
#######################################################
#                                                     #
#                        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  218 ( 1751),  selected  217 , name one
# Molecule2: number of CA atoms  226 ( 1803),  selected  217 , 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:   217      32_B - 248_B       4.52     4.52
  LCS_AVERAGE:     96.02

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   131      39_B - 169_B       2.00     4.67
  LONGEST_CONTINUOUS_SEGMENT:   131      40_B - 170_B       1.99     4.68
  LONGEST_CONTINUOUS_SEGMENT:   131      41_B - 171_B       1.99     4.68
  LCS_AVERAGE:     40.48

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    40      45_B - 84_B        1.00     4.68
  LCS_AVERAGE:     10.51

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  217
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     S    32_B     S    32_B      6   10  217      0    3    9   21   34   75   94  116  139  172  183  187  193  196  199  201  202  205  208  209 
LCS_GDT     P    33_B     P    33_B      6   10  217      3    5    8   12   26   40   55   82  104  121  159  173  187  190  196  199  202  205  208  209 
LCS_GDT     T    34_B     T    34_B      6   38  217      3    5    6   14   20   37   54   69  104  121  146  173  178  188  196  199  202  205  208  209 
LCS_GDT     T    35_B     T    35_B      6   89  217      3    6   14   26   69   90  108  142  166  180  185  190  193  196  199  201  202  205  208  209 
LCS_GDT     S    36_B     S    36_B      6   89  217      5   23   66  105  131  158  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     R    37_B     R    37_B      6   89  217      4   10   20   61   97  143  165  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     D    38_B     D    38_B      6   89  217      4   10   22   79  109  143  165  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     T    39_B     T    39_B      6  131  217      5   10   55   97  127  152  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     F    40_B     F    40_B      6  131  217      5   32   73  111  137  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     E    41_B     E    41_B      5  131  217     10   37   85  120  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     D    42_B     D    42_B      5  131  217      5   11   30   62  108  133  155  173  182  183  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     H    43_B     H    43_B      4  131  217      3    4   44   84  125  148  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     D    44_B     D    44_B     30  131  217      9   49   95  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     T    45_B     T    45_B     40  131  217     17   64   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     C    46_B     C    46_B     40  131  217     24   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     F    47_B     F    47_B     40  131  217     16   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     L    48_B     L    48_B     40  131  217     24   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     G    49_B     G    49_B     40  131  217     14   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     V    50_B     V    50_B     40  131  217     24   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     S    51_B     S    51_B     40  131  217     24   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     L    52_B     L    52_B     40  131  217      6   52   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     E    53_B     E    53_B     40  131  217     15   54   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     N    54_B     N    54_B     40  131  217     15   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     S    55_B     S    55_B     40  131  217     12   50   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     N    56_B     N    56_B     40  131  217      7   46   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     F    57_B     F    57_B     40  131  217      9   45   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     K    58_B     K    58_B     40  131  217      9   46   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     P    59_B     P    59_B     40  131  217      8   41   96  130  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     A    60_B     A    60_B     40  131  217      4   49   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     K    61_B     K    61_B     40  131  217     20   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     V    62_B     V    62_B     40  131  217     21   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     D    63_B     D    63_B     40  131  217     24   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     A    64_B     A    64_B     40  131  217     20   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     M    65_B     M    65_B     40  131  217     20   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     A    66_B     A    66_B     40  131  217     20   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     K    67_B     K    67_B     40  131  217     20   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     W    68_B     W    68_B     40  131  217     20   63   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     I    69_B     I    69_B     40  131  217     20   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     S    70_B     S    70_B     40  131  217     14   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     R    71_B     R    71_B     40  131  217     17   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     R    72_B     R    72_B     40  131  217      6   54   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     F    73_B     F    73_B     40  131  217      6   52   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     S    74_B     S    74_B     40  131  217      4   24   74  118  147  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     Q    75_B     Q    75_B     40  131  217      5   50   96  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     C    76_B     C    76_B     40  131  217     15   64   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     T    77_B     T    77_B     40  131  217     