
#######################################################
#                                                     #
#                        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  251 ( 2082),  selected  239 , name one
# Molecule2: number of CA atoms  239 ( 1967),  selected  239 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:A  -ch2:A  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    73      62_A - 134_A       5.00    13.99
  LONGEST_CONTINUOUS_SEGMENT:    73      63_A - 135_A       4.92    14.09
  LONGEST_CONTINUOUS_SEGMENT:    73      64_A - 136_A       4.97    14.23
  LCS_AVERAGE:     22.60

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    36      65_A - 100_A       1.99    14.05
  LCS_AVERAGE:      6.45

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    17      66_A - 82_A        1.00    14.88
  LCS_AVERAGE:      3.46

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  239
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     N     2_A     N     2_A      3    8   33      0    4    5    7    7    8   14   18   26   31   41   47   57  118  125  130  134  144  151  159 
LCS_GDT     S     3_A     S     3_A      3    8   36      3    4    5    7   13   21   26   32   47   53   75   98  111  121  152  156  162  170  172  174 
LCS_GDT     T     4_A     T     4_A      3    8   36      3    3    7   14   22   35   62   84   94  104  118  133  142  148  152  159  165  170  173  177 
LCS_GDT     E     5_A     E     5_A      4    9   36      3    4    5    7    9   21   27   34   43   77   87  104  113  140  151  156  164  170  172  177 
LCS_GDT     N     6_A     N     6_A      4    9   36      3    5   10   19   24   34   49   67   83   93  107  125  140  148  152  159  165  170  173  177 
LCS_GDT     K     7_A     K     7_A      4    9   36      3    3    5    7    9   27   49   68   89  107  128  137  143  148  152  159  165  170  173  177 
LCS_GDT     N     8_A     N     8_A      5    9   36      3    5    5    7   10   19   31   48   66   80  104  126  135  144  152  158  165  170  173  177 
LCS_GDT     F     9_A     F     9_A      5    9   36      4    5    5   10   14   23   32   48   66   80   98  124  137  144  152  159  165  170  173  177 
LCS_GDT     V    10_A     V    10_A      5    9   36      4    5    5   10   12   19   29   39   55   76   94  113  130  144  152  158  164  170  173  177 
LCS_GDT     I    11_A     I    11_A      5    9   36      4    5    5    8   14   23   32   48   70   80  102  125  137  145  152  159  165  170  173  177 
LCS_GDT     S    12_A     S    12_A      5    9   36      4    5    5    7   13   16   19   26   47   76   96  122  137  144  152  158  165  170  173  177 
LCS_GDT     I    13_A     I    13_A      5    9   36      3    5    5    7    9    9   13   20   34   49   82   92  137  144  152  159  165  170  173  177 
LCS_GDT     S    14_A     S    14_A      4    7   36      3    4    5    6    7   10   13   27   48   66   93  110  131  139  148  158  163  168  172  177 
LCS_GDT     T    15_A     T    15_A      4    7   36      3    4    5    6    8   11   18   29   48   77  104  129  138  144  152  158  165  168  173  177 
LCS_GDT     A    16_A     A    16_A      5   17   36      4    4   10   23   53   77  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     E    17_A     E    17_A     14   17   36      4    5   12   25   52   76  101  113  123  128  133  137  143  148  152  159  165  170  173  177 
LCS_GDT     Q    18_A     Q    18_A     14   17   36      6   13   13   15   27   56   80   98  122  128  131  137  143  148  152  159  165  170  173  177 
LCS_GDT     R    19_A     R    19_A     14   17   36      4   13   13   27   48   79  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     R    20_A     R    20_A     14   17   36      7   23   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     N    21_A     N    21_A     14   18   36     10   13   20   45   69   82  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     H    22_A     H    22_A     14   18   36     10   13   13   15   40   70   89  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     I    23_A     I    23_A     14   18   36     10   13   26   46   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     I    24_A     I    24_A     14   18   36     10   23   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     E    25_A     E    25_A     14   18   36     10   13   13   30   52   80  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     Q    26_A     Q    26_A     14   18   36     10   13   21   33   51   73   96  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     F    27_A     F    27_A     14   18   36     10   13   33   51   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     T    28_A     T    28_A     14   18   36     10   23   39   52   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     H    29_A     H    29_A     14   18   36     10   13   13   34   48   76  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     Q    30_A     Q    30_A     14   18   36     10   13   26   43   68   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     N    31_A     N    31_A      9   18   36      6   13   26   43   61   82  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     I    32_A     I    32_A      9   18   36      6   13   32   50   68   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     P    33_A     P    33_A      9   18   36      6   13   32   46   68   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     F    34_A     