
#######################################################
#                                                     #
#                        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  249 ( 1930),  selected  230 , name one
# Molecule2: number of CA atoms  230 ( 1795),  selected  230 , 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:   230      15_B - 244_B       4.95     4.95
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    66      47_B - 112_B       1.99     8.13
  LONGEST_CONTINUOUS_SEGMENT:    66      48_B - 113_B       1.98     8.09
  LCS_AVERAGE:     15.10

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    26      76_B - 101_B       0.96     9.26
  LCS_AVERAGE:      4.75

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  230
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     A    15_B     A    15_B      5    7  230      4    6    9   22   36   50   76  111  129  145  163  178  194  203  211  216  218  223  224  227 
LCS_GDT     F    16_B     F    16_B      5    7  230      4    8   25   46   63   86  112  134  147  160  172  183  196  203  211  216  218  223  224  227 
LCS_GDT     Y    17_B     Y    17_B      5    7  230      5   15   42   59   81  103  124  142  152  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     E    18_B     E    18_B      5    7  230      4    8   29   48   66   86  112  134  147  160  172  183  196  203  211  216  218  223  224  227 
LCS_GDT     L    19_B     L    19_B      5    7  230      4   10   31   48   60   80  101  119  137  152  168  181  194  203  211  216  218  223  224  227 
LCS_GDT     E    20_B     E    20_B      5    7  230      3    4   23   30   37   53   90  111  126  146  158  173  190  202  211  216  218  223  224  227 
LCS_GDT     F    21_B     F    21_B      4    7  230      3    6   25   45   61   78  101  122  140  156  172  182  196  203  211  216  218  223  224  227 
LCS_GDT     G    22_B     G    22_B      3    5  230      3    4    8   14   29   49   63   96  113  125  139  158  175  196  207  216  218  223  224  227 
LCS_GDT     P    23_B     P    23_B      3    5  230      3    3    4   11   17   34   46   56   61   86  108  128  141  164  182  194  208  218  223  227 
LCS_GDT     R    24_B     R    24_B      3    6  230      3    9   16   24   27   30   41   68  104  123  153  172  183  197  209  215  218  223  224  227 
LCS_GDT     T    25_B     T    25_B      4    6  230      3    4    8    9   16   27   55   90  113  144  172  183  196  203  211  216  218  223  224  227 
LCS_GDT     I    26_B     I    26_B      4    6  230      3    4    6   37   60   83  106  126  149  160  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     M    27_B     M    27_B      5    8  230      4   21   40   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     T    28_B     T    28_B      5    8  230      4   24   40   66   86  108  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     L    29_B     L    29_B      5   22  230      4    6   28   41   74   96  120  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     A    30_B     A    30_B      5   22  230      6   16   30   47   64   88  106  126  146  161  173  182  196  203  211  216  218  223  224  227 
LCS_GDT     N    31_B     N    31_B      5   22  230      4    5   18   28   49   73   97  121  146  157  166  178  193  203  211  216  218  223  224  227 
LCS_GDT     F    32_B     F    32_B      4   22  230      4    9   22   40   64   96  124  141  154  163  173  182  196  203  211  216  218  223  224  227 
LCS_GDT     P    33_B     P    33_B      4   22  230      3   10   19   27   49   73   88  118  140  152  166  178  187  201  210  216  218  223  224  227 
LCS_GDT     D    34_B     D    34_B      5   22  230      4    5   16   40   65   99  124  143  154  163  173  182  196  203  211  216  218  223  224  227 
LCS_GDT     D    35_B     D    35_B     10   22  230      3    5    8   17   40   73   96  123  151  162  171  179  190  202  211  216  218  223  224  227 
LCS_GDT     V    36_B     V    36_B     10   22  230      3    7   12   23   49   75  102  129  153  163  173  182  196  203  211  216  218  223  224  227 
LCS_GDT     L    37_B     L    37_B     11   22  230      4    9   22   40   64   91  124  141  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     P    38_B     P    38_B     11   22  230      4    9   22   40   62   91  124  140  154  162  173  182  196  203  211  216  218  223  224  227 
LCS_GDT     L    39_B     L    39_B     13   22  230      5   10   27   42   70  100  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     L    40_B     L    40_B     13   22  230      5   11   24   45   72  102  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     Q    41_B     Q    41_B     13   22  230      5   12   28   53   82  110  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     M    42_B     M    42_B     13   22  230      5   12   20   51   81  110  124  143  154  162  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     E    43_B     E    43_B     13   22  230      7   12   20   53   81  110  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     S    44_B     S    44_B     13   22  230      7   12   19   50   79  107  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     L    45_B     L    45_B     13   22  230      7   12   19   60   85  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     M    46_B     M    46_B     13   22  230      7   12   21   56   80  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     T    47_B     T    47_B     13   66  230      7   21   37   59   83  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     F    48_B     F    48_B     13   66  230      7   13   47   67   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     E    49_B     E    49_B     13   66  230      7   12   47   66   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     A    50_B     A    50_B     13   66  230      7   18   38   66   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     M    51_B     M    51_B     13   66  230      7   12   31   66   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     A    52_B     A    52_B     13   66  230      4   21   47   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     Y    53_B     Y    53_B      3   66  230      3    3    8   13   27   56   83  127  151  161  171  183  196  203  211  216  218  223  224  227 
LCS_GDT     L    54_B     L    54_B      3   66  230      3    8   22   44   64   79  101  122  146  160  170  181  194  203  211  216  218  223  224  227 
LCS_GDT     R    55_B     R    55_B      4   66  230      3   16   36   55   70   85  114  132  149  161  172  183  196  203  211  216  218  223  224  227 
LCS_GDT     C    56_B     C    56_B      4   66  230      1    4    6    8   42   49   78   87  114  135  154  174  188  201  211  216  218  223  224  227 