16   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     V    78_B     V    78_B     40  131  217     24   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     L    79_B     L    79_B     40  131  217     21   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     I    80_B     I    80_B     40  131  217     24   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     G    81_B     G    81_B     40  131  217     24   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     D    82_B     D    82_B     40  131  217     20   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     S    83_B     S    83_B     40  131  217     11   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     I    84_B     I    84_B     40  131  217     24   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     H    85_B     H    85_B     38  131  217     15   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     R    86_B     R    86_B     38  131  217     17   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     I    87_B     I    87_B     38  131  217     16   55   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     T    88_B     T    88_B     38  131  217     11   53   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     L    89_B     L    89_B     38  131  217     24   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     E    90_B     E    90_B     38  131  217     16   64   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     S    91_B     S    91_B     38  131  217      3   48   96  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     T    92_B     T    92_B     38  131  217      3    3   30   67  122  154  168  175  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     R    93_B     R    93_B     38  131  217      3   25   65  110  142  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     S    94_B     S    94_B     38  131  217      3   26   65  105  142  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     M    95_B     M    95_B     38  131  217      6    8   30   87  137  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     P    96_B     P    96_B     38  131  217      6   20   65  114  142  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     P    97_B     P    97_B     38  131  217     16   53   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     R    98_B     R    98_B     38  131  217      9   50   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     A    99_B     A    99_B     38  131  217     15   50   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     A   100_B     A   100_B     38  131  217     16   54   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     L   101_B     L   101_B     38  131  217     18   64   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     D   102_B     D   102_B     38  131  217     24   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     D   103_B     D   103_B     38  131  217     16   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     A   104_B     A   104_B     38  131  217     24   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     L   105_B     L   105_B     38  131  217     24   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     R   106_B     R   106_B     38  131  217     20   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     L   107_B     L   107_B     38  131  217     20   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     G   108_B     G   108_B     38  131  217     24   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     R   109_B     R   109_B     38  131  217     20   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     E   110_B     E   110_B     38  131  217     20   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     F   111_B     F   111_B     38  131  217     20   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     V   112_B     V   112_B     38  131  217     20   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     E   113_B     E   113_B     38  131  217     20   45   96  125  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     S   114_B     S   114_B     38  131  217     20   50   96  129  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     R   115_B     R   115_B     38  131  217     24   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     Q   116_B     Q   116_B     38  131  217     14   53   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     P   117_B     P   117_B     38  131  217     20   53   96  129  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     V   118_B     V   118_B     25  131  217     22   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     F   119_B     F   119_B     25  131  217     13   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     E   120_B     E   120_B     25  131  217     12   60   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     S   121_B     S   121_B     25  131  217      9   49   96  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     F   122_B     F   122_B     24  131  217      7   21   76  129  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     R   123_B     R   123_B      4  131  217      6   31   80  128  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     D   124_B     D   124_B      4  131  217      4    9   20   41  106  157  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     R   125_B     R   125_B      4  131  217      3    3   20   40   51   60   94  140  162  179  183  186  191  195  198  201  202  205  208  209 
LCS_GDT     T   126_B     T   126_B      3  131  217      3    4   17   40   61   91  122  158  177  184  186  189  193  196  199  201  202  205  208  209 
