180_B     Q   180_B     35   39   66     15   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     S   181_B     S   181_B     35   39   66     21   60  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     L   182_B     L   182_B     35   39   66     21   51  115  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     A   183_B     A   183_B     35   39   66     21   59  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     L   184_B     L   184_B     35   39   66     21   60  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     V   185_B     V   185_B     35   39   66     21   59  117  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     R   186_B     R   186_B     35   39   66     21   55  117  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     E   187_B     E   187_B     35   39   66     21   60  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     A   188_B     A   188_B     35   39   66     21   60  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     M   189_B     M   189_B     35   39   66     19   45  111  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     L   190_B     L   190_B     35   39   66     21   60  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     R   191_B     R   191_B     35   39   66     21   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     L   192_B     L   192_B     35   39   66     21   60  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     D   193_B     D   193_B     35   39   66     21   60  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     G   194_B     G   194_B     35   39   66     21   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     S   195_B     S   195_B     35   39   66     21   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     V   196_B     V   196_B     35   39   66     21   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     L   197_B     L   197_B     35   39   66     21   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     G   198_B     G   198_B     35   39   66     21   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     W   199_B     W   199_B     35   39   66     24   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     K   200_B     K   200_B     35   39   66     24   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     Q   201_B     Q   201_B     35   39   66     24   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     H   202_B     H   202_B     35   39   66     24   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     H   203_B     H   203_B     35   39   66     24   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     L   204_B     L   204_B     35   39   66     21   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     I   205_B     I   205_B     35   39   66     22   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     M   206_B     M   206_B     35   39   66     21   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     V   207_B     V   207_B     35   39   66     21   60  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     W   208_B     W   208_B     35   39   66     17   60  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     S   209_B     S   209_B     35   39   66     21   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     Q   210_B     Q   210_B     35   39   66     21   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     L   211_B     L   211_B     35   39   66     20   60  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     G   212_B     G   212_B     35   39   66     21   60  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     G   213_B     G   213_B     35   39   66     21   50  114  140  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     Q   214_B     Q   214_B      5   38   66      3    5    5   18   36   69   96  129  148  167  177  182  187  193  194  197  200  202  202  202 
LCS_GDT     P   215_B     P   215_B      5   38   66      3    5   14   25   45   69   82  123  145  157  171  181  187  191  194  197  200  202  202  202 
LCS_GDT     G   216_B     G   216_B      5    7   66      3    3    5    6   12   17   35   59   67   77   96  119  137  154  168  180  186  193  200  202 