LCS_GDT     D    57_B     D    57_B     12   66  230      6   28   47   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     A    58_B     A    58_B     12   66  230     11   25   46   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     L    59_B     L    59_B     12   66  230      7   24   46   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     V    60_B     V    60_B     12   66  230     11   36   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     E    61_B     E    61_B     12   66  230     15   36   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     L    62_B     L    62_B     12   66  230     11   36   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     G    63_B     G    63_B     12   66  230     11   36   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     C    64_B     C    64_B     12   66  230     11   36   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     Y    65_B     Y    65_B     12   66  230     11   36   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     D    66_B     D    66_B     12   66  230     11   36   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     G    67_B     G    67_B     12   66  230     11   36   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     R    68_B     R    68_B     12   66  230      3   16   45   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     A    69_B     A    69_B     11   66  230      8   36   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     L    70_B     L    70_B     10   66  230      6   15   46   67   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     E    71_B     E    71_B     10   66  230      6    9   32   64   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     I    72_B     I    72_B     10   66  230      6   12   44   61   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     A    73_B     A    73_B     19   66  230      7   28   51   67   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     R    74_B     R    74_B     21   66  230      6   15   35   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     L    75_B     L    75_B     22   66  230      6   20   46   64   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     L    76_B     L    76_B     26   66  230      6   36   51   67   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     N    77_B     N    77_B     26   66  230      5   30   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     A    78_B     A    78_B     26   66  230      6   29   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     R    79_B     R    79_B     26   66  230     10   36   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     Y    80_B     Y    80_B     26   66  230     10   36   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     L    81_B     L    81_B     26   66  230     11   36   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     G    82_B     G    82_B     26   66  230     11   36   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     V    83_B     V    83_B     26   66  230     13   36   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     D    84_B     D    84_B     26   66  230     11   36   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     L    85_B     L    85_B     26   66  230     12   36   51   62   85  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     D    86_B     D    86_B     26   66  230     13   36   51   62   87  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     Q    87_B     Q    87_B     26   66  230     15   36   51   62   89  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     R    88_B     R    88_B     26   66  230     15   36   51   62   89  110  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     A    89_B     A    89_B     26   66  230     15   36   51   62   89  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     I    90_B     I    90_B     26   66  230     15   36   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     E    91_B     E    91_B     26   66  230     15   36   51   66   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     T    92_B     T    92_B     26   66  230     15   36   51   64   89  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     L    93_B     L    93_B     26   66  230     15   34   51   66   89  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     R    94_B     R    94_B     26   66  230     15   34   51   66   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     T    95_B     T    95_B     26   66  230     15   34   51   62   89  108  123  142  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     R    96_B     R    96_B     26   66  230     15   33   48   62   89  107  123  142  153  162  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     I    97_B     I    97_B     26   66  230     15   31   47   62   89  108  123  142  153  162  172  183  196  203  211  216  218  223  224  227 
LCS_GDT     E    98_B     E    98_B     26   66  230      7   31   45   61   74   98  122  135  151  162  172  183  196  203  211  216  218  223  224  227 
LCS_GDT     R    99_B     R    99_B     26   66  230      9   31   45   61   74   92  116  132  147  160  171  183  196  203  211  216  218  223  224  227 
LCS_GDT     E   100_B     E   100_B     26   66  230     13   31   47   61   76  101  122  135  151  162  172  183  196  203  211  216  218  223  224  227 
LCS_GDT     G   101_B     G   101_B     26   66  230     15   31   47   61   74   94  122  135  151  161  172  183  196  203  211  216  218  223  224  227 
LCS_GDT     M   102_B     M   102_B     25   66  230      9   31   45   58   74   91  122  135  151  162  172  183  196  203  211  216  218  223  224  227 
LCS_GDT     S   103_B     S   103_B     24   66  230      3    8   18   41   75  101  115  137  151  162  172  183  196  203  211  216  218  223  224  227 
LCS_GDT     D   104_B     D   104_B      5   66  230      3    7   20   43   66   91  112  132  147  162  172  183  196  203  211  216  218  223  224  227 
LCS_GDT     R   105_B     R   105_B      8   66  230      1   14   44   64   89  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     A   106_B     A   106_B      8   66  230     10   36   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     D   107_B     D   107_B      8   66  230     11   36   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     T   108_B     T   108_B      8   66  230     13   36   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     V   109_B     V   109_B      8   66  230     13   36   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     V   110_B     V   110_B      8   66  230     13   36   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     D   111_B     D   111_B      8   66  230      3   26   51   62   90  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     D   112_B     D   112_B      8   66  230     11   31   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     I   113_B     I   113_B      8   66  230      4   22   47   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     L   114_B     L   114_B      7   63  230      4    9   28   64   89  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     N   115_B     N   115_B      7   62  230      4    5   28   53   85  110  123  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     H   116_B     H   116_B      7   60  230      4    8   20   43   83  106  123  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     T   117_B     T   117_B      4    5  230      3    4    4    5    9    9   40   54  124  156  170  182  196  203  211  216  218  223  224  227 