LCS_GDT     K   127_B     K   127_B     16  131  217      7   26   63  113  145  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     F   128_B     F   128_B     16  131  217      7   28   71  124  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     T   129_B     T   129_B     17  131  217     12   50   96  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     F   130_B     F   130_B     17  131  217     15   57   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     V   131_B     V   131_B     17  131  217     24   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     T   132_B     T   132_B     17  131  217     24   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     C   133_B     C   133_B     17  131  217     15   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     S   134_B     S   134_B     17  131  217     18   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     E   135_B     E   135_B     17  131  217     17   62   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     V   136_B     V   136_B     19  131  217     15   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     Q   137_B     Q   137_B     19  131  217     13   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     S   138_B     S   138_B     28  131  217     13   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     W   139_B     W   139_B     29  131  217     13   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     G   140_B     G   140_B     29  131  217     14   48   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     L   141_B     L   141_B     29  131  217     15   36   87  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     Y   142_B     Y   142_B     29  131  217     15   36   87  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     G   143_B     G   143_B     29  131  217     18   34   89  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     D   144_B     D   144_B     29  131  217     14   36   89  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     Y   145_B     Y   145_B     29  131  217     18   48   95  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     H   146_B     H   146_B     29  131  217     18   39   91  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     E   147_B     E   147_B     29  131  217     18   37   96  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     R   148_B     R   148_B     29  131  217     21   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     L   149_B     L   149_B     29  131  217     18   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     R   150_B     R   150_B     29  131  217     18   31   95  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     Q   151_B     Q   151_B     29  131  217     18   26   96  129  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     H   152_B     H   152_B     29  131  217     18   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     Y   153_B     Y   153_B     29  131  217     18   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     D   154_B     D   154_B     29  131  217     18   26   79  124  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     Q   155_B     Q   155_B     29  131  217     18   43   94  124  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     D   156_B     D   156_B     29  131  217     20   54   97  124  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     A   157_B     A   157_B     29  131  217     20   54   97  124  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     A   158_B     A   158_B     29  131  217     18   54   97  129  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     F   159_B     F   159_B     29  131  217     21   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     R   160_B     R   160_B     29  131  217     18   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     G   161_B     G   161_B     29  131  217     19   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     S   162_B     S   162_B     29  131  217     24   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     V   163_B     V   163_B     29  131  217     16   49   96  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     E   164_B     E   164_B     29  131  217     12   31   89  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     A   165_B     A   165_B     29  131  217     11   63   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     F   166_B     F   166_B     29  131  217      8   45   91  129  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     G   167_B     G   167_B     29  131  217     20   54   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     R   168_B     R   168_B     29  131  217      8   47   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     D   169_B     D   169_B     12  131  217      8   12   39  108  149  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     Y   170_B     Y   170_B     12  131  217      8   11   18   40  114  153  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     H   171_B     H   171_B     12  131  217      8   11   22   60  130  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     G   172_B     G   172_B     12  130  217      5   11   19   40   96  144  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     K   173_B     K   173_B     12   47  217      8   11   12   20   35   55  125  166  180  184  187  191  193  196  199  201  202  205  208  209 
LCS_GDT     R   174_B     R   174_B     12   28  217      5   11   12   17   22   30   49   67   97  172  184  190  193  196  199  201  202  205  208  209 
LCS_GDT     S   175_B     S   175_B     12   17  217      5   11   12   17   22   35   54  114  156  176  185  190  193  196  199  201  202  205  208  209 
LCS_GDT     E   176_B     E   176_B      5   17  217      3    4    6   11   20   27   39   64   91  126  147  187  193  196  199  201  202  205  208  209 
LCS_GDT     G   177_B     G   177_B      5   16  217      3    4    6   13   19   23   27   35   42   55   64   89  131  147  163  194  199  204  208  209 
LCS_GDT     V   178_B     V   178_B      5   16  217      3    4    7   13   20   27   41   59  103  136  160  174  191  196  199  201  202  205  208  209 
LCS_GDT     S   179_B     S   179_B      4   16  217      3    4    6   11   16   44   55   66   78  128  142  158  179  187  193  198  202  204  208  209 
LCS_GDT     A   180_B     A   180_B      4   16  217      3    4    6   10   19   23   28   75   92  137  152  169  184  190  193  198  202  204  208  209 
LCS_GDT     Q   181_B     Q   181_B      3   16  217      3    3    3    8   19   23   31   75   92  123  150  169  184  192  196  201  202  205  208  209 
LCS_GDT     E   182_B     E   182_B     19   38  217     10   14   36   78  106  142  158  171  181  184  187  191  193  196  199  201  202  205  208  209 