LCS_GDT     L   217_B     L   217_B      3    7   66      3    3    4    6    7    7    9    9   12   14   17   72   94  105  139  146  155  168  178  189 
LCS_GDT     L   239_B     L   239_B     13   22   66      7   11   40  140  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     A   240_B     A   240_B     13   22   66      7   42  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     T   241_B     T   241_B     13   22   66      7   38  113  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     L   242_B     L   242_B     13   22   66      7   58  112  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     E   243_B     E   243_B     13   22   66     21   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     A   244_B     A   244_B     13   22   66     24   68  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     R   245_B     R   245_B     13   22   66     13   67  113  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     S   246_B     S   246_B     13   22   66      6   34   86  132  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     Q   247_B     Q   247_B     14   22   66     10   19   62  136  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     L   248_B     L   248_B     14   22   66     11   60  118  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     A   249_B     A   249_B     14   22   66     12   20   37   60  134  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     L   250_B     L   250_B     14   22   66      4   21   40   53  127  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     F   251_B     F   251_B     14   22   66      5   28   48  124  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     P   252_B     P   252_B     14   22   66      5   21   43   91  150  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     E   253_B     E   253_B     14   22   66      5   21   40   73  130  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     L   254_B     L   254_B     14   22   66      5   21   50  129  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     W   255_B     W   255_B     14   22   66      5   24   94  146  155  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     R   256_B     R   256_B     14   22   66      5   24   55  106  150  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     A   257_B     A   257_B     14   22   66      8   21   43  106  150  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     A   258_B     A   258_B     14   22   66      8   19   40  106  150  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     E   259_B     E   259_B     14   22   66      4    8   34   49  135  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_GDT     D   260_B     D   260_B     14   22   66      4   16   40   49  135  163  170  173  179  184  186  188  192  193  194  197  200  202  202  202 
LCS_AVERAGE  LCS_A:  26.44  (  10.96   22.58   45.76 )

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     24     68    118    146    155    163    170    173    179    184    186    188    192    193    194    197    200    202    202    202 
GDT PERCENT_AT   9.23  26.15  45.38  56.15  59.62  62.69  65.38  66.54  68.85  70.77  71.54  72.31  73.85  74.23  74.62  75.77  76.92  77.69  77.69  77.69
GDT RMS_LOCAL    0.41   0.74   1.01   1.23   1.32   1.45   1.61   1.71   1.88   2.01   2.08   2.20   2.45   2.52   2.55   2.97   2.97   3.10   3.10   3.10
GDT RMS_ALL_AT   8.09   8.01   7.93   8.01   8.01   8.05   8.08   8.06   8.03   8.02   8.02   7.99   8.02   8.01   8.03   7.95   7.99   7.95   7.95   7.95

# Checking swapping
#   possible swapping detected:  D    21_B      D    21_B
#   possible swapping detected:  E    46_B      E    46_B
#   possible swapping detected:  F    52_B      F    52_B
#   possible swapping detected:  F    53_B      F    53_B
#   possible swapping detected:  Y    83_B      Y    83_B
#   possible swapping detected:  F    90_B      F    90_B
#   possible swapping detected:  E   125_B      E   125_B
#   possible swapping detected:  E   150_B      E   150_B
#   possible swapping detected:  D   169_B      D   169_B
#   possible swapping detected:  F   251_B      F   251_B
#   possible swapping detected:  E   259_B      E   259_B

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    D    19_B      D    19_B    15.532     0    0.116   1.005    17.390    0.000    0.000