LCS_GDT     R   118_B     R   118_B      4    6  230      3    4    4   20   39   77  123  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     R   119_B     R   119_B      4    6  230      3    4   10   21   49   81  107  137  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     G   120_B     G   120_B      4    6  230      3    3    5    7   24   42   62   80  119  137  168  178  186  194  204  212  218  223  224  227 
LCS_GDT     A   121_B     A   121_B      4    6  230      3    3   14   18   31   65   98  128  148  163  173  182  196  203  211  216  218  223  224  227 
LCS_GDT     S   122_B     S   122_B      5    6  230      3    4    9   15   27   47   73  105  136  158  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     V   123_B     V   123_B      5    6  230      3    6   11   20   29   55   94  120  148  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     G   124_B     G   124_B      5    6  230      3    6   11   20   29   47   84  112  138  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     S   125_B     S   125_B      5    6  230      3    4    5   13   23   46   92  121  148  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     R   126_B     R   126_B      5    6  230      3    7   16   32   73  101  123  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     A   127_B     A   127_B      5    8  230     11   23   40   66   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     L   128_B     L   128_B      5    8  230     11   36   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     Y   129_B     Y   129_B      5    8  230     11   36   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     L   130_B     L   130_B      5    8  230     15   36   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     L   131_B     L   131_B      5    8  230     13   24   46   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     P   132_B     P   132_B      5    8  230      7   36   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     F   133_B     F   133_B      3    8  230      3   25   39   50   65   79   97  121  139  158  173  181  194  203  211  216  218  223  224  227 
LCS_GDT     N   134_B     N   134_B      3    8  230      4   19   40   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     L   135_B     L   135_B      3    8  230      3    7   28   66   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     L   136_B     L   136_B      4    6  230      3    5    9   21   39   96  123  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     G   137_B     G   137_B      4    6  230      3    3    5   21   35   62   86  114  146  161  170  182  196  203  211  216  218  223  224  227 
LCS_GDT     N   138_B     N   138_B      4    4  230      3    3    9   41   69   99  117  136  154  163  173  182  196  203  211  216  218  223  224  227 
LCS_GDT     F   139_B     F   139_B      4    5  230      3    7   19   32   70  101  122  137  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     R   140_B     R   140_B      4   25  230     10   26   51   62   89  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     E   141_B     E   141_B     10   28  230      4   20   38   54   81  104  124  143  153  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     P   142_B     P   142_B     11   28  230     11   24   46   66   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     K   143_B     K   143_B     11   28  230      8   23   46   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     R   144_B     R   144_B     11   28  230      8   24   46   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     L   145_B     L   145_B     11   28  230      6   24   46   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     L   146_B     L   146_B     11   28  230     11   24   46   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     D   147_B     D   147_B     11   28  230     11   24   46   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     S   148_B     S   148_B     11   28  230      7   24   46   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     L   149_B     L   149_B     11   28  230      5   19   45   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     A   150_B     A   150_B     11   28  230      5   15   42   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     E   151_B     E   151_B     11   28  230      5   14   42   66   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     R   152_B     R   152_B     11   28  230      3   16   44   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     S   153_B     S   153_B     10   28  230      3    4    7   41   64   92  123  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     V   154_B     V   154_B     10   28  230     10   24   46   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     A   155_B     A   155_B     10   28  230      9   32   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     A   156_B     A   156_B     10   28  230     11   34   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     V   157_B     V   157_B     10   28  230     15   36   51   66   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     V   158_B     V   158_B     10   28  230      5   23   39   63   87  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     S   159_B     S   159_B     10   28  230     11   24   46   66   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     V   160_B     V   160_B     10   28  230      7   24   46   66   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     F   161_B     F   161_B     10   28  230      6   22   40   66   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     G   162_B     G   162_B     10   28  230      3   23   39   63   85  110  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     D   163_B     D   163_B     10   28  230      3   10   34   61   81  110  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     S   164_B     S   164_B     10   28  230      7   21   34   44   74  107  124  143  154  163  171  182  196  203  211  216  218  223  224  227 