LCS_GDT     L   183_B     L   183_B     23   38  217     10   32   74  112  141  159  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     D   184_B     D   184_B     23   38  217     10   21   36   91  124  150  162  173  179  183  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     H   185_B     H   185_B     23   38  217     10   21   49   95  129  153  162  175  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     R   186_B     R   186_B     23   38  217     10   37   88  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     I   187_B     I   187_B     23   38  217     10   39   84  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     R   188_B     R   188_B     23   38  217     10   23   72  108  140  158  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     K   189_B     K   189_B     23   38  217     10   33   87  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     S   190_B     S   190_B     23   38  217     16   60   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     S   191_B     S   191_B     23   38  217     10   38   83  126  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     E   192_B     E   192_B     23   38  217     10   38   85  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     Y   193_B     Y   193_B     23   38  217     12   48   93  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     F   194_B     F   194_B     23   38  217     13   39   86  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     L   195_B     L   195_B     23   38  217     14   39   88  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     E   196_B     E   196_B     23   38  217     14   48   96  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     E   197_B     E   197_B     23   38  217     14   40   96  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     F   198_B     F   198_B     23   38  217     14   39   89  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     A   199_B     A   199_B     23   38  217     14   36   89  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     I   200_B     I   200_B     23   38  217     14   36   89  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     F   201_B     F   201_B     23   38  217     14   36   88  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     A   202_B     A   202_B     23   38  217     14   36   88  130  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     C   203_B     C   203_B     23   38  217     14   40   89  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     L   204_B     L   204_B     23   38  217     12   36   89  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     Q   205_B     Q   205_B     23   38  217      4   18   64  124  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     R   206_B     R   206_B      5   38  217      4   33   78  122  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     T   207_B     T   207_B      5   38  217      5   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     G   208_B     G   208_B     10   38  217      4   34   74  122  148  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     S   209_B     S   209_B     10   38  217      8   49   96  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     P   210_B     P   210_B     10   38  217      5   39   97  125  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     V   211_B     V   211_B     10   38  217     24   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     M   212_B     M   212_B     10   38  217     24   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     V   213_B     V   213_B     10   38  217     24   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     Y   214_B     Y   214_B     10   38  217     24   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     P   215_B     P   215_B     10   38  217     20   60   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     G   216_B     G   216_B     10   38  217      7   53   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     S   217_B     S   217_B     10   38  217     10   53   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     F   218_B     F   218_B      4   38  217      3    4   11   88  134  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     S   219_B     S   219_B      4   38  217      3    5    6   34   42  104  162  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     T   220_B     T   220_B      3   12  217      3    5   30   93  128  155  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     L   221_B     L   221_B      4   12  217      4   43   85  125  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     S   222_B     S   222_B      4    6  217      3    4   25   47   69  108  147  167  176  183  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     E   223_B     E   223_B      5    6  217      3    9   31   48   66   97  131  155  173  181  188  191  193  195  199  201  202  205  208  209 
LCS_GDT     I   224_B     I   224_B      5    6  217      4   21   37   49   72  108  141  160  176  183  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     A   225_B     A   225_B      5    6  217      3    4    6   44   59   80  109  144  167  178  188  191  193  195  199  201  202  205  208  209 
LCS_GDT     Q   226_B     Q   226_B      5    6  217      3    4    8   13   19   30   91  120  159  181  188  191  193  195  199  201  202  205  208  209 
LCS_GDT     G   227_B     G   227_B      5    6  217      3    4    7   46   74   92  125  156  176  183  188  191  193  195  199  201  202  205  208  209 
LCS_GDT     K   228_B     K   228_B      4    6  217      3    4    4    9   10   12   16   17   19   38  111  129  157  166  183  189  191  196  198  202 
LCS_GDT     H   229_B     H   229_B      5    8  217      4    5    5    9   10   12   16   17   19   24   28   37   55   99  131  189  189  192  197  205 
LCS_GDT     P   230_B     P   230_B      5    8  217      4    5    5    6    7    8   10   12   13   17   20   76   79   87   96  192  194  197  204  206 
LCS_GDT     G   231_B     G   231_B      5    9  217      4    5    5    6    7    9   10   11   42   51   65   76   79   87   96  192  194  199  204  205 
LCS_GDT     A   232_B     A   232_B      8    9  217      4    8    8    9   10   12   16   17   20   24   65   76   79   89   97  158  184  197  202  205 