LGA    F    20_B      F    20_B    12.469     0    0.666   1.208    16.457    0.000    0.000
LGA    D    21_B      D    21_B    11.223     0    0.395   1.388    12.856    0.000    0.000
LGA    R    22_B      R    22_B    10.830     0    0.233   1.376    17.941    1.071    0.390
LGA    G    23_B      G    23_B     7.301     0    0.583   0.583     8.480   24.524   24.524
LGA    S    24_B      S    24_B     5.163     0    0.168   0.475     7.573   35.952   26.825
LGA    N    25_B      N    25_B     1.990     0    0.589   1.296     8.447   70.833   44.762
LGA    Y    26_B      Y    26_B     1.857     0    0.028   1.388     7.214   72.857   56.032
LGA    E    27_B      E    27_B     1.822     0    0.029   0.554     3.280   72.857   69.418
LGA    N    28_B      N    28_B     1.923     0    0.086   0.902     2.938   70.833   67.917
LGA    V    29_B      V    29_B     1.795     0    0.025   0.028     1.967   72.857   72.857
LGA    L    30_B      L    30_B     1.404     0    0.047   0.122     1.522   79.286   80.357
LGA    H    31_B      H    31_B     1.442     0    0.056   0.861     3.204   77.143   74.143
LGA    L    32_B      L    32_B     1.865     0    0.123   1.345     2.882   70.833   70.060
LGA    T    33_B      T    33_B     1.878     0    0.029   0.081     2.346   72.857   69.388
LGA    D    34_B      D    34_B     1.300     0    0.018   0.251     1.503   81.429   81.488
LGA    A    35_B      A    35_B     1.038     0    0.029   0.027     1.148   81.429   81.429
LGA    L    36_B      L    36_B     0.961     0    0.185   0.231     1.726   81.548   89.583
LGA    G    37_B      G    37_B     1.713     0    0.214   0.214     1.713   81.548   81.548
LGA    A    38_B      A    38_B     1.032     0    0.159   0.158     1.447   85.952   86.857
LGA    L    39_B      L    39_B     1.653     0    0.121   0.134     2.403   72.857   69.821
LGA    V    40_B      V    40_B     1.822     0    0.284   1.043     5.849   52.619   46.259
LGA    P    41_B      P    41_B     6.499     0    0.029   0.030     7.452   25.714   22.857
LGA    E    42_B      E    42_B     9.667     0    0.022   0.225    17.278    1.905    0.847
LGA    S    43_B      S    43_B     8.967     0    0.696   0.810    12.221    5.714    3.810
LGA    E    44_B      E    44_B     7.475     0    0.139   0.264    13.505    9.286    4.339
LGA    T    45_B      T    45_B     8.190     0    0.604   1.321    11.934    8.214    4.762
LGA    E    46_B      E    46_B     4.525     0    0.153   1.309     5.208   39.286   36.931
LGA    H    47_B      H    47_B     1.789     0    0.668   1.118    10.248   79.405   38.048
LGA    P    48_B      P    48_B     0.569     0    0.039   0.173     1.540   88.452   89.320
LGA    D    49_B      D    49_B     0.403     0    0.024   0.065     0.545   95.238   97.619
LGA    Q    50_B      Q    50_B     0.684     0    0.051   0.150     1.465   90.476   88.466
LGA    R    51_B      R    51_B     0.560     0    0.028   0.986     6.226   90.476   62.727
LGA    F    52_B      F    52_B     1.051     0    0.000   1.154     4.542   83.690   69.264
LGA    F    53_B      F    53_B     1.102     0    0.056   0.200     1.371   81.429   81.429
LGA    Q    54_B      Q    54_B     0.735     0    0.074   0.734     4.139   90.476   74.286
LGA    V    55_B      V    55_B     0.689     0    0.023   0.101     0.848   90.476   90.476
LGA    T    56_B      T    56_B     0.955     0    0.073   1.159     3.301   90.476   82.109
LGA    H    57_B      H    57_B     0.818     0    0.046   1.208     6.228   90.476   61.238
LGA    L    58_B      L    58_B     0.705     0    0.032   1.399     3.612   90.476   78.214
LGA    I    59_B      I    59_B     0.809     0    0.057   0.118     0.995   90.476   90.476
LGA    T    60_B      T    60_B     0.690     0    0.025   0.036     0.815   90.476   90.476
LGA    E    61_B      E    61_B     0.816     0    0.056   0.326     1.580   90.476   85.503
LGA    Y    62_B      Y    62_B     0.955     0    0.055   1.098     6.943   85.952   61.349
LGA    A    63_B      A    63_B     1.091     0    0.040   0.039     1.112   83.690   83.238
LGA    W    64_B      W    64_B     1.206     0    0.000   0.229     2.255   81.429   74.184
LGA    V    65_B      V    65_B     1.424     0    0.059   0.924     2.270   81.429   75.442