F    34_A      9   18   36      6   19   39   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     E    35_A     E    35_A      9   18   36      4   19   32   51   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     F    36_A     F    36_A      9   18   36      4   19   32   51   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     F    37_A     F    37_A      9   18   36      3   13   38   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     D    38_A     D    38_A      9   18   36      7   16   32   48   62   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     A    39_A     A    39_A      7   17   36      3    5   14   40   67   86  100  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     F    40_A     F    40_A      5   17   36      2    4   11   22   31   49   67   88  109  122  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     T    41_A     T    41_A     12   17   36      4    6   15   22   33   53   68   91  112  123  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     P    42_A     P    42_A     12   17   34      4    8   13   15   19   29   43   55   71   87  103  124  134  144  152  159  164  170  173  177 
LCS_GDT     S    43_A     S    43_A     12   17   31      6    9   13   15   20   26   39   60   73   87  100  113  125  139  149  156  163  170  173  177 
LCS_GDT     D    44_A     D    44_A     12   17   29      4    9   13   15   16   18   23   33   47   63   77   87   97  106  119  133  141  155  163  170 
LCS_GDT     K    45_A     K    45_A     12   17   25      6    9   13   15   16   18   21   22   24   26   28   55   76   94  103  114  126  139  155  165 
LCS_GDT     L    46_A     L    46_A     12   17   25      5    9   13   15   16   18   21   22   28   37   67   80   92  101  109  122  133  150  160  168 
LCS_GDT     T    47_A     T    47_A     12   17   25      5    9   13   15   16   18   21   22   25   35   45   59   67   78   88   98  117  124  137  146 
LCS_GDT     D    48_A     D    48_A     12   17   25      6    9   13   15   16   18   21   22   24   29   36   38   45   49   56   60   71   82   97  123 
LCS_GDT     H    49_A     H    49_A     12   17   25      6    9   13   15   16   18   21   22   24   26   28   29   45   49   56   60   71   75   80   82 
LCS_GDT     L    50_A     L    50_A     12   17   25      6    9   13   15   16   17   21   22   24   29   36   38   45   49   56   60   71   75   80   82 
LCS_GDT     Q    51_A     Q    51_A     12   17   25      4    7   13   15   16   18   21   22   24   26   28   29   33   40   43   48   51   75   80   82 
LCS_GDT     R    52_A     R    52_A     12   17   25      6    9   13   15   16   18   21   22   24   26   28   29   32   40   43   48   51   58   63   67 
LCS_GDT     Y    53_A     Y    53_A     12   17   25      4    7   13   15   16   18   21   22   24   26   28   29   32   35   38   41   51   58   63   67 
LCS_GDT     L    54_A     L    54_A      9   17   25      4    6    9   15   16   18   21   22   24   26   28   29   32   35   37   40   44   50   57   59 
LCS_GDT     P    55_A     P    55_A      4   17   25      3    6   10   12   13   15   18   21   24   26   28   29   32   35   38   41   44   48   57   63 
LCS_GDT     N    56_A     N    56_A      4   17   25      3    4    6    9   13   15   18   22   24   26   28   29   32   35   38   41   52   56   65   69 
LCS_GDT     V    57_A     V    57_A      3   17   25      3    3    3    8   11   15   18   22   24   26   28   29   32   35   38   60   71   75   80   82 
LCS_GDT     A    58_A     A    58_A      3    5   25      2    3    3    5    7    9   15   20   21   25   26   29   32   51   63   73   81  104  115  124 
LCS_GDT     N    59_A     N    59_A      4    5   25      3    5    6    6    7   11   14   18   21   23   25   28   32   37   56   60   81  103  115  123 
LCS_GDT     A    60_A     A    60_A      4    5   25      3    3    6    6    8    9   12   18   21   23   34   37   48   56   88   93   97  118  134  151 
LCS_GDT     A    61_A     A    61_A      4    5   72      3    5    6    6    8    9   12   15   21   29   37   54   67   78   97  111  133  146  158  166 
LCS_GDT     Q    62_A     Q    62_A      4    5   73      3    5    6    6    7    8   11   18   21   29   48   59   81   92  107  128  145  154  164  169 
LCS_GDT     L    63_A     L    63_A      4    5   73      3    3    5   10   11   20   34   51   64   86  103  126  134  145  152  159  164  170  173  177 
LCS_GDT     T    64_A     T    64_A      4    5   73      3    3   11   19   36   60   81  102  114  125  134  137  142  148  152  159  165  170  173  177 
LCS_GDT     M    65_A     M    65_A     13   36   73      3   20   38   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     G    66_A     G    66_A     17   36   73      5   19   36   53   69   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     E    67_A     E    67_A     17   36   73      4   22   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     K    68_A     K    68_A     17   36   73      5   19   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     G    69_A     G    69_A     17   36   73      5   19   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     C    70_A     C    70_A     17   36   73      8   22   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     L    71_A     L    71_A     17   36   73      5   20   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     M    72_A     M    72_A     17   36   73      5   19   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     