LCS_GDT     P   233_B     P   233_B      8    9  217      3    8    8    9   10   12   16   17   19   23   45   51   59   68   74  100  140  150  163  197 
LCS_GDT     E   234_B     E   234_B      8    9  217      6    8    8    9   10   12   25   28   32   35   61   77   85   98  130  168  182  191  195  202 
LCS_GDT     E   235_B     E   235_B      8    9  217      6    8    8    9   10   12   16   17   21   24   28   39   59   68   74   89  129  142  190  197 
LCS_GDT     L   236_B     L   236_B      8    9  217      6    8    8    9   10   12   16   23   25   35   48  101  121  174  185  197  198  202  204  209 
LCS_GDT     R   237_B     R   237_B      8    9  217      6    8    8   12   20   81  104  125  166  180  184  190  193  196  199  201  202  205  208  209 
LCS_GDT     D   238_B     D   238_B      8    9  217      6    8    8   11   18   33   58   73  100  120  149  179  189  190  196  198  202  205  208  209 
LCS_GDT     L   239_B     L   239_B      8   10  217      6    8    8   14   22   62   94  116  166  180  184  190  193  196  199  201  202  205  208  209 
LCS_GDT     I   240_B     I   240_B      9   10  217     24   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     V   241_B     V   241_B      9   10  217     10   64   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     V   242_B     V   242_B      9   10  217     24   65   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     S   243_B     S   243_B      9   10  217     15   54   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     L   244_B     L   244_B      9   10  217     13   63   97  131  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     H   245_B     H   245_B      9   10  217     12   47   93  123  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     L   246_B     L   246_B      9   10  217      5   31   85  123  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     K   247_B     K   247_B      9   10  217      5   31   77  116  148  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_GDT     G   248_B     G   248_B      9   10  217      5   31   83  123  150  160  168  178  182  184  188  191  193  196  199  201  202  205  208  209 
LCS_AVERAGE  LCS_A:  49.00  (  10.51   40.48   96.02 )

GLOBAL_DISTANCE_TEST (summary information about detected largest sets of residues (represented by selected AToms) that can fit under specified thresholds)
GDT DIST_CUTOFF  0.50   1.00   1.50   2.00   2.50   3.00   3.50   4.00   4.50   5.00   5.50   6.00   6.50   7.00   7.50   8.00   8.50   9.00   9.50  10.00
GDT NUMBER_AT     24     65     97    131    150    160    168    178    182    184    188    191    193    196    199    201    202    205    208    209 
GDT PERCENT_AT  10.62  28.76  42.92  57.96  66.37  70.80  74.34  78.76  80.53  81.42  83.19  84.51  85.40  86.73  88.05  88.94  89.38  90.71  92.04  92.48
GDT RMS_LOCAL    0.38   0.70   0.99   1.28   1.45   1.57   1.72   1.97   2.08   2.19   2.42   2.51   2.63   2.85   2.99   3.07   3.14   3.36   3.65   3.72
GDT RMS_ALL_AT   4.73   4.70   4.66   4.78   4.73   4.74   4.74   4.67   4.65   4.65   4.70   4.68   4.65   4.59   4.59   4.60   4.57   4.57   4.57   4.56

# Checking swapping
#   possible swapping detected:  F    40_B      F    40_B
#   possible swapping detected:  F    57_B      F    57_B
#   possible swapping detected:  D    63_B      D    63_B
#   possible swapping detected:  E   113_B      E   113_B
#   possible swapping detected:  E   120_B      E   120_B
#   possible swapping detected:  F   122_B      F   122_B
#   possible swapping detected:  F   128_B      F   128_B
#   possible swapping detected:  F   130_B      F   130_B
#   possible swapping detected:  Y   142_B      Y   142_B
#   possible swapping detected:  E   147_B      E   147_B
#   possible swapping detected:  Y   153_B      Y   153_B
#   possible swapping detected:  F   159_B      F   159_B
#   possible swapping detected:  F   166_B      F   166_B
#   possible swapping detected:  Y   170_B      Y   170_B
#   possible swapping detected:  F   218_B      F   218_B
#   possible swapping detected:  E   235_B      E   235_B
#   possible swapping detected:  D   238_B      D   238_B

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    S    32_B      S    32_B     7.777     0    0.036   0.049    10.511    5.476    3.889
LGA    P    33_B      P    33_B     9.858     0    0.021   0.378     9.858    2.024    2.041
LGA    T    34_B      T    34_B    10.585     0    0.059   0.202    12.977    1.071    0.612
LGA    T    35_B      T    35_B     7.756     0    0.106   0.120     9.134   12.143    9.184
LGA    S    36_B      S    36_B     3.944     0    0.332   0.622     5.463   37.500   38.413
LGA    R    37_B      R    37_B     5.333     0    0.184   1.259     7.385   26.190   23.853
LGA    D    38_B      D    38_B     5.175     0    0.440   0.476     6.247   25.000   25.119
LGA    T    39_B      T    39_B     4.459     0    0.223   1.089     6.012   34.286   30.408
LGA    F    40_B      F    40_B     3.437     0    0.216   1.062     9.625   51.905   30.693
LGA    E    41_B      E    41_B     2.714     0    0.072   0.638     4.283   48.690   56.032
LGA    D    42_B      D    42_B     5.560     0    0.000   0.298     7.893   26.548   18.333
LGA    H    43_B      H    43_B     4.258     0    0.573   0.619    12.268   47.262   20.952
LGA    D    44_B      D    44_B     1.995     0    0.626   1.143     8.046   70.833   42.500
LGA    T    45_B      T    45_B     1.096     0    0.030   1.077     2.816   83.690   79.252
LGA    C    46_B      C    46_B     0.778     0    0.078   0.098     0.787   90.476   90.476
LGA    F    47_B      F    47_B     0.917     0    0.081   1.202     4.188   90.476   75.887
LGA    L    48_B      L    48_B     0.384     0    0.103   0.870     3.684   97.619   81.726
LGA    G    49_B      G    49_B     0.533     0    0.042   0.042     0.562   95.238   95.238
LGA    V    50_B      V    50_B     0.326     0    0.046   0.114     0.967  100.000   97.279
LGA    S    51_B      S    51_B     0.656     0    0.157   0.768     2.189   86.071   83.254
LGA    L    52_B      L    52_B     1.474     0    0.623   0.661     3.678   72.024   74.583
LGA    E    53_B      E    53_B     1.433     0    0.408   0.356     4.152   75.119   60.688
LGA    N    54_B      N    54_B     1.266     0    0.072   1.118     2.676   85.952   81.845