LGA    Q    66_B      Q    66_B     1.177     0    0.014   0.116     1.547   81.429   81.481
LGA    V    67_B      V    67_B     1.112     0    0.037   0.063     1.289   83.690   82.721
LGA    H    68_B      H    68_B     1.193     0    0.022   1.088     3.794   81.429   76.143
LGA    Y    69_B      Y    69_B     1.187     0    0.038   0.162     2.379   81.429   75.833
LGA    E    70_B      E    70_B     0.792     0    0.025   0.893     4.111   90.476   78.836
LGA    L    71_B      L    71_B     0.843     0    0.054   0.120     1.584   90.476   86.012
LGA    R    72_B      R    72_B     0.507     0    0.020   1.226     4.966   95.238   78.312
LGA    R    73_B      R    73_B     0.479     0    0.051   1.239     4.524   97.619   75.714
LGA    A    74_B      A    74_B     1.100     0    0.070   0.073     1.226   81.429   81.429
LGA    I    75_B      I    75_B     1.193     0    0.043   0.103     1.776   85.952   80.476
LGA    G    76_B      G    76_B     0.642     0    0.017   0.017     0.777   92.857   92.857
LGA    H    77_B      H    77_B     0.263     0    0.082   0.194     0.870   95.238   94.286
LGA    L    78_B      L    78_B     0.728     0    0.000   0.065     1.084   90.476   89.345
LGA    D    79_B      D    79_B     0.710     0    0.043   0.316     1.834   90.476   87.143
LGA    E    80_B      E    80_B     0.810     0    0.020   0.102     1.518   90.476   85.503
LGA    D    81_B      D    81_B     0.640     0    0.108   0.211     1.117   88.214   89.345
LGA    R    82_B      R    82_B     0.628     0    0.007   0.784     3.860   88.214   74.329
LGA    Y    83_B      Y    83_B     1.131     0    0.060   0.368     3.850   83.690   68.849
LGA    H    84_B      H    84_B     0.955     0    0.047   1.291     6.086   88.214   60.762
LGA    Q    85_B      Q    85_B     1.308     0    0.022   1.206     5.601   81.429   59.577
LGA    A    86_B      A    86_B     1.354     0    0.018   0.017     1.464   81.429   81.429
LGA    V    87_B      V    87_B     0.843     0    0.030   0.039     1.168   85.952   87.891
LGA    R    88_B      R    88_B     1.161     0    0.017   1.091     3.905   83.690   76.494
LGA    M    89_B      M    89_B     1.499     0    0.000   0.973     3.036   79.286   73.214
LGA    F    90_B      F    90_B     1.252     0    0.031   0.122     1.812   81.429   79.091
LGA    D    91_B      D    91_B     1.237     0    0.029   0.088     1.693   81.429   78.214
LGA    R    92_B      R    92_B     0.984     0    0.020   1.056     4.458   88.214   74.632
LGA    A    93_B      A    93_B     0.957     0    0.020   0.011     1.007   85.952   86.857
LGA    T    94_B      T    94_B     1.249     0    0.023   0.057     1.603   81.429   80.204
LGA    G    95_B      G    95_B     1.045     0    0.027   0.027     1.088   85.952   85.952
LGA    L    96_B      L    96_B     0.808     0    0.056   0.162     1.180   85.952   90.595
LGA    S    97_B      S    97_B     1.200     0    0.067   0.577     3.336   81.429   76.190
LGA    E    98_B      E    98_B     1.254     0    0.094   0.938     5.591   83.690   63.757
LGA    V    99_B      V    99_B     1.084     0    0.019   0.059     1.174   83.690   85.306
LGA    T   100_B      T   100_B     1.130     0    0.024   0.053     1.566   81.429   78.980
LGA    V   101_B      V   101_B     1.108     0    0.052   0.922     2.301   79.286   76.599
LGA    Q   102_B      Q   102_B     1.640     0    0.030   0.474     3.748   75.000   61.270
LGA    A   103_B      A   103_B     1.513     0    0.072   0.085     1.652   75.000   76.286
LGA    V   104_B      V   104_B     1.997     0    0.072   1.222     4.644   72.857   68.571
LGA    R   105_B      R   105_B     2.316     0    0.073   1.403     6.522   68.810   45.887
LGA    L   106_B      L   106_B     1.148     0    0.034   1.359     4.024   83.690   71.190
LGA    L   107_B      L   107_B     0.812     0    0.131   1.407     3.275   88.214   80.952
LGA    T   108_B      T   108_B     1.382     0    0.107   0.182     2.320   77.143   74.150
LGA    D   109_B      D   109_B     3.751     0    0.083   0.077     6.695   45.238   33.512
LGA    H   110_B      H   110_B     4.799     0    0.125   1.025    10.564   33.095   15.857
LGA    L   111_B      L   111_B     5.351     0    0.635   0.840    10.445   31.548   18.571