S    73_A     S    73_A     17   36   73      5   19   39   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     H    74_A     H    74_A     17   36   73      5   19   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     F    75_A     F    75_A     17   36   73      6   22   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     M    76_A     M    76_A     17   36   73      5   19   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     L    77_A     L    77_A     17   36   73      5   19   26   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     W    78_A     W    78_A     17   36   73      5   15   29   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     K    79_A     K    79_A     17   36   73      5   22   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     K    80_A     K    80_A     17   36   73      5   19   25   52   68   86  100  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     C    81_A     C    81_A     17   36   73      3   10   18   29   56   72   90  107  122  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     I    82_A     I    82_A     17   36   73      3   10   17   40   60   80   94  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     D    83_A     D    83_A      6   36   73      3   11   30   48   69   82  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     E    84_A     E    84_A      3   36   73      3    6   16   46   62   79  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     N    85_A     N    85_A     13   36   73      3   10   28   47   69   82  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     L    86_A     L    86_A     14   36   73      6   23   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     D    87_A     D    87_A     14   36   73      8   23   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     Y    88_A     Y    88_A     14   36   73      9   23   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     I    89_A     I    89_A     14   36   73      8   23   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     T    90_A     T    90_A     14   36   73      9   23   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     L    91_A     L    91_A     14   36   73      8   23   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     F    92_A     F    92_A     14   36   73      6   23   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     E    93_A     E    93_A     14   36   73      4   23   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     D    94_A     D    94_A     14   36   73      8   23   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     D    95_A     D    95_A     14   36   73      8   23   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     I    96_A     I    96_A     14   36   73      7   23   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     L    97_A     L    97_A     14   36   73      5   19   39   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     L    98_A     L    98_A     14   36   73      3   10   32   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     G    99_A     G    99_A     14   36   73      3   19   29   51   68   84   96  110  123  128  134  137  142  148  152  159  165  170  173  177 
LCS_GDT     E   100_A     E   100_A     14   36   73      3    8   23   38   54   76   91  110  121  128  131  136  142  148  152  158  165  170  173  177 
LCS_GDT     N   101_A     N   101_A     11   21   73      3    8   20   35   54   76   96  110  121  128  131  136  142  148  152  158  165  170  173  177 
LCS_GDT     A   102_A     A   102_A     11   21   73      6    8   32   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     N   103_A     N   103_A     11   21   73      4    8   12   29   49   76   99  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     K   104_A     K   104_A     11   21   73      4   19   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     F   105_A     F   105_A     11   21   73      4    7   30   50   69   84  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     L   106_A     L   106_A     11   17   73      3    6   18   30   56   75   92  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     A   107_A     A   107_A      6   16   73      3    5    7   10   34   48   66   82  100  123  132  137  143  148  152  159  165  170  173  177 
LCS_GDT     E   108_A     E   108_A      6   16   73      3    5    7   13   31   50   67   84   94  109  126  136  142  148  152  159  165  170  173  177 
LCS_GDT     G   109_A     G   109_A      6   16   73      3    5    6    9   13   18   22   65   78  103  112  127  133  147  152  159  164  170  172  177 
LCS_GDT     D   110_A     D   110_A      3   16   73      3    3    8   12   22   36   52   81   94  105  126  134  142  148  152  159  165  170  173  177 
LCS_GDT     W   111_A     W   111_A      4    6   73      4    4    4    9   16   27   45   82   96  117  126  136  142  148  152  159  165  170  173  177 
LCS_GDT     L   112_A     L   112_A      4    6   73      4    4    4   14   25   40   69   92  113  125  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     K   113_A     K   113_A      4    6   73      4    6    8   22   45   70   88  106  122  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     V   114_A     V   114_A      4    6   73      4    6    9   36   55   76   93  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     R   115_A     R   115_A      4    6   73      3   10   24   41   62   81  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     F   116_A     F   116_A      4    6   73      2    8   17   34   51   66   86  103  117  127  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     N   117_A     N   117_A      3    6   73      3    3    3   14   39   66   86  106  122  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     F   118_A     F   118_A      4    9   73      3    4    5   14   23   30   54   75   86  103  122  134  140  148  152  159  165  170  173  177 