LCS_GDT     A   165_B     A   165_B     10   28  230      5    9   10   18   55  100  123  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     E   166_B     E   166_B     10   28  230      5    9   10   10   20   42   78  117  150  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     A   167_B     A   167_B     10   28  230      5   21   39   66   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     T   168_B     T   168_B     10   28  230      5   20   39   63   82  110  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     R   169_B     R   169_B     10   17  230      5   10   38   52   77   98  120  136  152  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     V   170_B     V   170_B     10   17  230      4   17   39   57   78  101  121  139  152  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     R   171_B     R   171_B     10   13  230      5   10   15   25   44   82  111  134  150  162  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     Q   172_B     Q   172_B     10   13  230      4    9   10   10   22   29   39   71  118  151  172  183  196  203  211  216  218  223  224  227 
LCS_GDT     S   173_B     S   173_B     10   13  230      4    6   13   18   32   70   91  111  134  155  172  183  196  203  211  216  218  223  224  227 
LCS_GDT     Y   174_B     Y   174_B      6   13  230      4    4    8   10   16   29   62   92  116  143  157  183  196  203  211  216  218  223  224  227 
LCS_GDT     Y   175_B     Y   175_B      6   13  230      5    5    7   10   14   22   46   57   79  130  141  169  188  201  211  216  218  223  224  227 
LCS_GDT     R   176_B     R   176_B      6    8  230      5   10   15   25   44   74  105  132  148  160  172  183  196  203  211  216  218  223  224  227 
LCS_GDT     R   177_B     R   177_B      6    8  230      5    5    5    7    9   13   42   56  107  143  154  176  196  203  211  216  218  223  224  227 
LCS_GDT     C   178_B     C   178_B      6    8  230      5    5    6   10   19   34   49   67   91  119  134  163  183  198  210  216  218  223  224  227 
LCS_GDT     G   179_B     G   179_B      6    8  230      5    5   15   38   56   77  101  125  144  160  172  183  196  203  211  216  218  223  224  227 
LCS_GDT     V   180_B     V   180_B      6    8  230      3    3    7   19   42   70   91  111  128  152  172  181  194  203  211  216  218  223  224  227 
LCS_GDT     Q   181_B     Q   181_B      4    8  230      3    4    8   15   45   49   60   68   97  106  128  154  176  197  209  214  218  223  224  227 
LCS_GDT     G   182_B     G   182_B      4    8  230      3    4    4    7    9   31   34   67   88  101  112  133  145  170  209  214  217  222  224  227 
LCS_GDT     L   183_B     L   183_B      6    8  230      3    4    8   20   70   88  113  132  148  162  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     E   184_B     E   184_B      6    8  230      3    4   27   52   77   99  120  136  152  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     L   185_B     L   185_B      6    8  230     11   24   46   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     H   186_B     H   186_B      6    8  230      3   15   40   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     T   187_B     T   187_B      6    8  230      3    9   33   66   92  110  124  143  154  163  173  182  196  203  211  216  218  223  224  227 
LCS_GDT     R   188_B     R   188_B      6    8  230     13   21   33   46   56   86  109  129  142  159  166  176  188  202  211  216  218  223  224  227 
LCS_GDT     D   189_B     D   189_B      3    8  230      3    3    4    6   22   34   69   75   83   98  118  139  150  160  172  184  205  215  223  226 
LCS_GDT     D   190_B     D   190_B      6    8  230      3    5    6    9   18   36   67   95  112  121  134  156  167  184  195  211  218  223  224  227 
LCS_GDT     G   191_B     G   191_B      6    8  230      3    5   15   20   32   41   72   95  112  133  152  162  179  187  205  216  218  223  224  227 
LCS_GDT     T   192_B     T   192_B      6    8  230      3    5    6   19   32   47   59   90  112  146  153  169  187  198  211  216  218  223  224  227 
LCS_GDT     V   193_B     V   193_B      6    8  230      3    5    6    8   16   19   40   54   80   96  122  139  170  185  202  211  218  223  224  227 
LCS_GDT     F   194_B     F   194_B      6    8  230      3    5    6   11   24   32   42   55   74   98  122  137  155  185  200  211  217  223  224  227 
LCS_GDT     T   195_B     T   195_B      6    8  230      3    5    6   10   16   29   37   49   59   73  100  127  139  157  172  189  209  216  224  227 
LCS_GDT     G   196_B     G   196_B      4   11  230      3    4   10   22   35   47   54   70   81   98  117  132  147  164  181  195  208  218  224  227 
LCS_GDT     S   197_B     S   197_B      4   11  230      3    4   16   22   35   47   60   71   81   98  116  130  147  157  171  188  205  214  221  226 
LCS_GDT     D   198_B     D   198_B      4   16  230      3    6   18   40   58   76   97  117  134  152  168  181  194  203  211  216  218  223  224  227 
LCS_GDT     G   199_B     G   199_B      4   16  230      2    4    8   15   30   50   73  102  118  137  156  176  190  201  211  216  218  223  224  227 
LCS_GDT     F   200_B     F   200_B      4   19  230      3    6   17   27   63   89  118  135  150  160  172  183  196  203  211  216  218  223  224  227 
LCS_GDT     Y   201_B     Y   201_B      4   20  230      3    6   17   25   50   86  118  135  150  160  172  183  196  203  211  216  218  223  224  227 
LCS_GDT     S   202_B     S   202_B     11   26  230      3    8   23   53   79  102  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     R   203_B     R   203_B     17   39  230      4   19   36   57   84  107  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     S   204_B     S   204_B     17   39  230      3   13   37   66   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     Y   205_B     Y   205_B     17   39  230      3   13   33   60   85  110  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     S   206_B     S   206_B     17   39  230     13   21   36   60   85  107  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     R   207_B     R   207_B     17   39  230     10   21   34   60   85  107  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     A   208_B     A   208_B     17   39  230     13   21   36   50   85  107  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     C   209_B     C   209_B     17   39  230     13   21   36   51   85  107  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     L   210_B     L   210_B     17   39  230     13   21   36   63   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     H   211_B     H   211_B     17   39  230     13   21   38   65   92  110  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     A   212_B     A   212_B     17   39  230     13   21   38   61   85  110  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     L   213_B     L   213_B     17   39  230     13   21   38   63   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     L   214_B     L   214_B     17   39  230     13   23   46   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     A   215_B     A   215_B     17   39  230     13   22   46   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     