
#######################################################
#                                                     #
#                        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  248 ( 1910),  selected  237 , name one
# Molecule2: number of CA atoms  269 ( 2068),  selected  237 , 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:   208      40_B - 258_B       4.89    17.36
  LCS_AVERAGE:     70.13

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   138      50_B - 187_B       1.95    17.59
  LONGEST_CONTINUOUS_SEGMENT:   138      51_B - 188_B       1.97    17.62
  LCS_AVERAGE:     34.16

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   129      51_B - 179_B       0.99    17.19
  LCS_AVERAGE:     28.52

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  237
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     M    11_B     M    11_B      4   18   42      3    4    6   10   16   20   23   27   30   32   35   37   39   41   43   45   46   48   49   51 
LCS_GDT     P    12_B     P    12_B      4   18   42      3    4    8   17   21   23   25   27   30   32   35   37   39   41   43   45   46   48   49   51 
LCS_GDT     S    13_B     S    13_B     15   18   42      4   13   20   21   22   24   25   27   30   32   35   37   39   41   43   45   46   48   49   51 
LCS_GDT     P    14_B     P    14_B     15   18   42      4   13   18   21   22   24   25   27   30   32   35   37   39   41   43   45   46   48   49   51 
LCS_GDT     A    15_B     A    15_B     15   18   42      7   15   20   21   22   24   25   27   30   32   35   37   39   41   43   45   46   48   49   51 
LCS_GDT     S    16_B     S    16_B     15   18   42      7   15   20   21   22   24   25   27   30   32   35   37   39   41   43   45   46   48   49   51 
LCS_GDT     E    17_B     E    17_B     15   18   42      5   15   20   21   22   24   25   27   30   32   35   37   39   41   43   45   46   48   49   51 
LCS_GDT     E    18_B     E    18_B     15   18   42      7   15   20   21   22   24   25   27   30   32   35   37   39   41   43   45   46   48   49   51 
LCS_GDT     V    19_B     V    19_B     15   18   42      7   15   20   21   22   24   25   27   30   32   35   37   39   41   43   45   46   48   49   51 
LCS_GDT     G    20_B     G    20_B     15   18   42      7   15   20   21   22   24   25   27   30   32   35   37   39   41   43   45   46   48   49   51 
LCS_GDT     A    21_B     A    21_B     15   18   42      7   15   20   21   22   24   25   27   30   32   35   37   39   41   43   45   46   48   49   51 
LCS_GDT     L    22_B     L    22_B     15   18   42      7   15   20   21   22   24   25   27   30   32   35   37   39   41   43   45   46   48   49   51 
LCS_GDT     Y    23_B     Y    23_B     15   18   42      7   15   20   21   22   24   25   27   30   32   35   37   39   41   43   45   46   48   49   51 
LCS_GDT     D    24_B     D    24_B     15   18   42      7   15   20   21   22   24   25   27   30   32   35   37   39   41   43   45   46   48   49   51 
LCS_GDT     R    25_B     R    25_B     15   18   42      7   15   20   21   22   24   25   27   30   32   35   37   39   41   43   45   46   48   49   51 
LCS_GDT     F    26_B     F    26_B     15   18   42      4   15   20   21   22   24   25   27   30   32   35   37   39   41   43   45   46   48   49   51 
LCS_GDT     T    27_B     T    27_B     15   18   42      4   11   16   20   22   24   25   27   30   32   35   37   39   41   43   45   46   48   49   51 
LCS_GDT     A    28_B     A    28_B     10   18   42      3    5    9   15   21   23   25   27   30   32   35   37   39   41   43   45   46   48   49   51 
LCS_GDT     L    29_B     L    29_B      4   18   42      3    4    5    8   15   19   23   27   30   32   35   37   39   41   43   45   46   48   49   51 
LCS_GDT     G    30_B     G    30_B      4   18   42      3    4    5   11   15   19   23   27   28   32   35   37   39   41   43   45   46   48   49   51 
LCS_GDT     A    31_B     A    31_B      4    6   42      3    3    4    5    8   19   24   27   29   32   35   37   39   41   43   45   46   48   49   51 
LCS_GDT     A    32_B     A    32_B      4    6   42      3    4    4    5    5   21   25   27   30   32   35   37   39   41   43   45   46   48   49   51 
LCS_GDT     S    33_B     S    33_B      4    6   42      3    4    4    5    7    8   14   22   27   31   34   36   39   41   43   45   46   48   49   51 
LCS_GDT     L    34_B     L    34_B      4    5   42      3    4    4    5    5    6   10   12   14   22   27   32   35   41   42   45   46   48   49   51 
LCS_GDT     G    35_B     G    35_B      4    5   42      3    4    4   15   16   18   23   26   30   32   35   37   39   41   43   45   46   48   49   51 
LCS_GDT     E    36_B     E    36_B      8    9   42      3   10   20   21   22   24   25   27   30   32   35   37   39   41   43   45   46   48   49   51 
LCS_GDT     N    37_B     N    37_B      8    9   42      4   15   20   21   22   24   25   27   30   32   35   37   39   41   43   45   46   48   49   51 
LCS_GDT     L    38_B     L    38_B      8    9  147      7   15   20   21   22   24   25   27   30   32   35   37   39   41   43   45   46   48   49   51 
LCS_GDT     H    39_B     H    39_B      8    9  164      7   15   20   21   22   24   25   27   30   32   35   37   39   41   43   45   46   48   49   51 
LCS_GDT     F    40_B     F    40_B      8    9  208      7   15   20   21   22   24   25   27   30   32   35   37   39   41   43   45   46   48   49   51 
LCS_GDT     G    41_B     G    41_B      8    9  208      5   15   20   21   22   24   25   27   30   32   35   37   39   41   43   45   46   50   74  128 
LCS_GDT     Y    42_B     Y    42_B      8    9  208      5   10   20   21   22   24   25   27   30   32   35   37   39   41   43   99  146  174  180  187 
LCS_GDT     W    43_B     W    43_B      8    9  208      0    5    8   10   21   24  112  162  165  168  177  182  183  185  188  192  192  193  195  196 
LCS_GDT     D    44_B     D    44_B      5    9  208      5    5    5   10   37   80  134  143  165  168  172  177  182  185  188  192  192  193  195  196 
LCS_GDT     S    45_B     S    45_B      5    8  208      5    5    6   17   22   86  124  143  150  168  171  175  178  182  186  188  191  193  194  196 
LCS_GDT     P    46_B     P    46_B      5    8  208      5    5    6    9   17   20   24   28   33   37   45   66   88  124  160  173  175  184  188  191 
LCS_GDT     D    47_B     D    47_B      5  135  208      5    5    8   11   15   19   25   30   33   48   57   66   75  109  124  131  136  171  188  191 