LCS_GDT     Q   119_A     Q   119_A      4    9   73      3    8   12   24   38   50   62   83   98  118  126  134  142  148  152  159  165  170  173  177 
LCS_GDT     E   120_A     E   120_A      4    9   73      3    8   12   25   38   50   62   83   98  118  125  134  142  148  152  159  165  170  173  177 
LCS_GDT     I   121_A     I   121_A      4    9   73      3    4    4    5    7   24   40   60   76   99  122  131  140  146  152  158  165  170  172  177 
LCS_GDT     F   122_A     F   122_A      5    9   73      3   12   32   45   62   82  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     V   123_A     V   123_A      5    9   73      4   19   32   51   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     L   124_A     L   124_A      5    9   73      4   19   36   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     R   125_A     R   125_A      5    9   73      6   19   39   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     L   126_A     L   126_A      5    9   73      3    9   27   52   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     E   127_A     E   127_A      5    8   73      3    7   10   32   65   80  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     T   128_A     T   128_A      3    8   73      3   11   37   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     F   129_A     F   129_A      3    8   73      3    3    4   12   48   80   93  110  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     L   130_A     L   130_A      3    5   73      3    7   22   43   63   82  100  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     M   131_A     M   131_A      4    6   73      3   11   28   47   64   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     P   132_A     P   132_A      4    6   73      3    7   13   20   27   41   50   70   97  113  125  132  137  142  150  156  165  168  173  177 
LCS_GDT     V   133_A     V   133_A      4    6   73      3    3    4    5    7   10   32   37   44   60   77  101  117  123  133  147  153  157  165  169 
LCS_GDT     Q   134_A     Q   134_A      4    6   73      3    3    4   20   24   31   34   59   69   99  113  126  132  138  148  156  161  168  173  177 
LCS_GDT     L   135_A     L   135_A      3    6   73      3    3    4    5    9   24   32   37   44   58   70   86  103  127  133  143  149  155  165  168 
LCS_GDT     E   136_A     E   136_A      3    7   73      1    3    4    6   10   13   32   37   44   56   70   83  103  127  133  140  149  154  159  166 
LCS_GDT     K   137_A     K   137_A      3    7   25      1    3    4    5   10   19   24   46   55   64   71  101  117  130  137  143  153  158  164  168 
LCS_GDT     Q   138_A     Q   138_A      6    7   18      4    5    6    7   10   11   14   17   23   30   40   50   66   86  103  125  137  145  152  161 
LCS_GDT     T   139_A     T   139_A      6    7   17      4    5    6    6    8    8   14   17   25   30   36   53   73   87  103  125  137  145  152  161 
LCS_GDT     Q   140_A     Q   140_A      6    7   17      4    5    6    6    8    8    9   11   11   12   14   14   22   31   49   62   75   80  101  130 
LCS_GDT     I   141_A     I   141_A      6    7   17      4    5    6    6    8    8    9   11   14   14   14   15   16   18   20   35   41   46   51   60 
LCS_GDT     P   142_A     P   142_A      6    7   17      3    5    6    6    8    8   10   11   15   15   15   16   16   18   20   23   25   29   36   42 
LCS_GDT     P   143_A     P   143_A      6    6   17      3    4    6    6    8    8    9   11   15   15   15   16   16   18   19   21   24   29   36   42 
LCS_GDT     F   144_A     F   144_A      3    6   17      3    4    4    5    6    6    9   11   11   12   14   16   16   18   19   21   24   29   36   42 
LCS_GDT     Q   145_A     Q   145_A      3    6   17      3    3    3    5    6    6    8    9   10   12   14   14   15   17   18   21   22   28   33   36 
LCS_GDT     Q   146_A     Q   146_A      3    6   17      3    3    5    6    6    7    9   11   11   12   14   14   26   29   33   44   46   50   62   75 
LCS_GDT     R   147_A     R   147_A      3    6   17      3    3    3    5    6    6    8    9   10   12   14   16   30   31   40   44   46   50   56   66 
LCS_GDT     D   148_A     D   148_A      3    6   17      3    4    4    5    6    6    8    9   10   12   14   17   22   29   34   41   55   71   73   84 
LCS_GDT     I   149_A     I   149_A      3    3   17      3    3    3    3    4    5    9   11   12   26   27   34   43   51   60   85   96  115  131  138 
LCS_GDT     D   150_A     D   150_A      3    3   15      3    3    3    4    6    7   11   16   20   26   27   37   43   61   81   91  113  124  132  140 
LCS_GDT     I   151_A     I   151_A      3    4   28      3    3    4    4    6    7   11   15   20   26   28   37   44   59   84   91  115  124  132  140 
LCS_GDT     L   152_A     L   152_A      3    4   45      3    3    4    4    8   10   14   22   30   36   51   59   76   91  110  124  135  145  152  161 
LCS_GDT     T   153_A     T   153_A      3    7   67      3    3    4    7    9   14   18   24   33   44   55   61   69   82   93  111  119  132  144  153 