E   216_B     E   216_B     17   39  230     13   22   39   66   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     C   217_B     C   217_B     17   39  230     13   22   46   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     G   218_B     G   218_B     17   39  230      8   24   46   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     L   219_B     L   219_B     17   39  230      8   22   46   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     T   220_B     T   220_B     16   39  230      4    9   23   50   77  102  123  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     V   221_B     V   221_B     10   39  230      4    7   19   56   74   99  123  141  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     V   222_B     V   222_B      6   39  230      3    8   15   32   64   92  123  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     R   223_B     R   223_B      6   39  230      5   13   32   49   70  101  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     S   224_B     S   224_B      6   39  230      5   21   43   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     A   225_B     A   225_B      6   39  230     13   31   47   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     S   226_B     S   226_B      6   39  230      9   24   47   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     N   227_B     N   227_B      6   39  230      6   36   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     L   228_B     L   228_B      6   39  230      3   16   40   57   71   91  111  125  143  162  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     F   229_B     F   229_B      6   39  230      3    5   39   55   71   89  111  125  143  156  172  182  196  203  211  216  218  223  224  227 
LCS_GDT     A   230_B     A   230_B     10   39  230      5   34   51   66   89  111  123  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     H   231_B     H   231_B     11   39  230      5   36   51   67   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     C   232_B     C   232_B     11   39  230     11   36   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     V   233_B     V   233_B     11   39  230     11   28   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     T   234_B     T   234_B     11   39  230     11   24   51   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     V   235_B     V   235_B     11   39  230     11   24   47   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     L   236_B     L   236_B     11   39  230     11   24   46   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     P   237_B     P   237_B     11   39  230     11   24   46   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     E   238_B     E   238_B     11   39  230      5   19   45   66   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     G   239_B     G   239_B     11   39  230      5   21   46   66   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     A   240_B     A   240_B     11   39  230     11   23   41   68   92  111  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     D   241_B     D   241_B     11   39  230      6   21   35   54   80  106  124  143  154  163  173  183  196  203  211  216  218  223  224  227 
LCS_GDT     Q   242_B     Q   242_B      7   14  230      4    8   10   18   46   61   81  108  133  158  173  181  194  203  211  216  218  223  224  227 
LCS_GDT     G   243_B     G   243_B      4   14  230      0    3    9   15   27   43   66   95  111  121  156  165  176  185  197  208  218  223  224  227 
LCS_GDT     F   244_B     F   244_B      4    5  230      0    3    4   10   18   22   25   41   47   65   81  105  117  148  166  177  189  203  210  217 
LCS_AVERAGE  LCS_A:  39.95  (   4.75   15.10  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     15     36     51     68     92    111    124    143    154    163    173    183    196    203    211    216    218    223    224    227 
GDT PERCENT_AT   6.52  15.65  22.17  29.57  40.00  48.26  53.91  62.17  66.96  70.87  75.22  79.57  85.22  88.26  91.74  93.91  94.78  96.96  97.39  98.70
GDT RMS_LOCAL    0.31   0.72   0.97   1.45   1.72   1.99   2.19   2.49   2.71   2.97   3.21   3.48   3.72   3.89   4.12   4.28   4.35   4.54   4.58   4.74
GDT RMS_ALL_AT   9.36   7.43   7.06   5.46   5.43   5.63   5.63   5.49   5.50   5.35   5.27   5.15   5.12   5.06   5.02   4.99   4.99   4.97   4.97   4.96

# Checking swapping
#   possible swapping detected:  F    21_B      F    21_B
#   possible swapping detected:  D    34_B      D    34_B
#   possible swapping detected:  E    43_B      E    43_B
#   possible swapping detected:  Y    53_B      Y    53_B
#   possible swapping detected:  D    57_B      D    57_B
#   possible swapping detected:  E    71_B      E    71_B
#   possible swapping detected:  Y    80_B      Y    80_B
#   possible swapping detected:  D    84_B      D    84_B
#   possible swapping detected:  Y   129_B      Y   129_B
#   possible swapping detected:  F   139_B      F   139_B
#   possible swapping detected:  E   141_B      E   141_B
#   possible swapping detected:  E   151_B      E   151_B
#   possible swapping detected:  F   161_B      F   161_B
#   possible swapping detected:  Y   174_B      Y   174_B
#   possible swapping detected:  D   189_B      D   189_B
#   possible swapping detected:  D   198_B      D   198_B
#   possible swapping detected:  Y   201_B      Y   201_B
#   possible swapping detected:  E   216_B      E   216_B
#   possible swapping detected:  D   241_B      D   241_B

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    A    15_B      A    15_B    10.293     0    0.033   0.047    11.492    0.595    0.476
LGA    F    16_B      F    16_B     7.328     0    0.060   0.817     8.071   11.310   15.455
LGA    Y    17_B      Y    17_B     4.424     0    0.245   0.205     5.772   26.548   53.175
LGA    E    18_B      E    18_B     7.126     0    0.095   0.604    12.009    8.690    4.444
LGA    L    19_B      L    19_B     9.019     0    0.121   0.216    10.962    4.048    2.202
LGA    E    20_B      E    20_B    10.406     0    0.613   1.116    11.861    0.595    0.317
LGA    F    21_B      F    21_B     9.245     0    0.597   1.078    11.577    1.310    1.385
LGA    G    22_B      G    22_B    12.236     0    0.504   0.504    12.236    0.000    0.000
LGA    P    23_B      P    23_B    13.470     0    0.643   0.550    17.437    0.119    0.068
LGA    R    24_B      R    24_B    10.826     0    0.527   1.164    15.892    0.714    0.260
LGA    T    25_B      T    25_B     8.219     0    0.575   1.418     8.896    8.571    6.667
LGA    I    26_B      I    26_B     5.652     0    0.047   1.540     6.589   25.476   23.036
LGA    M    27_B      M    27_B     1.370     0    0.211   0.352     5.429   69.048   57.560
LGA    T    28_B      T    28_B     2.845     0    0.078   0.214     4.252   52.143   51.497
LGA    L    29_B      L    29_B     4.584     0    0.182   1.179     5.395   31.548   28.869