LCS_GDT     S    48_B     S    48_B      5  137  208      5    5    6   13   19   27   30   38   55  151  157  161  167  178  181  185  188  191  193  196 
LCS_GDT     Q    49_B     Q    49_B      5  137  208      3    5   35   52   92  130  146  157  164  170  173  176  182  185  188  192  192  193  195  196 
LCS_GDT     V    50_B     V    50_B    124  138  208      3   10   29   89  141  155  163  168  172  175  178  182  184  185  188  192  192  193  195  196 
LCS_GDT     P    51_B     P    51_B    129  138  208      8   78  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     L    52_B     L    52_B    129  138  208     20  100  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     A    53_B     A    53_B    129  138  208     13   90  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     E    54_B     E    54_B    129  138  208     18   85  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     A    55_B     A    55_B    129  138  208     24  100  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     T    56_B     T    56_B    129  138  208     47  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     D    57_B     D    57_B    129  138  208     22   98  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     R    58_B     R    58_B    129  138  208     22   92  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     L    59_B     L    59_B    129  138  208     22   97  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     T    60_B     T    60_B    129  138  208     22   98  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     D    61_B     D    61_B    129  138  208     18   88  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     M    62_B     M    62_B    129  138  208     22   98  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     M    63_B     M    63_B    129  138  208     22   98  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     A    64_B     A    64_B    129  138  208     12   63  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     E    65_B     E    65_B    129  138  208      7   41  114  148  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     R    66_B     R    66_B    129  138  208      7   41   94  140  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     L    67_B     L    67_B    129  138  208      7   24  101  144  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     R    68_B     R    68_B    129  138  208      3   39   91  148  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     I    69_B     I    69_B    129  138  208      7   65  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     G    70_B     G    70_B    129  138  208     16   62  120  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     A    71_B     A    71_B    129  138  208     10   71  123  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     G    72_B     G    72_B    129  138  208     26  102  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     S    73_B     S    73_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     R    74_B     R    74_B    129  138  208     58  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     V    75_B     V    75_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     L    76_B     L    76_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     D    77_B     D    77_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     L    78_B     L    78_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     G    79_B     G    79_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     C    80_B     C    80_B    129  138  208     16  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     G    81_B     G    81_B    129  138  208     54  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     V    82_B     V    82_B    129  138  208     16  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     G    83_B     G    83_B    129  138  208     16  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     T    84_B     T    84_B    129  138  208     26  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     P    85_B     P    85_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     G    86_B     G    86_B    129  138  208     19  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     V    87_B     V    87_B    129  138  208     41  102  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     R    88_B     R    88_B    129  138  208     41  102  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     I    89_B     I    89_B    129  138  208     51  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     A    90_B     A    90_B    129  138  208     53  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     R    91_B     R    91_B    129  138  208     31  102  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     L    92_B     L    92_B    129  138  208     31  102  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     S    93_B     S    93_B    129  138  208     31  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     G    94_B     G    94_B    129  138  208     31  102  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     A    95_B     A    95_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     H    96_B     H    96_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     V    97_B     V    97_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     T    98_B     T    98_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     G    99_B     G    99_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     I   100_B     I   100_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     S   101_B     S   101_B    129  138  208     51  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     V   102_B     V   102_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     S   103_B     S   103_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     H   104_B     H   104_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     E   105_B     E   105_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     Q   106_B     Q   106_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     V   107_B     V   107_B    129  138  208     58  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     V   108_B     V   108_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     R   109_B     R   109_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     A   110_B     A   110_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     N   111_B     N   111_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     A   112_B     A   112_B    129  138  208     58  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     