LCS_GDT     S   154_A     S   154_A      4    7   68      3    4    5    6    9   14   18   30   41   53   58   65   78  107  119  134  141  148  155  164 
LCS_GDT     K   155_A     K   155_A      4    7   68      3    4    5    5    7    9   17   30   41   53   61   75  101  120  133  139  148  155  160  166 
LCS_GDT     H   156_A     H   156_A      4    7   68      3    4    5   14   24   38   56   89  106  120  128  133  138  145  152  158  165  170  173  177 
LCS_GDT     F   157_A     F   157_A      4    7   68      3    4   10   13   18   29   46   61   84  110  122  130  138  144  152  158  165  170  173  177 
LCS_GDT     G   158_A     G   158_A      4   20   68      3   14   28   52   69   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     T   159_A     T   159_A     11   20   68      3    8   16   33   62   79  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     A   160_A     A   160_A     11   20   68      3   17   25   48   69   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     G   161_A     G   161_A     11   20   68      8   21   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     Y   162_A     Y   162_A     11   20   68      8   19   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     V   163_A     V   163_A     11   20   68      9   23   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     I   164_A     I   164_A     11   20   68      9   23   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     S   165_A     S   165_A     13   20   68      9   23   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     Q   166_A     Q   166_A     13   20   68      9   23   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     G   167_A     G   167_A     13   20   68      6   23   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     A   168_A     A   168_A     13   20   68      5   23   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     A   169_A     A   169_A     13   20   68      5   20   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     K   170_A     K   170_A     13   20   68      9   23   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     Y   171_A     Y   171_A     13   20   68      6   21   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     L   172_A     L   172_A     13   20   68      6   10   32   51   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     I   173_A     I   173_A     13   20   68      4    9   33   51   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     A   174_A     A   174_A     13   20   68      6   10   35   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     L   175_A     L   175_A     13   20   68      6   23   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     F   176_A     F   176_A     13   20   68      6   20   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     E   177_A     E   177_A     13   20   68      6    9   21   48   69   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     K   178_A     K   178_A      3   13   68      3    3    4    9   15   29   50   69   84  100  114  131  143  148  152  159  165  170  173  177 
LCS_GDT     L   179_A     L   179_A      4   12   68      3    5   14   26   47   60   77   96  112  127  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     T   180_A     T   180_A      4   14   68      3    5   14   26   43   59   71   88  109  122  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     T   181_A     T   181_A      4   14   68      3    3    8   17   26   43   61   76   97  117  126  136  143  148  152  159  165  170  173  177 
LCS_GDT     E   182_A     E   182_A      4   14   68      3    4    8   17   23   34   41   65   77   98  118  132  142  146  152  159  164  168  173  177 
LCS_GDT     E   183_A     E   183_A      5   14   68      4    4    8   22   29   44   62   84  103  118  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     I   184_A     I   184_A      5   14   68      4    4    8   12   22   49   65   90  109  122  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     K   185_A     K   185_A      9   14   68      4   14   27   49   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     P   186_A     P   186_A      9   14   68      5   12   37   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     I   187_A     I   187_A      9   14   68      8   23   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     D   188_A     D   188_A      9   14   68      5   11   27   50   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     E   189_A     E   189_A      9   14   68      5   19   37   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     I   190_A     I   190_A      9   14   68      5   23   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     M   191_A     M   191_A      9   14   68      5   13   27   50   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     F   192_A     F   192_A      9   14   68      4   13   26   46   69   85  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     N   193_A     N   193_A      9   14   68      3   10   22   40   61   78   98  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     Q   194_A     Q   194_A      5   12   68      3    7   18   37   60   77   91  112  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     Q   195_A     Q   195_A      4   12   68      3    8   13   34   50   76   91  109  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     I   196_A     I   196_A      4   12   68      3    4    6   12   29   47   58   70   89  106  124  135  143  147  152  159  165  170  173  177 