LGA    S    55_B      S    55_B     1.369     0    0.041   0.069     2.071   81.429   77.222
LGA    N    56_B      N    56_B     1.511     0    0.037   0.408     2.450   77.143   73.988
LGA    F    57_B      F    57_B     1.183     0    0.040   0.266     1.284   81.429   87.186
LGA    K    58_B      K    58_B     1.158     0    0.084   0.460     5.655   85.952   60.952
LGA    P    59_B      P    59_B     1.956     0    0.346   0.352     3.052   75.000   69.796
LGA    A    60_B      A    60_B     1.560     0    0.000   0.045     1.757   77.143   76.286
LGA    K    61_B      K    61_B     1.238     0    0.037   0.194     2.018   81.429   77.672
LGA    V    62_B      V    62_B     1.105     0    0.019   0.669     2.130   85.952   81.633
LGA    D    63_B      D    63_B     0.632     0    0.035   0.109     0.854   90.476   91.667
LGA    A    64_B      A    64_B     0.733     0    0.077   0.092     0.886   90.476   90.476
LGA    M    65_B      M    65_B     0.730     0    0.067   0.566     2.171   90.476   81.845
LGA    A    66_B      A    66_B     0.781     0    0.051   0.055     1.137   88.214   88.667
LGA    K    67_B      K    67_B     1.020     0    0.044   0.605     2.034   81.429   78.677
LGA    W    68_B      W    68_B     1.169     0    0.056   1.578     7.666   81.429   59.218
LGA    I    69_B      I    69_B     0.754     0    0.048   0.718     2.854   92.857   87.500
LGA    S    70_B      S    70_B     0.496     0    0.059   0.217     0.940   95.238   93.651
LGA    R    71_B      R    71_B     1.200     0    0.056   1.293     3.843   79.286   73.290
LGA    R    72_B      R    72_B     1.728     0    0.249   1.025     6.618   71.071   50.909
LGA    F    73_B      F    73_B     1.713     0    0.082   0.380     2.037   72.976   73.680
LGA    S    74_B      S    74_B     3.170     0    0.189   0.597     4.160   53.571   51.429
LGA    Q    75_B      Q    75_B     1.728     0    0.113   1.135     5.094   75.119   68.095
LGA    C    76_B      C    76_B     1.036     0    0.068   0.116     1.258   81.429   82.937
LGA    T    77_B      T    77_B     0.990     0    0.000   0.076     1.092   88.214   89.184
LGA    V    78_B      V    78_B     0.519     0    0.084   0.224     1.272   92.857   91.905
LGA    L    79_B      L    79_B     0.626     0    0.045   1.265     3.726   97.619   85.893
LGA    I    80_B      I    80_B     0.443     0    0.071   0.162     0.937   95.238   92.857
LGA    G    81_B      G    81_B     0.518     0    0.063   0.063     1.196   88.214   88.214
LGA    D    82_B      D    82_B     1.248     0    0.027   0.168     2.301   83.690   78.333
LGA    S    83_B      S    83_B     1.169     0    0.109   0.613     2.417   88.333   81.825
LGA    I    84_B      I    84_B     0.396     0    0.065   0.102     1.262   92.857   89.405
LGA    H    85_B      H    85_B     0.948     0    0.032   1.467     4.423   90.476   74.381
LGA    R    86_B      R    86_B     0.583     0    0.032   1.015     2.932   90.476   86.017
LGA    I    87_B      I    87_B     1.013     0    0.089   0.716     3.315   83.690   82.024
LGA    T    88_B      T    88_B     1.284     0    0.049   1.082     3.653   85.952   77.347
LGA    L    89_B      L    89_B     0.379     0    0.000   0.134     0.773   97.619   96.429
LGA    E    90_B      E    90_B     0.686     0    0.214   0.556     2.148   90.595   84.656
LGA    S    91_B      S    91_B     1.597     0    0.043   0.657     3.808   69.048   65.397
LGA    T    92_B      T    92_B     4.078     0    0.057   0.183     5.356   37.619   35.034
LGA    R    93_B      R    93_B     3.380     0    0.496   0.420     4.013   46.786   52.251
LGA    S    94_B      S    94_B     3.580     0    0.039   0.609     5.183   43.333   40.476
LGA    M    95_B      M    95_B     3.740     0    0.101   0.779     6.729   46.667   38.512
LGA    P    96_B      P    96_B     3.240     0    0.046   0.341     3.697   59.405   52.517
LGA    P    97_B      P    97_B     1.475     0    0.099   0.136     2.077   75.119   72.993
LGA    R    98_B      R    98_B     1.811     0    0.000   1.051     7.198   79.405   51.082
LGA    A    99_B      A    99_B     1.512     0    0.040   0.043     1.952   77.143   76.286
LGA    A   100_B      A   100_B     1.110     0    0.069   0.062     1.227   85.952   85.048
LGA    L   101_B      L   101_B     0.474     0    0.026   0.094     0.787   97.619   95.238
LGA    D   102_B      D   102_B     0.242     0    0.044   0.103     1.249   97.619   92.976
LGA    D   103_B      D   103_B     0.716     0    0.056   0.257     2.244   92.857   85.060
LGA    A   104_B      A   104_B     0.396     0    0.077   0.072     0.440  100.000  100.000
LGA    L   105_B      L   105_B     0.680     0    0.017   0.168     1.117   90.595   89.405
LGA    R   106_B      R   106_B     1.233     0    0.041   1.028     4.149   81.548   75.887
LGA    L   107_B      L   107_B     1.142     0    0.073   0.109     1.331   85.952   83.690
LGA    G   108_B      G   108_B     0.830     0    0.047   0.047     1.333   85.952   85.952
LGA    R   109_B      R   109_B     1.427     0    0.035   1.067     7.993   77.143   48.874
LGA    E   110_B      E   110_B     1.611     0    0.043   0.125     1.806   75.000   73.810
LGA    F   111_B      F   111_B     1.428     0    0.000   0.039     1.569   77.143   84.805
LGA    V   112_B      V   112_B     1.629     0    0.045   0.227     1.857   72.857   72.857
LGA    E   113_B      E   113_B     2.288     0    0.072   0.543     4.928   66.786   50.635
LGA    S   114_B      S   114_B     2.118     0    0.052   0.079     2.746   68.810   66.190
LGA    R   115_B      R   115_B     1.068     0    0.098   1.140     5.728   85.952   69.740
LGA    Q   116_B      Q   116_B     1.742     0    0.075   0.840     4.219   75.000   63.757
LGA    P   117_B      P   117_B     2.226     0    0.070   0.101     2.957   68.810   64.898
LGA    V   118_B      V   118_B     0.685     0    0.057   0.112     1.543   92.857   88.027
LGA    F   119_B      F   119_B     0.861     0    0.126   0.133     1.762   83.810   84.762
LGA    E   120_B      E   120_B     1.123     0    0.044   0.717     4.105   85.952   71.270
LGA    S   121_B      S   121_B     1.311     0    0.145   0.151     2.277   77.381   78.730
LGA    F   122_B      F   122_B     2.349     0    0.559   1.307     9.192   70.952   37.489
LGA    R   123_B      R   123_B     2.780     0    0.495   1.103    12.087   55.595   25.455