L   113_B     L   113_B    129  138  208     58  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     A   114_B     A   114_B    129  138  208     39  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     E   115_B     E   115_B    129  138  208     39  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     E   116_B     E   116_B    129  138  208     39  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     A   117_B     A   117_B    129  138  208     39  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     G   118_B     G   118_B    129  138  208     32  102  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     L   119_B     L   119_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     A   120_B     A   120_B    129  138  208     33  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     D   121_B     D   121_B    129  138  208     30  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     R   122_B     R   122_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     A   123_B     A   123_B    129  138  208     58  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     R   124_B     R   124_B    129  138  208     27  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     F   125_B     F   125_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     Q   126_B     Q   126_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     R   127_B     R   127_B    129  138  208     51  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     A   128_B     A   128_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     D   129_B     D   129_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     A   130_B     A   130_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     M   131_B     M   131_B    129  138  208     22  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     D   132_B     D   132_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     L   133_B     L   133_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     P   134_B     P   134_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     F   135_B     F   135_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     E   136_B     E   136_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     D   137_B     D   137_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     E   138_B     E   138_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     S   139_B     S   139_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     F   140_B     F   140_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     D   141_B     D   141_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     A   142_B     A   142_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     V   143_B     V   143_B    129  138  208     32  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     I   144_B     I   144_B    129  138  208     44  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     A   145_B     A   145_B    129  138  208     40  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     L   146_B     L   146_B    129  138  208     44  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     E   147_B     E   147_B    129  138  208     44  101  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     S   148_B     S   148_B    129  138  208     44  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     I   149_B     I   149_B    129  138  208     44  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     I   150_B     I   150_B    129  138  208     40   97  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     H   151_B     H   151_B    129  138  208     32   98  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     M   152_B     M   152_B    129  138  208     16   98  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     P   153_B     P   153_B    129  138  208     15   98  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     D   154_B     D   154_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     R   155_B     R   155_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     A   156_B     A   156_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     Q   157_B     Q   157_B    129  138  208     58  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     V   158_B     V   158_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     L   159_B     L   159_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     A   160_B     A   160_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     Q   161_B     Q   161_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     V   162_B     V   162_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     G   163_B     G   163_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     R   164_B     R   164_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     V   165_B     V   165_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     L   166_B     L   166_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     R   167_B     R   167_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     P   168_B     P   168_B    129  138  208     58  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     G   169_B     G   169_B    129  138  208     58  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     G   170_B     G   170_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     R   171_B     R   171_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     L   172_B     L   172_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     V   173_B     V   173_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     L   174_B     L   174_B    129  138  208      4   90  131  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     T   175_B     T   175_B    129  138  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     D   176_B     D   176_B    129  138  208     31   94  133  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     F   177_B     F   177_B    129  138  208     10   92  131  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     F   178_B     F   178_B    129  138  208     11   84  131  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     E   179_B     E   179_B    129  138  208     12   83  127  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     R   180_B     R   180_B    119  138  208      3   22   94  135  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     A   181_B     A   181_B    115  138  208      5   31   74  129  159  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     P   182_B     P   182_B     15  138  208      5   25   60  116  153  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     L   183_B     L   183_B     15  138  208      5   15   43   83  131  161  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     A   184_B     A   184_B     15  138  208      5   12   16   27   57  110  151  170  177  179  179  181  184  185  188  192  192  193  195  196 