LCS_GDT     N   197_A     N   197_A      4    7   68      3    4    4    5    6   21   32   46   73   92  124  133  143  148  152  159  165  170  173  177 
LCS_GDT     A   198_A     A   198_A      4    7   68      3    3    4   11   62   81   95  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     T   199_A     T   199_A      3    8   68      3   16   37   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     D   200_A     D   200_A      5    9   68      3   19   30   49   69   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     Y   201_A     Y   201_A      6    9   68      3   20   40   53   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     R   202_A     R   202_A      7    9   68      3    8   26   46   69   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     V   203_A     V   203_A      7    9   68      3   10   26   42   69   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     Y   204_A     Y   204_A      7    9   68      3   10   26   42   69   82  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     Q   205_A     Q   205_A      7    9   68      3   11   27   46   69   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     L   206_A     L   206_A      7    9   68      4   11   31   51   69   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     N   207_A     N   207_A      7    9   68      3    7   14   49   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     P   208_A     P   208_A      7    9   68      3    7   12   40   70   86  101  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     A   209_A     A   209_A      9    9   68      4    7   10   17   35   60   86  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     I   210_A     I   210_A      9    9   68      4    7   10   19   57   80   94  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     C   211_A     C   211_A      9    9   68      4    7   21   40   65   80   95  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     V   212_A     V   212_A      9    9   68      4    7   21   40   65   80   95  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     Q   213_A     Q   213_A      9    9   68      4    7   19   38   65   80   93  109  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     E   214_A     E   214_A      9    9   68      4    7   20   41   65   80   94  107  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     L   215_A     L   215_A      9    9   68      4   10   21   37   58   72   89  101  114  125  130  137  143  148  152  159  165  170  173  177 
LCS_GDT     Q   216_A     Q   216_A      9    9   68      4    6   22   31   54   76   88  101  114  126  130  137  143  148  152  159  165  170  173  177 
LCS_GDT     L   217_A     L   217_A      9    9   68      3    5   23   41   65   80   97  113  123  128  134  137  143  148  152  159  165  170  173  177 
LCS_GDT     N   218_A     N   218_A      3    7   68      3    4   11   22   37   52   83   97  112  122  128  136  143  146  152  157  165  170  173  177 
LCS_GDT     Q   219_A     Q   219_A      3    4   68      3    3    4    4    5    7   19   23   62   73   85   99  117  136  148  156  161  168  173  177 
LCS_GDT     E   220_A     E   220_A      3    4   68      3    4    4    4    4   21   27   30   35   39   70   99  117  123  138  147  161  168  173  177 
LCS_GDT     A   221_A     A   221_A      3    4   68      0    4    4    6    9   13   21   32   42   79   94  114  126  138  148  157  161  168  173  177 
LCS_GDT     S   222_A     S   222_A      3    4   68      3    4    4    4    5    8    9   10   13   18   35   49   74   96  115  131  141  155  164  170 
LCS_GDT     L   223_A     L   223_A      3    4   68      3    3    3    5    5    8    9   10   13   18   28   38   49   61   74   92  121  134  145  156 
LCS_GDT     L   224_A     L   224_A      3    5   17      3    3    3    5    7   10   14   15   21   30   33   42   49   82   89   99  114  139  142  152 
LCS_GDT     V   225_A     V   225_A      3    5   17      3    3    4    5    7    7    9   14   16   19   20   26   33   44   50   82   98  115  122  136 
LCS_GDT     S   226_A     S   226_A      3    5   17      3    3    4    5    7    8   10   12   17   20   22   31   37   62   76   90  104  115  133  141 
LCS_GDT     N   227_A     N   227_A      5   10   17      4    4    8   10   11   11   13   15   21   30   34   43   86   94  101  110  125  150  153  158 
LCS_GDT     L   228_A     L   228_A      5   10   17      4    4    8   10   11   11   14   15   18   20   25   30   35   42   49   85   90  101  116  121 
LCS_GDT     E   229_A     E   229_A      7   10   17      4    6    8   10   11   11   14   15   21   23   27   32   44   54   70   85  107  111  116  121 
LCS_GDT     Q   230_A     Q   230_A      7   10   17      4    6    8   10   11   11   13   15   18   20   23   31   42   48   63   73   82   90  100  111 
LCS_GDT     E   231_A     E   231_A      7   10   17      4    6    7   10   11   11   13   15   18   20   22   22   24   26   30   36   46   53   65   87 
LCS_GDT     R   232_A     R   232_A      7   10   17      4    6    8   10   11   11   13   15   18   20   22   22   24   26   29   31   39   70   82   88 
LCS_GDT     K   233_A     K   233_A      7   10   17      4    6    8   10   11   11   13   15   18   20   22   22   25   36   44   53   65   75   84   92 