LGA    D   124_B      D   124_B     3.943     0    0.620   1.160     9.218   32.500   22.619
LGA    R   125_B      R   125_B     8.273     0    0.078   1.574    15.494    7.976    2.900
LGA    T   126_B      T   126_B     7.147     0    0.609   0.604    10.966   13.690    8.095
LGA    K   127_B      K   127_B     3.074     0    0.601   0.681    11.348   55.476   34.392
LGA    F   128_B      F   128_B     2.301     0    0.086   1.241     6.206   59.167   46.970
LGA    T   129_B      T   129_B     1.286     0    0.029   0.055     1.840   85.952   81.565
LGA    F   130_B      F   130_B     0.992     0    0.038   1.300     4.878   90.476   74.416
LGA    V   131_B      V   131_B     0.682     0    0.126   1.044     2.872   86.071   79.524
LGA    T   132_B      T   132_B     0.740     0    0.053   0.133     1.094   90.476   89.184
LGA    C   133_B      C   133_B     0.958     0    0.065   0.754     2.703   92.857   85.000
LGA    S   134_B      S   134_B     0.409     0    0.051   0.218     1.564   95.238   90.714
LGA    E   135_B      E   135_B     1.071     0    0.134   0.200     1.920   81.548   81.534
LGA    V   136_B      V   136_B     1.084     0    0.009   0.077     1.454   83.690   82.721
LGA    Q   137_B      Q   137_B     1.199     0    0.065   0.665     3.333   81.429   74.233
LGA    S   138_B      S   138_B     1.318     0    0.060   0.076     1.528   81.429   78.571
LGA    W   139_B      W   139_B     1.074     0    0.006   1.266     5.605   83.690   55.748
LGA    G   140_B      G   140_B     1.381     0    0.079   0.079     2.360   77.381   77.381
LGA    L   141_B      L   141_B     2.249     0    0.187   0.592     4.086   66.786   56.845
LGA    Y   142_B      Y   142_B     2.247     0    0.021   0.106     2.323   64.762   68.135
LGA    G   143_B      G   143_B     2.388     0    0.045   0.045     2.388   64.762   64.762
LGA    D   144_B      D   144_B     2.426     0    0.022   0.097     3.694   66.905   58.512
LGA    Y   145_B      Y   145_B     1.689     0    0.006   0.629     2.875   75.000   70.952
LGA    H   146_B      H   146_B     1.867     0    0.000   1.029     4.235   72.857   67.333
LGA    E   147_B      E   147_B     1.620     0    0.000   1.124     3.551   77.143   68.254
LGA    R   148_B      R   148_B     0.473     0    0.031   0.838     3.090   97.619   81.515
LGA    L   149_B      L   149_B     0.748     0    0.000   1.068     4.790   90.476   73.631
LGA    R   150_B      R   150_B     1.666     0    0.059   0.804     4.001   75.000   63.463
LGA    Q   151_B      Q   151_B     1.749     0    0.058   1.039     6.959   75.000   55.979
LGA    H   152_B      H   152_B     0.926     0    0.024   1.194     4.813   85.952   67.619
LGA    Y   153_B      Y   153_B     1.071     0    0.040   0.146     2.831   79.405   71.746
LGA    D   154_B      D   154_B     2.342     0    0.117   0.206     3.000   64.881   61.012
LGA    Q   155_B      Q   155_B     2.444     0    0.208   0.427     3.745   64.762   59.841
LGA    D   156_B      D   156_B     2.192     0    0.059   0.622     3.381   70.952   68.095
LGA    A   157_B      A   157_B     2.131     0    0.124   0.130     2.373   68.810   68.000
LGA    A   158_B      A   158_B     1.678     0    0.029   0.026     2.043   79.405   76.476
LGA    F   159_B      F   159_B     0.583     0    0.027   0.095     1.076   92.976   93.983
LGA    R   160_B      R   160_B     1.098     0    0.033   1.105     4.537   83.690   64.632
LGA    G   161_B      G   161_B     0.857     0    0.060   0.060     0.996   90.476   90.476
LGA    S   162_B      S   162_B     0.360     0    0.032   0.665     1.482   95.238   92.143
LGA    V   163_B      V   163_B     1.439     0    0.049   0.074     2.343   79.405   75.442
LGA    E   164_B      E   164_B     1.973     0    0.173   0.289     4.032   75.000   62.116
LGA    A   165_B      A   165_B     1.260     0    0.048   0.045     1.713   81.548   79.810
LGA    F   166_B      F   166_B     2.075     0    0.022   1.184     9.528   68.810   36.580
LGA    G   167_B      G   167_B     1.496     0    0.090   0.090     1.742   79.405   79.405
LGA    R   168_B      R   168_B     1.229     0    0.017   1.530    10.106   77.857   46.840
LGA    D   169_B      D   169_B     2.722     0    0.122   0.941     5.387   54.286   46.845
LGA    Y   170_B      Y   170_B     3.635     0    0.026   0.193     5.531   43.452   35.675
LGA    H   171_B      H   171_B     3.481     0    0.076   1.480     5.644   40.833   43.429
LGA    G   172_B      G   172_B     4.815     0    0.035   0.035     6.625   27.381   27.381
LGA    K   173_B      K   173_B     6.580     4    0.194   0.210     7.560   12.976    7.672
LGA    R   174_B      R   174_B     8.370     0    0.514   1.564    11.135    4.881    5.281
LGA    S   175_B      S   175_B     8.600     0    0.064   0.494     9.664    2.619    2.619
LGA    E   176_B      E   176_B    10.221     4    0.585   0.548    11.003    0.357    0.159
LGA    G   177_B      G   177_B    14.303     0    0.054   0.054    14.666    0.000    0.000
LGA    V   178_B      V   178_B    11.480     0    0.095   0.110    12.023    0.000    0.136
LGA    S   179_B      S   179_B    13.224     0    0.609   0.785    15.816    0.000    0.000
LGA    A   180_B      A   180_B    12.628     0    0.618   0.596    14.180    0.000    0.000
LGA    Q   181_B      Q   181_B    12.153     0    0.624   1.060    19.570    0.476    0.212
LGA    E   182_B      E   182_B     6.008     0    0.576   1.396     8.467   22.619   21.587
LGA    L   183_B      L   183_B     3.799     0    0.048   1.387     6.394   42.024   37.262
LGA    D   184_B      D   184_B     5.328     0    0.048   0.107     7.135   27.500   21.964
LGA    H   185_B      H   185_B     4.883     0    0.000   1.157     7.050   36.071   28.286
LGA    R   186_B      R   186_B     2.269     0    0.044   1.529     7.148   67.262   50.649
LGA    I   187_B      I   187_B     2.639     0    0.031   0.134     3.844   59.048   52.857
LGA    R   188_B      R   188_B     3.836     0    0.044   0.700     9.093   48.452   24.978
LGA    K   189_B      K   189_B     2.121     0    0.057   1.107     3.414   73.452   64.497
LGA    S   190_B      S   190_B     0.985     0    0.038   0.668     2.936   81.548   77.460
LGA    S   191_B      S   191_B     2.793     0    0.096   0.121     3.617   59.048   53.810