LCS_GDT     P   185_B     P   185_B     15  138  208      5   12   15   23   28   60  104  152  177  179  179  181  184  185  188  192  192  193  195  196 
LCS_GDT     E   186_B     E   186_B     15  138  208      5   12   15   23   44   65  104  155  177  179  179  181  184  185  188  192  192  193  195  196 
LCS_GDT     G   187_B     G   187_B     15  138  208      5   12   24   37   73  133  162  170  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     R   188_B     R   188_B     15  138  208      5   12   24   32   67  110  156  170  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     A   189_B     A   189_B     15  122  208      5   12   16   30   52   98  146  170  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     A   190_B     A   190_B     15   21  208      5   12   24   54  101  151  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     V   191_B     V   191_B     15   21  208      5    8   24   38   72  128  162  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     Q   192_B     Q   192_B      9   21  208      5    8   24   35   64  118  153  170  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     R   193_B     R   193_B      9   21  208      5   10   31   57  114  161  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     Y   194_B     Y   194_B      7   20  208      4    6    7   35   60   87  111  135  171  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     L   195_B     L   195_B      7    7  208      4    6    7    8    8    9   70   78   88  108  129  152  178  185  188  192  192  193  195  196 
LCS_GDT     H   196_B     H   196_B      7    7  208      4    6   21   55   90  118  142  152  156  169  174  177  182  185  188  192  192  193  195  196 
LCS_GDT     D   197_B     D   197_B      7    7  208      4    7    7   20   92  130  146  165  169  175  178  182  184  185  188  192  192  193  195  196 
LCS_GDT     F   198_B     F   198_B      7    7  208      4    7   15   27   89  135  146  160  168  173  177  182  184  185  188  192  192  193  195  196 
LCS_GDT     M   199_B     M   199_B      7    7  208      3    5    7    8    8    9   12   14   19   31   51  126  144  162  167  183  186  190  195  196 
LCS_GDT     M   200_B     M   200_B      3    5  208      3    3    4    7   10   14   16   19   70  115  141  150  156  162  178  183  191  192  195  196 
LCS_GDT     T   201_B     T   201_B      4    6  208      3    4    4    8   10   12   13   13   17   30   36   59   76  110  129  144  159  172  181  189 
LCS_GDT     M   202_B     M   202_B      4    6  208      3    4    4    8   10   12   16   21   30   36   50   68   79   99  159  161  168  174  189  191 
LCS_GDT     V   203_B     V   203_B      4    6  208      3    4    6    8   10   12   16   21   26   30   36   42   52   61   73   87   98  113  141  181 
LCS_GDT     S   204_B     S   204_B      4    6  208      3    4    6    8   10   12   16   21   26   30   36   47   52   61   69   83   94  105  127  137 
LCS_GDT     A   205_B     A   205_B      4    6  208      3    4    6    8   10   12   16   21   28   35   44   51   55   61   69  101  111  118  161  167 
LCS_GDT     E   206_B     E   206_B      3    6  208      3    3    4    5    8   12   16   21   28   35   41   51   55   62   79  101  111  157  178  181 
LCS_GDT     A   207_B     A   207_B      3    4  208      3    3    3    3    4    6    9   14   88  104  116  131  148  172  178  188  192  193  195  196 
LCS_GDT     Y   208_B     Y   208_B      3    4  208      3    3    3    4    5    9   12   20   60  113  129  169  176  181  188  192  192  193  195  196 
LCS_GDT     P   209_B     P   209_B      3    4  208      3    3    3    4    7   14   70   78   88  104  129  169  176  181  188  192  192  193  195  196 
LCS_GDT     P   210_B     P   210_B      3   17  208      3    3    4    4    9   21   70   84  121  138  166  177  181  185  188  192  192  193  195  196 
LCS_GDT     L   211_B     L   211_B     16   37  208     13   90  134  149  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     L   212_B     L   212_B     16   37  208     13  102  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     R   213_B     R   213_B     16   37  208     12   98  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     G   214_B     G   214_B     16   37  208     14  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     A   215_B     A   215_B     16   37  208     14  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     G   216_B     G   216_B     16   37  208     12   96  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     L   217_B     L   217_B     16   37  208     14  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     W   218_B     W   218_B     16   37  208     59  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     L   219_B     L   219_B     16   37  208     58  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     E   220_B     E   220_B     16   37  208     18  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     E   221_B     E   221_B     16   37  208     15  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     F   222_B     F   222_B     16   37  208     39  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     L   223_B     L   223_B     16   37  208     37  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     D   224_B     D   224_B     16   37  208     38  103  134  150  161  166  168  171  174  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     I   225_B     I   225_B     16   37  208      7   96  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     S   226_B     S   226_B     16   37  208      4   10   23   75  160  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     D   227_B     D   227_B      8   37  208      4   10   56  125  157  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     Q   228_B     Q   228_B     17   37  208      3   32   94  137  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     T   229_B     T   229_B     17   37  208     58  103  134  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     L   230_B     L   230_B     17   37  208      6   19   71  148  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     E   231_B     E   231_B     17   37  208     13   24   90  142  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     K   232_B     K   