LCS_GDT     I   234_A     I   234_A      7   10   17      4    6    8   10   11   11   13   15   18   20   22   22   24   26   27   29   32   48   56   60 
LCS_GDT     N   235_A     N   235_A      7   10   17      3    6    8   10   11   11   13   15   18   20   22   22   24   26   27   29   32   35   37   38 
LCS_GDT     L   236_A     L   236_A      7   10   17      3    4    8   10   11   11   13   15   18   20   22   22   23   26   27   29   32   35   37   38 
LCS_GDT     K   237_A     K   237_A      3    5   17      3    3    4    4    4    7    7   11   18   20   22   22   23   26   27   29   32   35   37   38 
LCS_GDT     Y   238_A     Y   238_A      3    5   17      3    3    5    5    6    8   11   14   18   20   22   22   23   26   27   29   32   35   36   38 
LCS_GDT     E   239_A     E   239_A      3    5   17      3    3    5    6   11   11   13   15   18   20   22   22   23   26   27   29   32   35   37   38 
LCS_GDT     K   240_A     K   240_A      3    5   17      3    3    5    5    5    5   10   10   15   15   15   16   18   18   18   20   21   28   30   34 
LCS_AVERAGE  LCS_A:  10.84  (   3.46    6.45   22.60 )

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     10     23     40     53     70     86    101    113    123    128    134    137    143    148    152    159    165    170    173    177 
GDT PERCENT_AT   4.18   9.62  16.74  22.18  29.29  35.98  42.26  47.28  51.46  53.56  56.07  57.32  59.83  61.92  63.60  66.53  69.04  71.13  72.38  74.06
GDT RMS_LOCAL    0.30   0.67   1.08   1.34   1.69   1.95   2.29   2.49   2.69   2.80   3.18   3.21   3.55   3.76   3.94   4.32   4.44   4.79   4.96   5.10
GDT RMS_ALL_AT  27.38  14.02  14.08  14.05  13.99  14.00  14.01  14.03  14.04  14.06  13.93  13.99  13.92  13.95  13.93  13.89  13.87  13.82  13.70  13.73

# Checking swapping
#   possible swapping detected:  E     5_A      E     5_A
#   possible swapping detected:  F     9_A      F     9_A
#   possible swapping detected:  E    17_A      E    17_A
#   possible swapping detected:  F    27_A      F    27_A
#   possible swapping detected:  F    34_A      F    34_A
#   possible swapping detected:  E    35_A      E    35_A
#   possible swapping detected:  F    36_A      F    36_A
#   possible swapping detected:  F    37_A      F    37_A
#   possible swapping detected:  F    40_A      F    40_A
#   possible swapping detected:  D    48_A      D    48_A
#   possible swapping detected:  Y    53_A      Y    53_A
#   possible swapping detected:  E    67_A      E    67_A
#   possible swapping detected:  E    84_A      E    84_A
#   possible swapping detected:  F    92_A      F    92_A
#   possible swapping detected:  D    94_A      D    94_A
#   possible swapping detected:  E   100_A      E   100_A
#   possible swapping detected:  F   105_A      F   105_A
#   possible swapping detected:  D   110_A      D   110_A
#   possible swapping detected:  E   127_A      E   127_A
#   possible swapping detected:  F   129_A      F   129_A
#   possible swapping detected:  E   136_A      E   136_A
#   possible swapping detected:  F   144_A      F   144_A
#   possible swapping detected:  D   148_A      D   148_A
#   possible swapping detected:  D   150_A      D   150_A
#   possible swapping detected:  F   157_A      F   157_A
#   possible swapping detected:  F   176_A      F   176_A
#   possible swapping detected:  E   177_A      E   177_A
#   possible swapping detected:  E   182_A      E   182_A
#   possible swapping detected:  D   200_A      D   200_A
#   possible swapping detected:  Y   201_A      Y   201_A
#   possible swapping detected:  Y   204_A      Y   204_A
#   possible swapping detected:  E   214_A      E   214_A
#   possible swapping detected:  E   229_A      E   229_A
#   possible swapping detected:  E   239_A      E   239_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    N     2_A      N     2_A    15.152     0    0.273   1.196    22.004    0.000    0.000
LGA    S     3_A      S     3_A    13.357     0    0.258   0.694    16.440    0.000    0.000
LGA    T     4_A      T     4_A     9.947     0    0.582   0.991    10.840    0.238    0.952
LGA    E     5_A      E     5_A    13.177     0    0.628   1.137    20.230    0.119    0.053
LGA    N     6_A      N     6_A     9.947     0    0.336   0.837    12.939    1.548    0.774
LGA    K     7_A      K     7_A     7.820     0    0.076   1.020     8.111    6.548    8.307
LGA    N     8_A      N     8_A     9.270     0    0.626   0.548    12.213    2.619    1.310
LGA    F     9_A      F     9_A     9.491     0    0.069   1.354    10.023    0.952    1.429
LGA    V    10_A      V    10_A    10.175     0    0.242   1.194    13.969    0.238    0.136
LGA    I    11_A      I    11_A     9.404     0    0.036   1.173    12.962    1.190    0.655
LGA    S    12_A      S    12_A     9.411     0    0.046   0.608    11.574    1.429    1.032
LGA    I    13_A      I    13_A     9.675     0    0.037   0.965    13.555    2.381    1.190
LGA    S    14_A      S    14_A     8.862     0    0.671   0.705    12.091    2.500    1.667
LGA    T    15_A      T    15_A     8.029     0    0.679   0.895     9.844    6.905    5.102
LGA    A    16_A      A    16_A     3.440     0    0.562   0.619     4.573   48.929   50.571
LGA    E    17_A      E    17_A     3.486     0    0.133   1.185     8.824   51.786   32.275
LGA    Q    18_A      Q    18_A     4.726     0    0.165   0.725    10.680   37.262   20.423
LGA    R    19_A      R    19_A     3.969     0    0.136   1.033    14.195   48.452   22.121
LGA    R    20_A      R    20_A     1.313     0    0.058   1.204    12.006   83.690   43.247