LGA    P   112_B      P   112_B     4.863     0    0.665   0.632     6.912   25.595   23.810
LGA    Q   113_B      Q   113_B     4.559     0    0.548   1.332    11.604   43.690   22.434
LGA    H   114_B      H   114_B     1.529     0    0.590   1.465     5.442   63.214   55.190
LGA    S   115_B      S   115_B     0.593     0    0.048   0.567     2.585   92.857   85.000
LGA    L   116_B      L   116_B     0.931     0    0.031   1.241     3.022   83.810   76.548
LGA    L   117_B      L   117_B     1.676     0    0.016   1.411     5.383   75.000   58.452
LGA    M   118_B      M   118_B     1.741     0    0.126   0.184     2.519   68.929   68.869
LGA    M   119_B      M   119_B     1.769     0    0.598   0.962     7.768   61.429   46.488
LGA    R   120_B      R   120_B     6.763     0    0.652   1.215    18.858   21.786    8.052
LGA    N   121_B      N   121_B     5.148     0    0.045   0.065     8.125   27.619   20.357
LGA    A   122_B      A   122_B     4.740     0    0.272   0.283     5.567   39.048   35.524
LGA    L   123_B      L   123_B     3.033     0    0.595   1.501     5.122   46.905   43.869
LGA    P   124_B      P   124_B     4.062     0    0.628   0.553     6.546   56.071   41.701
LGA    E   125_B      E   125_B     3.689     0    0.537   1.106     6.869   43.452   32.593
LGA    D   126_B      D   126_B     2.243     0    0.055   0.095     2.738   68.810   65.833
LGA    A   127_B      A   127_B     1.530     0    0.019   0.019     1.909   72.857   72.857
LGA    T   128_B      T   128_B     1.706     0    0.019   1.007     4.238   77.143   70.272
LGA    G   129_B      G   129_B     1.224     0    0.061   0.061     1.589   79.286   79.286
LGA    L   130_B      L   130_B     1.685     0    0.034   0.034     1.962   72.857   72.857
LGA    D   131_B      D   131_B     1.504     0    0.022   0.207     1.849   75.000   77.143
LGA    S   132_B      S   132_B     1.769     0    0.061   0.078     1.872   75.000   74.286
LGA    P   133_B      P   133_B     2.289     0    0.025   0.231     2.997   64.762   61.497
LGA    G   134_B      G   134_B     2.704     0    0.000   0.000     2.704   62.976   62.976
LGA    Y   135_B      Y   135_B     1.653     0    0.030   0.172     1.887   77.143   74.286
LGA    R   136_B      R   136_B     1.026     0    0.022   0.718     3.465   81.429   73.983
LGA    N   137_B      N   137_B     2.008     0    0.126   0.900     7.972   66.786   45.060
LGA    L   138_B      L   138_B     4.483     0    0.255   0.786     7.650   37.619   26.190
LGA    R   139_B      R   139_B     4.882     0    0.405   1.551     6.850   29.286   27.143
LGA    R   140_B      R   140_B     4.059     0    0.121   1.299     7.829   33.333   33.377
LGA    V   141_B      V   141_B     4.551     0    0.654   1.173     6.045   29.048   33.401
LGA    A   142_B      A   142_B     9.492     0    0.637   0.617    12.096    5.833    4.667
LGA    R   143_B      R   143_B     5.514     0    0.569   1.435    12.919   29.643   12.121
LGA    P   144_B      P   144_B     1.337     0    0.633   0.581     4.102   85.952   66.871
LGA    V   145_B      V   145_B     0.679     0    0.084   0.885     2.969   90.476   84.422
LGA    W   146_B      W   146_B     0.720     0    0.029   0.229     1.553   95.238   85.408
LGA    K   147_B      K   147_B     0.586     0    0.033   0.605     2.371   92.857   85.661
LGA    A   148_B      A   148_B     0.824     0    0.086   0.097     0.862   90.476   90.476
LGA    Y   149_B      Y   149_B     0.955     0    0.061   0.091     1.111   90.476   87.460
LGA    E   150_B      E   150_B     1.033     0    0.040   0.675     1.760   83.690   80.582
LGA    Q   151_B      Q   151_B     0.950     0    0.033   1.404     4.486   85.952   74.021
LGA    A   152_B      A   152_B     1.091     0    0.000   0.000     1.383   83.690   83.238
LGA    V   153_B      V   153_B     1.547     0    0.024   0.052     2.052   75.000   72.925
LGA    E   154_B      E   154_B     1.786     0    0.018   1.143     4.710   72.857   59.153
LGA    R   155_B      R   155_B     1.375     0    0.122   0.919     2.682   77.143   76.883
LGA    A   156_B      A   156_B     1.357     0    0.030   0.037     1.733   77.143   78.000
LGA    G   157_B      G   157_B     2.343     0    0.148   0.148     3.795   57.738   57.738
LGA    L   158_B      L   158_B     4.244     0    0.078   1.101     8.135   34.881   26.786