232_B     17   37  208     14   51  124  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     T   233_B     T   233_B     17   37  208     14   51  128  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     F   234_B     F   234_B     17   37  208     13   50   96  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     R   235_B     R   235_B     17   37  208     14   51   95  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     L   236_B     L   236_B     17   37  208     14   51  127  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     L   237_B     L   237_B     17   37  208     14   51  127  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     S   238_B     S   238_B     17   37  208     14   51  118  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     E   239_B     E   239_B     17   37  208     14   51  124  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     R   240_B     R   240_B     17   37  208     14   61  128  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     I   241_B     I   241_B     17   37  208     14   61  127  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     N   242_B     N   242_B     17   37  208     14   52  127  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     S   243_B     S   243_B     17   37  208     14   59  127  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     S   244_B     S   244_B     17   37  208      3   23  127  150  161  166  168  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     K   245_B     K   245_B     17   37  208      3    4    6   37  110  162  167  171  177  179  179  182  184  185  188  192  192  193  195  196 
LCS_GDT     V   257_B     V   257_B      0   37  208      6   13   21  114  133  162  167  170  172  177  178  182  184  185  188  192  192  193  195  196 
LCS_GDT     N   258_B     N   258_B      0   37  208      0    3    8   19   36  161  167  170  172  176  178  182  184  185  188  192  192  193  195  196 
LCS_AVERAGE  LCS_A:  44.27  (  28.52   34.16   70.13 )

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     59    103    134    150    161    166    168    171    177    179    179    182    184    185    188    192    192    193    195    196 
GDT PERCENT_AT  21.93  38.29  49.81  55.76  59.85  61.71  62.45  63.57  65.80  66.54  66.54  67.66  68.40  68.77  69.89  71.38  71.38  71.75  72.49  72.86
GDT RMS_LOCAL    0.32   0.58   0.84   1.06   1.22   1.37   1.48   1.62   2.14   2.19   2.19   2.17   2.36   2.37   2.58   2.89   2.89   2.96   3.21   3.25
GDT RMS_ALL_AT  17.03  17.05  17.13  17.26  17.30  17.34  17.38  17.44  17.64  17.65  17.65  17.50  17.59  17.44  17.48  17.53  17.53  17.53  17.47  17.49

# Checking swapping
#   possible swapping detected:  D    24_B      D    24_B
#   possible swapping detected:  D    47_B      D    47_B
#   possible swapping detected:  E    54_B      E    54_B
#   possible swapping detected:  E   115_B      E   115_B
#   possible swapping detected:  E   116_B      E   116_B
#   possible swapping detected:  D   121_B      D   121_B
#   possible swapping detected:  D   132_B      D   132_B
#   possible swapping detected:  D   176_B      D   176_B
#   possible swapping detected:  Y   194_B      Y   194_B
#   possible swapping detected:  E   206_B      E   206_B
#   possible swapping detected:  Y   208_B      Y   208_B
#   possible swapping detected:  E   221_B      E   221_B
#   possible swapping detected:  E   231_B      E   231_B
#   possible swapping detected:  F   234_B      F   234_B

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    M    11_B      M    11_B    60.421     0    0.252   0.964    62.387    0.000    0.000
LGA    P    12_B      P    12_B    59.183     0    0.277   0.533    60.220    0.000    0.000
LGA    S    13_B      S    13_B    59.698     0    0.586   0.490    60.394    0.000    0.000
LGA    P    14_B      P    14_B    58.005     0    0.079   0.160    60.989    0.000    0.000
LGA    A    15_B      A    15_B    63.186     0    0.085   0.114    65.161    0.000    0.000
LGA    S    16_B      S    16_B    63.122     0    0.123   0.240    65.191    0.000    0.000
LGA    E    17_B      E    17_B    65.214     0    0.318   0.675    72.936    0.000    0.000
LGA    E    18_B      E    18_B    60.000     0    0.100   0.959    63.965    0.000    0.000
LGA    V    19_B      V    19_B    54.377     0    0.106   0.148    56.783    0.000    0.000
LGA    G    20_B      G    20_B    57.117     0    0.230   0.230    57.117    0.000    0.000
LGA    A    21_B      A    21_B    56.535     0    0.055   0.053    58.065    0.000    0.000
LGA    L    22_B      L    22_B    49.218     0    0.108   1.391    52.116    0.000    0.000
LGA    Y    23_B      Y    23_B    47.863     0    0.155   1.373    49.237    0.000    0.000
LGA    D    24_B      D    24_B    53.110     0    0.089   1.116    58.814    0.000    0.000
LGA    R    25_B      R    25_B    48.742     0    0.028   1.385    53.017    0.000    0.000
LGA    F    26_B      F    26_B    41.846     0    0.182   0.882    44.640    0.000    0.000
LGA    T    27_B      T    27_B    42.387     0    0.420   0.961    45.129    0.000    0.000
LGA    A    28_B      A    28_B    42.531     0    0.754   0.683    44.753    0.000    0.000
LGA    L    29_B      L    29_B    37.599     0    0.297   1.361    39.979    0.000    0.000
LGA    G    30_B      G    30_B    33.299     0    0.206   0.206    35.235    0.000    0.000
LGA    A    31_B      A    31_B    33.351     0    0.126   0.134    35.121    0.000    0.000
LGA    A    32_B      A    32_B    33.493     0    0.619   0.558    34.322    0.000    0.000
LGA    S    33_B      S    33_B    32.554     0    0.176   0.692    32.661    0.000    0.000
LGA    L    34_B      L    34_B    32.865     0    0.537   1.313    33.748    0.000    0.000
LGA    G    35_B      G    35_B    33.455     0    0.641   0.641    33.621    0.000    0.000
LGA    E    36_B      E    36_B    33.899     0    0.645   0.569    36.276    0.000    0.000
LGA    N    37_B      N    37_B    32.111     0    0.170   0.236    33.321    0.000    0.000
LGA    L    38_B      L    38_B    32.935     0    0.000   0.112    39.969    0.000    0.000
LGA    H    39_B      H    39_B    28.420     0    0.063   1.128    29.607    0.000    0.000
LGA    F    40_B      F    40_B    21.674     0    0.068   1.191    25.996    0.000    0.000
LGA    G    41_B      G    41_B    15.657     0    0.092   0.092    17.425    0.000    0.000
LGA    Y    42_B      Y    42_B    12.774     0    0.287   0.998    19.011    0.833    0.278
LGA    W    43_B      W    43_B     6.249     0    0.650   1.176     8.814   13.571   14.456