LGA    A    30_B      A    30_B     6.466     0    0.096   0.095     7.575   18.214   16.000
LGA    N    31_B      N    31_B     7.091     0    0.269   1.240     7.853   12.619   13.393
LGA    F    32_B      F    32_B     4.731     0    0.163   0.865     6.085   27.500   32.771
LGA    P    33_B      P    33_B     7.628     0    0.612   0.576     9.337   13.690    9.864
LGA    D    34_B      D    34_B     4.248     0    0.514   1.315     5.299   31.548   41.071
LGA    D    35_B      D    35_B     5.816     0    0.350   0.787     8.594   23.810   15.298
LGA    V    36_B      V    36_B     5.407     0    0.039   0.095     6.345   26.190   23.537
LGA    L    37_B      L    37_B     4.643     0    0.057   1.342     6.198   32.976   29.107
LGA    P    38_B      P    38_B     4.755     0    0.107   0.098     5.849   34.286   30.136
LGA    L    39_B      L    39_B     4.037     0    0.070   0.783     4.374   40.238   41.964
LGA    L    40_B      L    40_B     3.924     0    0.067   0.066     5.430   43.333   36.786
LGA    Q    41_B      Q    41_B     3.458     0    0.027   1.033     6.212   48.333   40.635
LGA    M    42_B      M    42_B     3.952     0    0.051   0.831     7.123   43.333   30.893
LGA    E    43_B      E    43_B     3.612     0    0.035   0.700     3.742   43.333   49.418
LGA    S    44_B      S    44_B     3.315     0    0.029   0.045     3.792   50.000   47.778
LGA    L    45_B      L    45_B     2.883     0    0.055   1.470     4.898   57.262   47.381
LGA    M    46_B      M    46_B     3.239     0    0.038   1.018     8.223   50.000   39.583
LGA    T    47_B      T    47_B     3.043     0    0.032   1.126     4.900   53.571   48.571
LGA    F    48_B      F    48_B     2.169     0    0.053   1.206     4.323   62.857   62.944
LGA    E    49_B      E    49_B     2.431     0    0.064   1.217     3.061   64.762   66.825
LGA    A    50_B      A    50_B     2.583     0    0.036   0.052     2.682   59.048   58.667
LGA    M    51_B      M    51_B     2.544     0    0.057   0.994     6.043   59.048   52.321
LGA    A    52_B      A    52_B     1.908     0    0.148   0.169     3.365   63.095   63.429
LGA    Y    53_B      Y    53_B     6.119     0    0.535   1.259    18.284   21.190    7.460
LGA    L    54_B      L    54_B     6.261     0    0.305   1.130     9.891   15.357   10.893
LGA    R    55_B      R    55_B     5.462     0    0.387   1.681    12.148   27.738   14.589
LGA    C    56_B      C    56_B     7.101     0    0.336   0.346    12.447   20.238   13.730
LGA    D    57_B      D    57_B     0.466     0    0.672   1.160     4.393   85.119   63.512
LGA    A    58_B      A    58_B     1.357     0    0.063   0.075     1.575   79.286   79.714
LGA    L    59_B      L    59_B     1.541     0    0.072   0.091     2.220   79.286   75.060
LGA    V    60_B      V    60_B     0.894     0    0.121   0.117     1.273   83.690   87.959
LGA    E    61_B      E    61_B     1.181     0    0.060   0.285     1.336   83.690   83.439
LGA    L    62_B      L    62_B     1.484     0    0.079   1.425     3.697   81.429   74.524
LGA    G    63_B      G    63_B     1.776     0    0.060   0.060     1.776   72.857   72.857
LGA    C    64_B      C    64_B     1.375     0    0.038   0.049     1.639   77.143   78.571
LGA    Y    65_B      Y    65_B     2.102     0    0.208   1.442    11.494   66.786   35.357
LGA    D    66_B      D    66_B     2.235     0    0.264   1.049     2.601   68.810   71.131
LGA    G    67_B      G    67_B     1.654     0    0.231   0.231     2.132   77.381   77.381
LGA    R    68_B      R    68_B     1.423     0    0.138   1.192     9.702   79.286   42.424
LGA    A    69_B      A    69_B     1.344     0    0.265   0.261     1.643   81.429   79.714
LGA    L    70_B      L    70_B     2.199     0    0.079   0.973     3.644   70.833   61.369
LGA    E    71_B      E    71_B     2.739     0    0.103   1.260     7.149   60.952   39.947
LGA    I    72_B      I    72_B     2.912     0    0.043   1.259     6.250   59.048   56.131
LGA    A    73_B      A    73_B     2.323     0    0.039   0.044     2.666   66.786   64.857
LGA    R    74_B      R    74_B     1.882     0    0.058   1.049     8.513   72.857   45.758
LGA    L    75_B      L    75_B     2.734     0    0.139   1.414     4.172   57.262   59.702
LGA    L    76_B      L    76_B     2.395     0    0.096   1.408     3.029   64.762   66.131
LGA    N    77_B      N    77_B     1.592     0    0.074   1.304     3.643   77.143   74.583
LGA    A    78_B      A    78_B     1.230     0    0.048   0.060     1.367   85.952   85.048
LGA    R    79_B      R    79_B     0.736     0    0.121   1.412     3.919   92.857   74.675
LGA    Y    80_B      Y    80_B     0.485     0    0.045   0.194     1.944   92.857   87.540
LGA    L    81_B      L    81_B     0.700     0    0.118   0.110     1.023   88.214   90.536
LGA    G    82_B      G    82_B     1.120     0    0.099   0.099     1.120   83.690   83.690
LGA    V    83_B      V    83_B     0.970     0    0.061   1.000     3.024   83.690   78.299
LGA    D    84_B      D    84_B     1.548     0    0.070   0.415     2.876   75.000   75.238
LGA    L    85_B      L    85_B     3.034     0    0.061   1.166     4.386   51.786   57.381
LGA    D    86_B      D    86_B     3.279     0    0.039   0.827     6.830   51.786   38.631
LGA    Q    87_B      Q    87_B     3.016     0    0.037   1.453     4.513   51.786   54.815
LGA    R    88_B      R    88_B     3.747     0    0.036   1.211     8.638   43.333   32.641
LGA    A    89_B      A    89_B     3.537     0    0.035   0.040     3.716   48.452   47.429
LGA    I    90_B      I    90_B     2.174     0    0.047   1.462     3.708   62.857   60.476
LGA    E    91_B      E    91_B     2.892     0    0.049   0.232     3.358   53.571   51.587
LGA    T    92_B      T    92_B     3.754     0    0.052   0.982     5.427   43.333   41.837
LGA    L    93_B      L    93_B     3.181     0    0.044   1.140     3.957   50.000   55.833
LGA    R    94_B      R    94_B     3.029     0    0.048   1.153     3.881   48.452   56.320
LGA    T    95_B      T    95_B     4.300     0    0.033   1.057     5.659   35.833   31.905
LGA    R    96_B      R    96_B     4.693     0    0.055   0.732     6.201   30.119   28.831
LGA    I    97_B      I    97_B     4.294     0    0.051   0.187     5.380   32.976   40.893
LGA    E    98_B      E    98_B     5.728     0    0.043   1.169    10.941   19.524   12.593
LGA    R    99_B      R    99_B     6.623     0    0.063   0.247     8.552   15.238   10.563
LGA    E   100_B      E   100_B     5.502     0    0.186   0.732     6.020   20.357   33.968
LGA    G   101_B      G   101_B     6.125     0    0.174   0.174     6.125   20.357   20.357
LGA    M   102_B      M   102_B     5.641     0    0.654   1.092     5.906   22.619   28.690
LGA    S   103_B      S   103_B     4.956     0    0.645   0.756     6.228   25.238   24.048
LGA    D   104_B      D   104_B     6.314     0    0.090   0.983     9.238   20.833   13.750