LGA    S   159_B      S   159_B     7.732     0    0.287   0.674     9.626    7.143    5.635
LGA    L   160_B      L   160_B    10.543     0    0.629   1.399    15.217    0.357    1.786
LGA    Q   161_B      Q   161_B    15.668     0    0.626   1.173    18.938    0.000    0.000
LGA    D   162_B      D   162_B    19.420     0    0.094   0.296    22.234    0.000    0.000
LGA    V   163_B      V   163_B    21.692     0    0.284   1.243    22.959    0.000    0.000
LGA    I   164_B      I   164_B    19.934     0    0.121   0.142    21.584    0.000    0.000
LGA    A   165_B      A   165_B    22.733     0    0.049   0.045    26.171    0.000    0.000
LGA    Q   166_B      Q   166_B    27.089     0    0.665   0.944    29.208    0.000    0.000
LGA    Q   167_B      Q   167_B    29.443     0    0.697   0.989    32.763    0.000    0.000
LGA    D   168_B      D   168_B    34.827     0    0.058   0.092    38.777    0.000    0.000
LGA    D   169_B      D   169_B    35.894     0    0.128   1.098    37.171    0.000    0.000
LGA    G   170_B      G   170_B    39.975     0    0.089   0.089    39.975    0.000    0.000
LGA    Y   171_B      Y   171_B    35.571     0    0.039   0.205    36.760    0.000    0.000
LGA    D   172_B      D   172_B    35.331     0    0.636   1.211    39.367    0.000    0.000
LGA    G   173_B      G   173_B    29.111     0    0.112   0.112    31.034    0.000    0.000
LGA    P   174_B      P   174_B     9.197     0    0.654   0.717    10.407    6.905    4.014
LGA    R   175_B      R   175_B     6.034     0    0.479   1.013    13.179   13.452    9.307
LGA    S   176_B      S   176_B     8.531     0    0.611   0.920    11.224   11.548    7.698
LGA    G   177_B      G   177_B     7.893     0    0.103   0.103     8.318    8.810    8.810
LGA    G   178_B      G   178_B     7.785     0    0.075   0.075     7.910   14.286   14.286
LGA    S   179_B      S   179_B     2.034     0    0.430   0.404     4.151   66.190   64.603
LGA    Q   180_B      Q   180_B     0.771     0    0.087   0.471     2.905   85.952   81.852
LGA    S   181_B      S   181_B     1.350     0    0.030   0.047     1.702   81.429   78.571
LGA    L   182_B      L   182_B     1.848     0    0.020   0.167     2.824   72.857   67.857
LGA    A   183_B      A   183_B     1.441     0    0.033   0.037     1.471   81.429   81.429
LGA    L   184_B      L   184_B     1.273     0    0.031   0.082     1.462   81.429   81.429
LGA    V   185_B      V   185_B     1.606     0    0.037   0.042     1.991   75.000   74.082
LGA    R   186_B      R   186_B     1.600     0    0.027   1.408     6.931   72.857   53.550
LGA    E   187_B      E   187_B     1.345     0    0.031   0.406     3.062   81.429   75.132
LGA    A   188_B      A   188_B     1.562     0    0.028   0.027     1.814   75.000   74.571
LGA    M   189_B      M   189_B     1.861     0    0.032   1.161     2.625   75.000   69.940
LGA    L   190_B      L   190_B     1.359     0    0.041   1.396     3.318   79.286   71.310
LGA    R   191_B      R   191_B     0.976     0    0.035   1.139     5.712   83.690   66.580
LGA    L   192_B      L   192_B     1.430     0    0.022   0.092     2.054   81.429   76.131
LGA    D   193_B      D   193_B     1.243     0    0.031   0.439     2.758   85.952   78.512
LGA    G   194_B      G   194_B     0.767     0    0.050   0.050     0.871   90.476   90.476
LGA    S   195_B      S   195_B     0.619     0    0.040   0.575     2.717   90.476   84.921
LGA    V   196_B      V   196_B     0.865     0    0.000   0.045     1.367   90.476   86.599
LGA    L   197_B      L   197_B     0.544     0    0.051   0.098     0.879   95.238   92.857
LGA    G   198_B      G   198_B     0.291     0    0.017   0.017     0.357  100.000  100.000
LGA    W   199_B      W   199_B     0.433     0    0.013   0.139     1.896   95.238   85.476
LGA    K   200_B      K   200_B     0.522     0    0.000   0.745     3.440   92.857   85.238
LGA    Q   201_B      Q   201_B     0.472     0    0.044   1.058     4.168   95.238   81.429
LGA    H   202_B      H   202_B     0.686     0    0.032   0.865     2.429   92.857   85.381
LGA    H   203_B      H   203_B     0.952     0    0.087   1.153     2.449   90.476   79.190
LGA    L   204_B      L   204_B     1.256     0    0.038   0.122     1.477   81.429   81.429