LGA    D    44_B      D    44_B     7.476     0    0.650   0.602     9.725    7.976    4.881
LGA    S    45_B      S    45_B     9.140     0    0.037   0.534    11.379    2.143    1.667
LGA    P    46_B      P    46_B    14.870     0    0.019   0.266    16.948    0.000    0.000
LGA    D    47_B      D    47_B    15.935     0    0.046   1.243    17.604    0.000    0.000
LGA    S    48_B      S    48_B    11.117     0    0.116   0.118    12.431    0.238    0.238
LGA    Q    49_B      Q    49_B     7.715     0    0.481   1.176    12.319    8.333    4.656
LGA    V    50_B      V    50_B     4.912     0    0.216   0.965     7.707   33.095   30.816
LGA    P    51_B      P    51_B     1.742     0    0.109   0.367     3.645   68.929   61.973
LGA    L    52_B      L    52_B     0.933     0    0.044   0.183     1.101   88.214   88.214
LGA    A    53_B      A    53_B     0.917     0    0.100   0.108     1.381   85.952   85.048
LGA    E    54_B      E    54_B     1.426     0    0.053   0.686     4.696   81.429   65.344
LGA    A    55_B      A    55_B     1.370     0    0.062   0.074     1.445   81.429   81.429
LGA    T    56_B      T    56_B     1.068     0    0.040   1.050     2.909   81.548   78.095
LGA    D    57_B      D    57_B     1.680     0    0.125   0.184     1.864   75.000   77.143
LGA    R    58_B      R    58_B     2.195     0    0.013   1.346     8.454   64.762   44.416
LGA    L    59_B      L    59_B     2.145     0    0.017   0.158     2.706   68.810   65.833
LGA    T    60_B      T    60_B     1.672     0    0.036   0.084     1.846   72.857   76.531
LGA    D    61_B      D    61_B     1.906     0    0.013   0.100     2.033   70.833   71.845
LGA    M    62_B      M    62_B     1.861     0    0.065   1.280     4.890   72.857   61.131
LGA    M    63_B      M    63_B     1.770     0    0.043   1.157     5.397   72.857   65.060
LGA    A    64_B      A    64_B     1.951     0    0.033   0.046     2.102   68.810   68.000
LGA    E    65_B      E    65_B     2.254     0    0.051   0.638     3.764   62.857   56.614
LGA    R    66_B      R    66_B     2.653     0    0.119   1.027     4.157   57.143   62.338
LGA    L    67_B      L    67_B     2.235     0    0.088   1.407     4.271   62.857   64.583
LGA    R    68_B      R    68_B     2.255     0    0.065   0.372     5.609   66.786   47.835
LGA    I    69_B      I    69_B     1.158     0    0.183   1.128     2.316   85.952   79.464
LGA    G    70_B      G    70_B     2.015     0    0.148   0.148     2.015   72.976   72.976
LGA    A    71_B      A    71_B     1.702     0    0.053   0.050     1.968   77.143   76.286
LGA    G    72_B      G    72_B     0.553     0    0.049   0.049     0.947   90.476   90.476
LGA    S    73_B      S    73_B     0.988     0    0.101   0.683     1.916   90.476   86.032
LGA    R    74_B      R    74_B     0.553     0    0.066   1.397     4.351   95.238   75.931
LGA    V    75_B      V    75_B     0.158     0    0.018   0.238     0.761  100.000   97.279
LGA    L    76_B      L    76_B     0.341     0    0.037   0.143     0.475  100.000  100.000
LGA    D    77_B      D    77_B     0.531     0    0.110   0.236     1.486   97.619   90.655
LGA    L    78_B      L    78_B     0.621     0    0.039   1.229     2.636   90.476   81.964
LGA    G    79_B      G    79_B     0.766     0    0.287   0.287     1.400   88.214   88.214
LGA    C    80_B      C    80_B     0.820     0    0.084   0.176     1.114   88.214   88.968
LGA    G    81_B      G    81_B     0.568     0    0.072   0.072     0.730   90.476   90.476
LGA    V    82_B      V    82_B     1.035     0    0.023   0.080     1.111   83.690   82.721
LGA    G    83_B      G    83_B     1.038     0    0.029   0.029     1.060   81.429   81.429
LGA    T    84_B      T    84_B     1.219     0    0.028   0.128     1.704   81.429   80.204
LGA    P    85_B      P    85_B     0.821     0    0.086   0.172     1.133   88.214   87.891
LGA    G    86_B      G    86_B     1.190     0    0.062   0.062     1.190   81.429   81.429
LGA    V    87_B      V    87_B     1.176     0    0.094   1.368     4.233   81.429   73.878
LGA    R    88_B      R    88_B     1.363     0    0.013   0.600     1.495   81.429   81.429
LGA    I    89_B      I    89_B     0.959     0    0.025   0.119     1.110   88.214   90.536
LGA    A    90_B      A    90_B     0.657     0    0.027   0.027     0.868   90.476   90.476
LGA    R    91_B      R    91_B     1.371     0    0.024   0.745     2.007   79.286   80.823
LGA    L    92_B      L    92_B     1.480     0    0.059   0.158     1.634   79.286   76.071
LGA    S    93_B      S    93_B     1.307     0    0.058   0.665     2.632   81.429   77.381
LGA    G    94_B      G    94_B     1.274     0    0.176   0.176     1.548   79.286   79.286
LGA    A    95_B      A    95_B     0.787     0    0.046   0.080     0.889   90.476   90.476
LGA    H    96_B      H    96_B     0.467     0    0.018   1.039     4.551   97.619   72.238
LGA    V    97_B      V    97_B     0.084     0    0.062   0.137     0.476  100.000  100.000
LGA    T    98_B      T    98_B     0.390     0    0.050   0.196     0.774  100.000   97.279
LGA    G    99_B      G    99_B     0.478     0    0.021   0.021     0.807   95.238   95.238
LGA    I   100_B      I   100_B     0.890     0    0.015   0.111     0.940   90.476   90.476
LGA    S   101_B      S   101_B     1.245     0    0.019   0.065     1.843   81.429   78.571
LGA    V   102_B      V   102_B     1.425     0    0.010   0.034     1.619   79.286   76.531
LGA    S   103_B      S   103_B     1.468     0    0.073   0.156     1.551   81.429   80.000
LGA    H   104_B      H   104_B     1.220     0    0.035   1.145     2.911   81.429   75.619
LGA    E   105_B      E   105_B     1.133     0    0.036   0.245     2.139   81.429   77.672
LGA    Q   106_B      Q   106_B     1.353     0    0.037   0.142     1.744   81.429   76.667
LGA    V   107_B      V   107_B     1.260     0    0.028   0.063     1.963   85.952   80.340
LGA    V   108_B      V   108_B     0.771     0    0.023   0.038     0.913   92.857   91.837
LGA    R   109_B      R   109_B     0.574     0    0.012   1.364     5.746   95.238   74.719
LGA    A   110_B      A   110_B     0.282     0    0.020   0.026     0.436  100.000  100.000
LGA    N   111_B      N   111_B     0.588     0    0.063   0.138     1.353   92.857   90.536
LGA    A   112_B      A   112_B     0.596     0    0.066   0.069     0.779   90.476   90.476
LGA    L   113_B      L   113_B     0.625     0    0.030   0.157     1.205   90.476   89.345
LGA    A   114_B      A   114_B     0.956     0    0.027   0.028     1.253   85.952   86.857
LGA    E   115_B      E   115_B     1.193     0    0.027   0.868     3.667   81.429   66.720