LGA    R   105_B      R   105_B     3.517     0    0.072   1.432    10.935   48.452   31.342
LGA    A   106_B      A   106_B     2.207     0    0.177   0.245     3.766   55.595   57.429
LGA    D   107_B      D   107_B     1.497     0    0.068   1.268     3.973   83.690   72.560
LGA    T   108_B      T   108_B     1.167     0    0.043   1.154     4.125   81.429   71.497
LGA    V   109_B      V   109_B     0.589     0    0.084   1.139     2.482   88.214   81.837
LGA    V   110_B      V   110_B     1.917     0    0.211   0.203     3.504   63.690   59.864
LGA    D   111_B      D   111_B     2.661     0    0.062   0.317     5.372   64.881   50.417
LGA    D   112_B      D   112_B     1.605     0    0.114   0.189     2.583   66.905   77.560
LGA    I   113_B      I   113_B     2.115     0    0.032   1.448     4.511   63.095   56.250
LGA    L   114_B      L   114_B     3.146     0    0.041   1.090     4.369   48.810   47.798
LGA    N   115_B      N   115_B     4.263     0    0.595   0.793     7.622   40.238   29.702
LGA    H   116_B      H   116_B     4.057     0    0.583   1.611     6.778   33.214   26.000
LGA    T   117_B      T   117_B     6.464     0    0.081   1.190     9.649   19.048   12.381
LGA    R   118_B      R   118_B     4.210     0    0.571   0.625    15.495   45.357   20.390
LGA    R   119_B      R   119_B     5.817     0    0.258   1.309    12.807   17.738   10.649
LGA    G   120_B      G   120_B     7.884     0    0.190   0.190     7.884   13.810   13.810
LGA    A   121_B      A   121_B     6.436     0    0.066   0.108     6.997   15.238   14.857
LGA    S   122_B      S   122_B     7.600     0    0.508   0.949     9.474    9.405    6.746
LGA    V   123_B      V   123_B     7.031     0    0.075   1.332     7.218   12.619   15.850
LGA    G   124_B      G   124_B     7.962     0    0.067   0.067     7.962    9.405    9.405
LGA    S   125_B      S   125_B     6.671     0    0.615   0.670    10.004   21.071   15.238
LGA    R   126_B      R   126_B     4.264     0    0.246   1.277    15.837   41.310   16.494
LGA    A   127_B      A   127_B     2.396     0    0.637   0.592     4.813   73.214   64.857
LGA    L   128_B      L   128_B     1.462     0    0.092   1.207     4.486   77.143   65.893
LGA    Y   129_B      Y   129_B     1.521     0    0.113   0.528     3.896   72.976   70.794
LGA    L   130_B      L   130_B     1.789     0    0.070   1.149     3.671   72.857   68.155
LGA    L   131_B      L   131_B     1.871     0    0.188   1.009     3.324   72.857   71.131
LGA    P   132_B      P   132_B     1.603     0    0.130   0.212     2.779   69.048   70.748
LGA    F   133_B      F   133_B     6.013     0    0.409   0.984    15.392   26.786   10.173
LGA    N   134_B      N   134_B     1.167     0    0.355   1.229     5.072   77.262   62.560
LGA    L   135_B      L   135_B     2.161     0    0.035   1.225     6.384   61.190   52.440
LGA    L   136_B      L   136_B     4.001     0    0.626   1.284     6.750   45.119   35.357
LGA    G   137_B      G   137_B     5.209     0    0.053   0.053     5.209   36.429   36.429
LGA    N   138_B      N   138_B     5.043     0    0.676   0.706    10.320   32.976   18.274
LGA    F   139_B      F   139_B     4.943     0    0.604   1.574    12.544   40.714   16.364
LGA    R   140_B      R   140_B     3.396     0    0.034   1.285    12.778   48.571   24.545
LGA    E   141_B      E   141_B     3.566     0    0.539   1.003     7.589   54.048   32.063
LGA    P   142_B      P   142_B     2.225     0    0.097   0.423     3.915   66.905   59.864
LGA    K   143_B      K   143_B     1.984     0    0.058   1.025     4.171   70.833   58.836
LGA    R   144_B      R   144_B     1.582     0    0.077   1.554     7.538   72.857   52.424
LGA    L   145_B      L   145_B     1.507     0    0.050   0.079     2.024   77.143   73.988
LGA    L   146_B      L   146_B     1.038     0    0.036   1.426     4.052   81.429   68.095
LGA    D   147_B      D   147_B     1.348     0    0.066   0.254     1.892   77.143   76.071
LGA    S   148_B      S   148_B     1.721     0    0.073   0.593     1.903   72.857   74.286
LGA    L   149_B      L   149_B     1.690     0    0.080   0.225     1.738   75.000   73.929
LGA    A   150_B      A   150_B     1.861     0    0.081   0.102     2.046   72.857   71.238
LGA    E   151_B      E   151_B     2.129     0    0.103   1.030     3.905   70.952   59.418
LGA    R   152_B      R   152_B     1.951     0    0.673   0.786    10.812   60.714   31.385
LGA    S   153_B      S   153_B     3.757     0    0.159   0.240     6.967   55.595   42.143
LGA    V   154_B      V   154_B     0.730     0    0.642   1.400     3.159   86.071   82.177
LGA    A   155_B      A   155_B     1.595     0    0.100   0.151     2.006   70.833   71.238
LGA    A   156_B      A   156_B     1.483     0    0.093   0.139     1.592   79.286   79.714
LGA    V   157_B      V   157_B     2.350     0    0.051   0.132     3.056   60.952   58.299
LGA    V   158_B      V   158_B     2.851     0    0.205   1.235     4.201   55.357   52.245
LGA    S   159_B      S   159_B     2.434     0    0.064   0.641     2.571   62.857   63.492
LGA    V   160_B      V   160_B     2.368     0    0.063   1.116     4.446   64.762   61.973
LGA    F   161_B      F   161_B     2.332     0    0.059   1.442     7.476   64.762   46.017
LGA    G   162_B      G   162_B     2.916     0    0.058   0.058     2.916   57.143   57.143
LGA    D   163_B      D   163_B     3.114     0    0.727   1.250     6.901   44.048   35.893
LGA    S   164_B      S   164_B     3.682     0    0.629   0.761     5.643   61.667   49.048
LGA    A   165_B      A   165_B     3.793     0    0.041   0.046     5.315   40.476   37.619
LGA    E   166_B      E   166_B     5.191     0    0.047   1.161     7.864   34.524   21.852
LGA    A   167_B      A   167_B     2.111     0    0.069   0.087     2.930   60.952   60.190
LGA    T   168_B      T   168_B     3.725     0    0.040   1.040     5.940   38.333   38.776
LGA    R   169_B      R   169_B     6.285     0    0.028   1.725     8.439   16.905   18.831
LGA    V   170_B      V   170_B     5.428     0    0.076   1.234     6.799   21.786   30.748
LGA    R   171_B      R   171_B     6.646     0    0.191   1.462    11.202   10.595    9.870
LGA    Q   172_B      Q   172_B    10.131     0    0.083   1.120    15.801    0.714    0.317
LGA    S   173_B      S   173_B     9.399     0    0.057   0.695     9.952    1.190    1.825
LGA    Y   174_B      Y   174_B     8.329     0    0.606   1.449    16.234    2.500    0.873
LGA    Y   175_B      Y   175_B    11.149     0    0.452   0.468    16.330    0.357    0.119
LGA    R   176_B      R   176_B     7.977     0    0.067   1.367     9.829    5.119    8.312
LGA    R   177_B      R   177_B     9.173     0    0.043   1.492    10.041    1.310    0.693
LGA    C   178_B      C   178_B    11.486     0    0.158   0.157    12.869    0.000    0.000
LGA    G   179_B      G   179_B     9.411     0    0.105   0.105     9.897    0.714    0.714