LGA    I   205_B      I   205_B     1.192     0    0.000   0.062     1.437   85.952   83.690
LGA    M   206_B      M   206_B     0.609     0    0.068   0.926     3.753   85.952   75.952
LGA    V   207_B      V   207_B     1.657     0    0.040   0.094     2.395   75.000   72.925
LGA    W   208_B      W   208_B     2.047     0    0.034   1.287     7.859   68.810   45.306
LGA    S   209_B      S   209_B     1.026     0    0.038   0.036     1.312   85.952   89.048
LGA    Q   210_B      Q   210_B     1.013     0    0.086   0.829     3.562   83.690   72.011
LGA    L   211_B      L   211_B     1.709     0    0.086   0.105     2.773   75.000   68.929
LGA    G   212_B      G   212_B     1.828     0    0.079   0.079     3.158   65.119   65.119
LGA    G   213_B      G   213_B     2.790     0    0.467   0.467     5.487   43.571   43.571
LGA    Q   214_B      Q   214_B     9.773     0    0.031   1.063    17.417    2.738    1.217
LGA    P   215_B      P   215_B    11.017     0    0.556   0.603    13.200    0.000    0.000
LGA    G   216_B      G   216_B    17.076     0    0.525   0.525    20.094    0.000    0.000
LGA    L   217_B      L   217_B    18.681     0    0.305   1.366    20.732    0.000    0.000
LGA    L   239_B      L   239_B     2.156     0    0.089   0.920     3.667   69.048   67.321
LGA    A   240_B      A   240_B     1.675     0    0.020   0.025     1.955   75.000   74.571
LGA    T   241_B      T   241_B     1.820     0    0.029   1.139     4.825   77.143   69.456
LGA    L   242_B      L   242_B     1.516     0    0.072   1.400     3.549   77.143   72.381
LGA    E   243_B      E   243_B     0.351     0    0.035   0.120     1.410   97.619   91.693
LGA    A   244_B      A   244_B     0.699     0    0.036   0.035     1.439   95.238   92.476
LGA    R   245_B      R   245_B     1.339     0    0.083   1.221     8.150   79.286   52.468
LGA    S   246_B      S   246_B     2.368     0    0.040   0.131     3.345   63.095   62.381
LGA    Q   247_B      Q   247_B     2.611     0    0.059   1.005     3.826   62.976   58.254
LGA    L   248_B      L   248_B     1.098     0    0.085   0.112     3.524   67.738   67.500
LGA    A   249_B      A   249_B     3.375     0    0.106   0.134     4.070   53.690   50.381
LGA    L   250_B      L   250_B     3.536     0    0.024   0.095     4.158   46.667   45.060
LGA    F   251_B      F   251_B     2.695     0    0.012   0.317     2.942   57.143   62.035
LGA    P   252_B      P   252_B     3.101     0    0.043   0.162     4.039   51.786   48.231
LGA    E   253_B      E   253_B     3.611     0    0.111   1.327     9.264   48.333   30.899
LGA    L   254_B      L   254_B     2.475     0    0.034   0.240     2.877   62.857   63.810
LGA    W   255_B      W   255_B     2.039     0    0.037   0.267     2.403   64.762   70.544
LGA    R   256_B      R   256_B     3.048     0    0.020   1.354    10.070   51.786   32.121
LGA    A   257_B      A   257_B     3.128     0    0.062   0.072     3.128   50.000   50.000
LGA    A   258_B      A   258_B     3.120     0    0.068   0.076     3.331   50.000   50.000
LGA    E   259_B      E   259_B     3.741     0    0.068   0.763     3.919   43.333   48.730
LGA    D   260_B      D   260_B     3.758     0    0.234   0.509     5.424   46.667   41.310

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      221     884    884  100.00    1765   1765  100.00               260
SUMMARY(RMSD_GDC):     7.511          7.510                  7.733           54.059   49.526

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  222  260    4.0    173    1.71    56.154    51.044     9.578

LGA_LOCAL      RMSD:   1.706  Number of atoms:  173  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   8.061  Number of assigned atoms:  221 
Std_ASGN_ATOMS RMSD:   7.511  Standard rmsd on all 221 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.071009 * X  +   0.404364 * Y  +  -0.911838 * Z  +  52.369972
  Y_new =   0.990024 * X  +  -0.140098 * Y  +   0.014970 * Z  + -57.902554
  Z_new =  -0.121694 * X  +  -0.903804 * Y  +  -0.410278 * Z  + 139.452469 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  1.499195  0.121996 -1.996927   [DEG:   85.8975    6.9899 -114.4155 ]
ZXZ: -1.587212  1.993555 -3.007751   [DEG:  -90.9405  114.2223 -172.3315 ]
 
# END of job