LGA    E   116_B      E   116_B     1.209     0    0.018   1.273     4.422   81.429   63.862
LGA    A   117_B      A   117_B     1.380     0    0.067   0.063     1.493   81.429   81.429
LGA    G   118_B      G   118_B     1.632     0    0.037   0.037     1.798   75.000   75.000
LGA    L   119_B      L   119_B     0.915     0    0.027   0.079     1.043   88.214   88.214
LGA    A   120_B      A   120_B     1.174     0    0.131   0.150     1.207   81.429   81.429
LGA    D   121_B      D   121_B     1.018     0    0.096   0.729     2.945   85.952   84.107
LGA    R   122_B      R   122_B     0.944     0    0.152   1.085     2.818   92.857   78.095
LGA    A   123_B      A   123_B     0.857     0    0.028   0.031     1.392   85.952   85.048
LGA    R   124_B      R   124_B     0.915     0    0.022   1.504     7.721   90.476   62.641
LGA    F   125_B      F   125_B     0.485     0    0.066   0.146     0.873   92.857   93.939
LGA    Q   126_B      Q   126_B     1.060     0    0.026   0.779     5.480   85.952   67.196
LGA    R   127_B      R   127_B     1.694     0    0.048   0.540     2.669   70.833   67.749
LGA    A   128_B      A   128_B     1.363     0    0.020   0.027     1.420   81.429   81.429
LGA    D   129_B      D   129_B     0.955     0    0.086   0.222     1.284   85.952   83.690
LGA    A   130_B      A   130_B     0.928     0    0.033   0.049     1.048   88.214   86.857
LGA    M   131_B      M   131_B     1.130     0    0.028   1.065     4.200   88.214   75.060
LGA    D   132_B      D   132_B     1.117     0    0.087   0.121     1.538   83.690   81.488
LGA    L   133_B      L   133_B     1.031     0    0.021   0.104     1.402   81.429   85.952
LGA    P   134_B      P   134_B     1.192     0    0.307   0.310     2.164   77.262   84.286
LGA    F   135_B      F   135_B     1.182     0    0.061   0.133     1.319   81.429   88.918
LGA    E   136_B      E   136_B     1.214     0    0.040   0.194     1.367   81.429   81.429
LGA    D   137_B      D   137_B     1.083     0    0.020   0.104     1.829   83.690   80.417
LGA    E   138_B      E   138_B     0.865     0    0.041   0.162     1.027   90.476   89.471
LGA    S   139_B      S   139_B     0.904     0    0.071   0.510     1.512   90.476   86.032
LGA    F   140_B      F   140_B     0.595     0    0.031   0.199     0.986   90.476   91.342
LGA    D   141_B      D   141_B     0.681     0    0.015   0.210     1.229   90.476   87.083
LGA    A   142_B      A   142_B     0.415     0    0.076   0.108     0.639  100.000   98.095
LGA    V   143_B      V   143_B     0.773     0    0.102   1.046     2.412   90.476   83.129
LGA    I   144_B      I   144_B     0.593     0    0.053   0.123     2.029   92.857   85.060
LGA    A   145_B      A   145_B     0.612     0    0.019   0.024     0.651   90.476   90.476
LGA    L   146_B      L   146_B     0.673     0    0.049   1.176     3.128   90.476   83.214
LGA    E   147_B      E   147_B     0.754     0    0.109   0.371     2.600   88.214   78.095
LGA    S   148_B      S   148_B     0.626     0    0.026   0.074     0.799   90.476   90.476
LGA    I   149_B      I   149_B     0.864     0    0.037   1.307     3.843   90.476   75.357
LGA    I   150_B      I   150_B     0.807     0    0.073   1.428     5.330   90.476   73.333
LGA    H   151_B      H   151_B     0.666     0    0.037   1.076     2.491   92.857   82.762
LGA    M   152_B      M   152_B     0.876     0    0.107   0.865     2.707   90.476   80.774
LGA    P   153_B      P   153_B     0.912     0    0.131   0.299     1.726   85.952   84.082
LGA    D   154_B      D   154_B     1.122     0    0.096   0.536     2.623   83.690   76.369
LGA    R   155_B      R   155_B     0.924     0    0.063   0.793     2.935   88.214   78.615
LGA    A   156_B      A   156_B     0.860     0    0.029   0.033     0.923   90.476   90.476
LGA    Q   157_B      Q   157_B     1.152     0    0.035   0.438     3.809   83.690   71.852
LGA    V   158_B      V   158_B     0.956     0    0.033   0.979     2.704   88.214   80.748
LGA    L   159_B      L   159_B     0.765     0    0.029   0.098     0.957   90.476   90.476
LGA    A   160_B      A   160_B     0.855     0    0.050   0.062     1.105   90.476   88.667
LGA    Q   161_B      Q   161_B     0.743     0    0.049   0.170     0.920   90.476   93.651
LGA    V   162_B      V   162_B     0.697     0    0.016   0.080     0.923   90.476   90.476
LGA    G   163_B      G   163_B     0.615     0    0.071   0.071     0.807   90.476   90.476
LGA    R   164_B      R   164_B     0.908     0    0.040   0.132     1.151   88.214   84.719
LGA    V   165_B      V   165_B     0.919     0    0.034   0.058     0.996   90.476   90.476
LGA    L   166_B      L   166_B     0.629     0    0.033   0.207     1.106   90.476   89.345
LGA    R   167_B      R   167_B     0.690     0    0.073   0.199     1.559   90.476   88.874
LGA    P   168_B      P   168_B     1.111     0    0.058   0.320     1.402   81.429   82.721
LGA    G   169_B      G   169_B     1.005     0    0.010   0.010     1.010   85.952   85.952
LGA    G   170_B      G   170_B     0.346     0    0.039   0.039     0.663   97.619   97.619
LGA    R   171_B      R   171_B     0.314     0    0.029   0.994     3.215  100.000   92.857
LGA    L   172_B      L   172_B     0.398     0    0.034   0.067     0.851  100.000   96.429
LGA    V   173_B      V   173_B     0.329     0    0.045   1.108     2.464   95.238   87.211
LGA    L   174_B      L   174_B     1.363     0    0.090   1.095     3.773   83.690   74.643
LGA    T   175_B      T   175_B     1.168     0    0.222   1.101     3.441   81.429   78.231
LGA    D   176_B      D   176_B     1.667     0    0.045   0.897     5.357   72.857   56.726
LGA    F   177_B      F   177_B     1.722     0    0.025   0.391     3.001   79.405   68.095
LGA    F   178_B      F   178_B     1.090     0    0.069   0.311     1.352   83.690   85.541
LGA    E   179_B      E   179_B     0.879     0    0.187   1.224     3.945   85.952   74.868
LGA    R   180_B      R   180_B     2.881     0    0.072   0.934     4.181   53.810   50.909
LGA    A   181_B      A   181_B     3.576     0    0.185   0.251     4.818   43.452   41.048
LGA    P   182_B      P   182_B     4.273     0    0.667   0.574     8.046   26.667   28.707
LGA    L   183_B      L   183_B     5.124     0    0.122   0.329     6.818   23.452   31.131
LGA    A   184_B      A   184_B     8.350     0    0.044   0.049     8.858    6.667    5.905
LGA    P   185_B      P   185_B     9.641     0    0.062   0.107    10.708    0.952    0.544
LGA    E   186_B      E   186_B     9.485     0    0.062   0.983    11.284    2.857    1.852