LGA    V   180_B      V   180_B    10.637     0    0.046   0.989    12.590    0.000    0.680
LGA    Q   181_B      Q   181_B    13.209     0    0.049   1.174    15.500    0.000    0.000
LGA    G   182_B      G   182_B    13.358     0    0.399   0.399    13.519    0.000    0.000
LGA    L   183_B      L   183_B     7.917     0    0.295   0.985     9.349    6.429   15.179
LGA    E   184_B      E   184_B     6.719     0    0.138   0.643    11.795   21.548   10.476
LGA    L   185_B      L   185_B     1.424     0    0.192   1.367     4.171   71.429   60.060
LGA    H   186_B      H   186_B     1.348     0    0.224   1.132     3.902   79.286   68.762
LGA    T   187_B      T   187_B     2.505     0    0.607   0.626     4.440   54.286   48.707
LGA    R   188_B      R   188_B     5.753     0    0.580   1.362     8.299   16.190   17.619
LGA    D   189_B      D   189_B    11.559     0    0.597   0.679    16.645    0.357    0.179
LGA    D   190_B      D   190_B     9.826     0    0.557   1.142    10.766    0.357    0.774
LGA    G   191_B      G   191_B     8.787     0    0.073   0.073     8.974    2.857    2.857
LGA    T   192_B      T   192_B     8.907     0    0.277   1.083    10.216    2.500    3.537
LGA    V   193_B      V   193_B    11.887     0    0.057   0.088    14.557    0.000    0.000
LGA    F   194_B      F   194_B    12.210     0    0.104   1.331    12.904    0.000    0.260
LGA    T   195_B      T   195_B    14.843     0    0.086   1.292    19.422    0.000    0.000
LGA    G   196_B      G   196_B    14.238     0    0.237   0.237    16.026    0.000    0.000
LGA    S   197_B      S   197_B    15.657     0    0.249   0.681    16.012    0.000    0.000
LGA    D   198_B      D   198_B    10.138     0    0.642   1.268    12.498    0.000   10.000
LGA    G   199_B      G   199_B    11.809     0    0.702   0.702    11.809    0.238    0.238
LGA    F   200_B      F   200_B     6.480     0    0.171   1.432     8.425    9.167   22.078
LGA    Y   201_B      Y   201_B     6.484     0    0.048   1.135    14.504   22.976    8.730
LGA    S   202_B      S   202_B     4.245     0    0.282   0.380     5.281   44.524   46.429
LGA    R   203_B      R   203_B     3.371     0    0.089   1.458    12.731   51.905   28.052
LGA    S   204_B      S   204_B     1.921     0    0.149   0.543     3.207   66.786   65.000
LGA    Y   205_B      Y   205_B     2.978     0    0.043   0.303     5.517   59.048   44.444
LGA    S   206_B      S   206_B     3.325     0    0.058   0.077     3.398   50.000   50.000
LGA    R   207_B      R   207_B     3.349     0    0.066   1.446     7.708   50.000   32.121
LGA    A   208_B      A   208_B     3.643     0    0.054   0.066     4.107   45.000   43.429
LGA    C   209_B      C   209_B     3.470     0    0.056   0.821     3.821   51.905   52.619
LGA    L   210_B      L   210_B     2.320     0    0.048   1.386     4.840   64.881   60.714
LGA    H   211_B      H   211_B     2.343     0    0.038   0.710     3.583   64.762   62.762
LGA    A   212_B      A   212_B     2.955     0    0.034   0.048     3.597   57.143   54.381
LGA    L   213_B      L   213_B     2.541     0    0.059   1.397     3.363   60.952   60.119
LGA    L   214_B      L   214_B     1.140     0    0.052   0.965     2.799   79.286   77.381
LGA    A   215_B      A   215_B     1.649     0    0.035   0.045     2.030   75.000   72.952
LGA    E   216_B      E   216_B     2.202     0    0.034   0.718     5.937   64.762   51.534
LGA    C   217_B      C   217_B     1.672     0    0.123   0.856     4.878   77.143   68.810
LGA    G   218_B      G   218_B     1.458     0    0.289   0.289     2.083   77.262   77.262
LGA    L   219_B      L   219_B     1.672     0    0.041   1.064     3.612   67.143   67.381
LGA    T   220_B      T   220_B     3.770     0    0.619   0.911     5.963   40.952   41.905
LGA    V   221_B      V   221_B     4.429     0    0.074   0.100     8.327   40.357   28.639
LGA    V   222_B      V   222_B     4.321     0    0.587   1.000     8.926   35.952   24.762
LGA    R   223_B      R   223_B     3.938     0    0.047   1.117     6.183   58.214   39.004
LGA    S   224_B      S   224_B     1.101     0    0.235   0.293     2.661   73.095   69.048
LGA    A   225_B      A   225_B     2.030     0    0.032   0.049     4.154   71.190   64.381
LGA    S   226_B      S   226_B     2.132     0    0.056   0.130     5.500   79.643   63.651
LGA    N   227_B      N   227_B     1.933     0    0.644   1.129     4.755   64.881   58.869
LGA    L   228_B      L   228_B     6.504     0    0.171   1.020     8.592   15.000   10.893
LGA    F   229_B      F   229_B     6.893     0    0.029   0.283    12.066   17.262    7.446
LGA    A   230_B      A   230_B     3.396     0    0.044   0.063     4.325   45.119   46.095
LGA    H   231_B      H   231_B     2.316     0    0.077   1.027     4.356   64.762   56.238
LGA    C   232_B      C   232_B     1.820     0    0.105   0.101     2.289   72.857   70.159
LGA    V   233_B      V   233_B     0.992     0    0.070   1.098     2.817   83.690   77.075
LGA    T   234_B      T   234_B     1.124     0    0.108   1.077     3.865   85.952   76.122
LGA    V   235_B      V   235_B     0.817     0    0.035   1.024     2.818   85.952   79.456
LGA    L   236_B      L   236_B     1.010     0    0.033   1.044     3.152   88.214   78.750
LGA    P   237_B      P   237_B     0.457     0    0.133   0.240     1.118   90.595   93.265
LGA    E   238_B      E   238_B     2.451     0    0.219   0.221     5.007   64.881   49.101
LGA    G   239_B      G   239_B     2.548     0    0.116   0.116     2.669   69.286   69.286
LGA    A   240_B      A   240_B     1.639     0    0.074   0.084     2.977   69.048   66.667
LGA    D   241_B      D   241_B     3.288     0    0.124   1.042     6.618   37.619   34.464
LGA    Q   242_B      Q   242_B     7.098     0    0.658   1.137     7.678   15.833   14.709
LGA    G   243_B      G   243_B     9.699     0    0.675   0.675    11.606    0.833    0.833
LGA    F   244_B      F   244_B    15.430     0    0.448   0.506    18.552    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      230     920    920  100.00    1795   1795  100.00               230
SUMMARY(RMSD_GDC):     4.949          4.889                  5.852           45.865   41.444

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  249  230    4.0    143    2.49    50.326    43.903     5.515

LGA_LOCAL      RMSD:   2.493  Number of atoms:  143  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   5.486  Number of assigned atoms:  230 
Std_ASGN_ATOMS RMSD:   4.949  Standard rmsd on all 230 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.388566 * X  +   0.577285 * Y  +  -0.718164 * Z  +  74.220711
  Y_new =  -0.331176 * X  +   0.814824 * Y  +   0.475799 * Z  + -63.149899
  Z_new =   0.859848 * X  +   0.052959 * Y  +   0.507795 * Z  + -73.570206 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -0.705830 -1.034973  0.103917   [DEG:  -40.4411  -59.2996    5.9540 ]
ZXZ: -2.155924  1.038173  1.509283   [DEG: -123.5254   59.4829   86.4755 ]
 
# END of job