LGA    E   192_B      E   192_B     2.399     0    0.086   0.256     2.765   66.786   62.275
LGA    Y   193_B      Y   193_B     1.790     0    0.000   0.532     3.775   70.833   65.238
LGA    F   194_B      F   194_B     2.265     0    0.000   0.270     2.567   64.762   66.277
LGA    L   195_B      L   195_B     2.112     0    0.017   0.135     2.730   68.810   65.833
LGA    E   196_B      E   196_B     1.425     0    0.044   0.565     1.704   79.286   79.524
LGA    E   197_B      E   197_B     1.668     0    0.044   0.202     2.027   72.857   71.958
LGA    F   198_B      F   198_B     2.055     0    0.025   0.102     2.429   66.786   68.442
LGA    A   199_B      A   199_B     2.346     0    0.039   0.048     2.464   64.762   64.762
LGA    I   200_B      I   200_B     2.089     0    0.044   1.311     4.278   64.762   63.333
LGA    F   201_B      F   201_B     2.425     0    0.071   0.077     2.585   60.952   63.377
LGA    A   202_B      A   202_B     2.531     0    0.015   0.036     2.598   60.952   60.190
LGA    C   203_B      C   203_B     1.966     0    0.110   0.139     2.045   70.833   71.508
LGA    L   204_B      L   204_B     2.216     0    0.072   0.214     3.659   66.786   60.238
LGA    Q   205_B      Q   205_B     2.735     0    0.112   1.186     3.553   59.048   62.063
LGA    R   206_B      R   206_B     2.667     0    0.124   1.311    13.050   64.881   30.433
LGA    T   207_B      T   207_B     1.327     0    0.117   0.145     3.384   79.524   70.000
LGA    G   208_B      G   208_B     2.988     0    0.263   0.263     2.988   61.071   61.071
LGA    S   209_B      S   209_B     1.601     0    0.195   0.583     3.695   70.833   65.238
LGA    P   210_B      P   210_B     2.133     0    0.119   0.270     2.703   72.976   70.680
LGA    V   211_B      V   211_B     0.851     0    0.063   1.208     3.676   88.214   79.864
LGA    M   212_B      M   212_B     0.709     0    0.110   0.759     3.523   90.476   75.357
LGA    V   213_B      V   213_B     0.547     0    0.114   0.190     0.766   90.476   93.197
LGA    Y   214_B      Y   214_B     0.506     0    0.047   0.113     0.962   90.476   93.651
LGA    P   215_B      P   215_B     1.328     0    0.536   0.730     3.917   72.024   74.966
LGA    G   216_B      G   216_B     1.576     0    0.000   0.000     1.576   77.143   77.143
LGA    S   217_B      S   217_B     1.569     0    0.154   0.594     1.835   72.857   75.714
LGA    F   218_B      F   218_B     3.322     0    0.237   1.099     3.753   53.571   51.472
LGA    S   219_B      S   219_B     4.503     0    0.605   0.786     6.741   31.786   26.270
LGA    T   220_B      T   220_B     3.917     0    0.613   0.559     6.954   59.524   41.565
LGA    L   221_B      L   221_B     2.378     0    0.573   0.532     4.629   62.976   55.179
LGA    S   222_B      S   222_B     6.095     0    0.104   0.603     8.182   16.667   14.127
LGA    E   223_B      E   223_B     7.663     0    0.082   1.002     9.591    8.095    5.185
LGA    I   224_B      I   224_B     6.934     0    0.085   1.121     8.508    9.167   15.952
LGA    A   225_B      A   225_B     7.891     0    0.291   0.298     8.928    6.190    5.905
LGA    Q   226_B      Q   226_B     8.250     0    0.418   0.489    10.504    3.690    5.397
LGA    G   227_B      G   227_B     7.764     0    0.191   0.191    11.003    4.286    4.286
LGA    K   228_B      K   228_B    14.337     0    0.152   0.606    21.277    0.000    0.000
LGA    H   229_B      H   229_B    14.371     0    0.556   0.510    20.697    0.000    0.000
LGA    P   230_B      P   230_B    12.520     0    0.016   0.240    14.278    0.000    0.000
LGA    G   231_B      G   231_B    13.292     0    0.070   0.070    14.739    0.000    0.000
LGA    A   232_B      A   232_B    14.713     0    0.553   0.578    14.992    0.000    0.000
LGA    P   233_B      P   233_B    15.998     0    0.132   0.433    18.786    0.000    0.000
LGA    E   234_B      E   234_B    14.367     0    0.116   0.352    17.820    0.000    0.000
LGA    E   235_B      E   235_B    15.389     0    0.199   1.149    22.698    0.000    0.000
LGA    L   236_B      L   236_B    11.415     0    0.062   0.914    14.625    1.548    0.774
LGA    R   237_B      R   237_B     7.366     0    0.031   1.310    15.720   11.071    5.628
LGA    D   238_B      D   238_B     9.009     0    0.138   1.131    13.564    3.452    1.726
LGA    L   239_B      L   239_B     6.976     0    0.591   1.055    12.233   19.524   10.417
LGA    I   240_B      I   240_B     0.178     0    0.625   1.022     5.041   86.548   65.476
LGA    V   241_B      V   241_B     1.209     0    0.020   0.115     2.854   81.548   73.265
LGA    V   242_B      V   242_B     0.505     0    0.078   0.242     0.844   90.476   91.837
LGA    S   243_B      S   243_B     1.389     0    0.193   0.576     3.767   79.286   72.222
LGA    L   244_B      L   244_B     1.334     0    0.060   0.100     2.158   72.976   78.333
LGA    H   245_B      H   245_B     2.186     0    0.045   1.172     6.171   68.810   50.143
LGA    L   246_B      L   246_B     2.290     0    0.027   0.105     2.972   60.952   62.917
LGA    K   247_B      K   247_B     2.587     0    0.031   0.537     3.811   62.857   57.407
LGA    G   248_B      G   248_B     2.310     0    0.523   0.523     3.082   61.071   61.071

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      217     868    868  100.00    1732   1732  100.00               226
SUMMARY(RMSD_GDC):     4.520          4.453                  5.112           60.624   55.298

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  218  226    4.0    178    1.97    63.606    61.233     8.602

LGA_LOCAL      RMSD:   1.969  Number of atoms:  178  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   4.666  Number of assigned atoms:  217 
Std_ASGN_ATOMS RMSD:   4.520  Standard rmsd on all 217 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.503979 * X  +  -0.806658 * Y  +  -0.308719 * Z  + 209.214493
  Y_new =  -0.404028 * X  +  -0.095737 * Y  +   0.909723 * Z  + -87.328209
  Z_new =  -0.763391 * X  +   0.583212 * Y  +  -0.277663 * Z  + 107.496559 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -2.465830  0.868547  2.015136   [DEG: -141.2816   49.7641  115.4588 ]
ZXZ: -2.814432  1.852157 -0.918411   [DEG: -161.2551  106.1208  -52.6211 ]
 
# END of job