LGA    G   187_B      G   187_B     6.650     0    0.042   0.042     7.614   14.762   14.762
LGA    R   188_B      R   188_B     6.630     0    0.121   1.042     8.117   14.286   11.126
LGA    A   189_B      A   189_B     7.484     0    0.090   0.094     8.282   12.619   11.048
LGA    A   190_B      A   190_B     5.386     0    0.033   0.034     6.220   25.238   25.429
LGA    V   191_B      V   191_B     5.628     0    0.022   1.040     8.050   21.429   19.116
LGA    Q   192_B      Q   192_B     6.402     0    0.118   0.757     6.809   19.286   20.159
LGA    R   193_B      R   193_B     4.829     0    0.578   0.642     5.491   34.762   55.325
LGA    Y   194_B      Y   194_B     7.544     0    0.058   1.140    15.291   11.071    3.690
LGA    L   195_B      L   195_B    10.181     0    0.037   1.192    16.165    1.071    0.536
LGA    H   196_B      H   196_B     7.882     0    0.034   0.078    13.089    6.786    3.905
LGA    D   197_B      D   197_B     5.649     0    0.058   0.884     7.666   20.357   19.167
LGA    F   198_B      F   198_B     6.867     0    0.338   0.674    10.048    9.048   11.558
LGA    M   199_B      M   199_B    12.832     0    0.496   1.141    17.266    0.000    0.000
LGA    M   200_B      M   200_B    11.608     0    0.661   1.019    13.683    0.000    6.726
LGA    T   201_B      T   201_B    15.752     0    0.571   1.201    18.840    0.000    0.000
LGA    M   202_B      M   202_B    14.613     0    0.173   0.819    17.266    0.000    0.000
LGA    V   203_B      V   203_B    17.334     0    0.020   0.206    17.988    0.000    0.000
LGA    S   204_B      S   204_B    18.862     0    0.057   0.282    21.599    0.000    0.000
LGA    A   205_B      A   205_B    17.315     0    0.545   0.568    18.315    0.000    0.000
LGA    E   206_B      E   206_B    17.011     0    0.687   1.300    19.142    0.000    0.000
LGA    A   207_B      A   207_B    12.152     0    0.607   0.554    13.489    0.000    0.000
LGA    Y   208_B      Y   208_B    10.314     0    0.632   0.726    11.165    0.000    0.278
LGA    P   209_B      P   209_B    10.256     0    0.573   0.598    11.116    0.119    0.068
LGA    P   210_B      P   210_B     8.425     0    0.633   0.616     9.610    9.167    6.735
LGA    L   211_B      L   211_B     2.183     0    0.570   0.677     4.520   55.952   55.536
LGA    L   212_B      L   212_B     1.710     0    0.022   0.048     1.864   72.857   72.857
LGA    R   213_B      R   213_B     1.921     0    0.010   1.411     5.799   72.857   57.273
LGA    G   214_B      G   214_B     1.814     0    0.107   0.107     2.125   70.833   70.833
LGA    A   215_B      A   215_B     1.570     0    0.040   0.046     1.645   75.000   76.286
LGA    G   216_B      G   216_B     1.735     0    0.054   0.054     1.735   77.143   77.143
LGA    L   217_B      L   217_B     1.114     0    0.054   0.196     1.819   83.690   79.345
LGA    W   218_B      W   218_B     0.519     0    0.103   0.822     3.381   95.238   80.986
LGA    L   219_B      L   219_B     1.137     0    0.077   0.144     1.202   81.429   82.560
LGA    E   220_B      E   220_B     1.255     0    0.055   0.721     3.039   79.286   73.228
LGA    E   221_B      E   221_B     1.499     0    0.072   0.992     4.277   79.286   66.720
LGA    F   222_B      F   222_B     2.048     0    0.048   0.323     2.949   66.786   63.420
LGA    L   223_B      L   223_B     1.961     0    0.091   0.146     2.079   70.833   70.833
LGA    D   224_B      D   224_B     2.064     0    0.371   1.267     5.948   68.810   51.786
LGA    I   225_B      I   225_B     1.968     0    0.301   1.270     3.705   72.976   63.571
LGA    S   226_B      S   226_B     2.740     0    0.124   0.550     4.282   62.976   55.397
LGA    D   227_B      D   227_B     2.978     0    0.017   0.349     4.872   55.595   47.202
LGA    Q   228_B      Q   228_B     2.634     0    0.158   1.379     6.777   63.214   42.804
LGA    T   229_B      T   229_B     1.367     0    0.040   1.060     4.719   83.690   68.639
LGA    L   230_B      L   230_B     2.198     0    0.047   1.430     4.859   70.833   63.869
LGA    E   231_B      E   231_B     2.234     0    0.030   0.813     4.395   68.810   56.349
LGA    K   232_B      K   232_B     1.503     0    0.043   0.778     2.572   77.143   72.169
LGA    T   233_B      T   233_B     1.289     0    0.029   0.115     1.492   81.429   81.429
LGA    F   234_B      F   234_B     1.823     0    0.007   1.154     4.337   72.857   65.714
LGA    R   235_B      R   235_B     1.858     0    0.072   0.644     3.869   72.857   61.861
LGA    L   236_B      L   236_B     1.419     0    0.031   0.142     1.626   81.429   80.357
LGA    L   237_B      L   237_B     1.527     0    0.031   1.266     3.815   75.000   64.524
LGA    S   238_B      S   238_B     1.824     0    0.066   0.553     3.271   72.857   69.048
LGA    E   239_B      E   239_B     1.695     0    0.081   1.130     6.659   72.857   54.392
LGA    R   240_B      R   240_B     1.275     0    0.133   1.265     3.724   79.286   72.987
LGA    I   241_B      I   241_B     1.465     0    0.064   1.522     3.886   79.286   69.524
LGA    N   242_B      N   242_B     1.755     0    0.099   1.092     4.097   72.857   69.464
LGA    S   243_B      S   243_B     1.537     0    0.137   0.596     3.045   72.857   70.476
LGA    S   244_B      S   244_B     1.657     0    0.126   0.140     2.173   68.810   71.587
LGA    K   245_B      K   245_B     3.871     0    0.156   1.499    11.061   52.143   27.354
LGA    V   257_B      V   257_B     4.199     0    0.576   1.097     7.140   29.286   29.796
LGA    N   258_B      N   258_B     4.250     0    0.100   1.252     7.527   41.786   31.667

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      237     948    948  100.00    1816   1816  100.00               269
SUMMARY(RMSD_GDC):    15.789         15.663                 15.636           52.314   49.383

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  248  269    4.0    171    1.62    57.249    53.498     9.965

LGA_LOCAL      RMSD:   1.616  Number of atoms:  171  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  17.439  Number of assigned atoms:  237 
Std_ASGN_ATOMS RMSD:  15.789  Standard rmsd on all 237 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.778711 * X  +   0.053851 * Y  +   0.625068 * Z  +  58.689293
  Y_new =  -0.281747 * X  +   0.860176 * Y  +  -0.425107 * Z  +  44.111328
  Z_new =  -0.560561 * X  +  -0.507146 * Y  +  -0.654656 * Z  +  69.833893 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -2.794433  0.595063 -2.482485   [DEG: -160.1092   34.0946 -142.2359 ]
ZXZ:  0.973553  2.284523 -2.306209   [DEG:   55.7805  130.8936 -132.1360 ]
 
# END of job