LGA    N    21_A      N    21_A     3.032     0    0.056   1.277     8.548   59.286   37.262
LGA    H    22_A      H    22_A     4.236     0    0.037   0.457     8.037   43.452   25.048
LGA    I    23_A      I    23_A     3.245     0    0.086   0.732     7.592   57.262   42.143
LGA    I    24_A      I    24_A     1.157     0    0.079   0.646     3.336   88.214   70.952
LGA    E    25_A      E    25_A     3.162     0    0.072   0.688     7.878   55.714   34.550
LGA    Q    26_A      Q    26_A     4.044     0    0.028   1.076     9.639   45.119   25.185
LGA    F    27_A      F    27_A     3.164     0    0.049   0.156     8.128   57.262   32.251
LGA    T    28_A      T    28_A     1.535     0    0.162   1.088     4.652   79.286   65.102
LGA    H    29_A      H    29_A     3.314     0    0.069   0.648     7.299   53.690   32.571
LGA    Q    30_A      Q    30_A     3.415     0    0.692   1.307     7.645   46.786   31.429
LGA    N    31_A      N    31_A     3.612     0    0.176   0.171     4.992   46.667   39.762
LGA    I    32_A      I    32_A     2.914     0    0.177   1.121     4.932   51.905   47.202
LGA    P    33_A      P    33_A     2.915     0    0.117   0.203     3.492   62.976   58.435
LGA    F    34_A      F    34_A     2.026     0    0.081   0.479     8.331   61.071   35.325
LGA    E    35_A      E    35_A     2.268     0    0.076   1.236     6.911   72.976   49.365
LGA    F    36_A      F    36_A     2.527     0    0.074   0.303     4.986   57.262   48.788
LGA    F    37_A      F    37_A     2.099     0    0.341   0.613     3.184   61.071   66.407
LGA    D    38_A      D    38_A     2.949     0    0.150   1.241     8.123   63.214   37.321
LGA    A    39_A      A    39_A     3.233     0    0.492   0.478     3.933   50.357   51.714
LGA    F    40_A      F    40_A     7.405     0    0.597   1.460    13.476   10.357    3.896
LGA    T    41_A      T    41_A     7.632     0    0.301   0.389    10.509    4.405   14.218
LGA    P    42_A      P    42_A    13.589     0    0.034   0.283    14.916    0.000    0.000
LGA    S    43_A      S    43_A    14.185     0    0.086   0.121    17.419    0.000    0.000
LGA    D    44_A      D    44_A    19.349     0    0.123   1.145    21.590    0.000    0.000
LGA    K    45_A      K    45_A    19.774     0    0.073   0.749    22.588    0.000    0.000
LGA    L    46_A      L    46_A    18.367     0    0.143   0.985    21.340    0.000    0.000
LGA    T    47_A      T    47_A    22.850     0    0.053   0.790    26.279    0.000    0.000
LGA    D    48_A      D    48_A    26.477     0    0.174   1.056    29.224    0.000    0.000
LGA    H    49_A      H    49_A    25.834     0    0.062   0.114    27.600    0.000    0.000
LGA    L    50_A      L    50_A    26.030     0    0.163   1.019    29.257    0.000    0.000
LGA    Q    51_A      Q    51_A    32.277     0    0.065   0.975    35.247    0.000    0.000
LGA    R    52_A      R    52_A    33.728     0    0.063   1.211    37.848    0.000    0.000
LGA    Y    53_A      Y    53_A    32.434     0    0.708   0.705    32.651    0.000    0.000
LGA    L    54_A      L    54_A    32.698     0    0.004   0.908    32.818    0.000    0.000
LGA    P    55_A      P    55_A    32.146     0    0.543   0.537    33.408    0.000    0.000
LGA    N    56_A      N    56_A    31.897     0    0.661   1.085    32.194    0.000    0.000
LGA    V    57_A      V    57_A    26.511     0    0.602   0.909    28.408    0.000    0.000
LGA    A    58_A      A    58_A    22.796     0    0.628   0.614    23.879    0.000    0.000
LGA    N    59_A      N    59_A    24.494     0    0.587   1.226    26.140    0.000    0.000
LGA    A    60_A      A    60_A    21.451     0    0.156   0.171    22.305    0.000    0.000
LGA    A    61_A      A    61_A    19.812     0    0.686   0.622    20.709    0.000    0.000
LGA    Q    62_A      Q    62_A    18.136     0    0.658   1.232    18.935    0.000    0.000
LGA    L    63_A      L    63_A    12.559     0    0.109   0.995    16.285    0.357    0.179
LGA    T    64_A      T    64_A     7.287     0    0.109   0.937     9.592   13.452   10.204
LGA    M    65_A      M    65_A     1.606     0    0.602   1.341     7.059   69.048   55.714
LGA    G    66_A      G    66_A     2.010     0    0.498   0.498     2.010   79.524   79.524
LGA    E    67_A      E    67_A     0.961     0    0.031   0.983     3.276   88.214   78.148
LGA    K    68_A      K    68_A     1.445     0    0.085   1.712     7.143   81.429   63.704
LGA    G    69_A      G    69_A     1.572     0    0.059   0.059     1.572   75.000   75.000
LGA    C    70_A      C    70_A     0.706     0    0.067   0.844     2.503   88.214   85.000
LGA    L    71_A      L    71_A     1.030     0    0.000   1.407     4.219   83.690   70.060
LGA    M    72_A      M    72_A     1.709     0    0.071   1.180     5.408   72.976   61.905
LGA    S    73_A      S    73_A     1.850     0    0.074   0.096     1.850   72.857   72.857
LGA    H    74_A      H    74_A     1.545     0    0.003   1.145     3.819   75.000   71.952
LGA    F    75_A      F    75_A     1.111     0    0.099   0.875     4.237   79.286   68.312
LGA    M    76_A      M    76_A     1.944     0    0.028   0.907     4.629   68.810   59.940
LGA    L    77_A      L    77_A     2.608     0    0.121   0.726     3.536   57.262   55.536
LGA    W    78_A      W    78_A     2.727     0    0.074   1.234     3.955   60.952   58.639
LGA    K    79_A      K    79_A     1.581     0    0.050   1.006     3.229   70.833   69.841
LGA    K    80_A      K    80_A     2.820     0    0.000   0.570     5.662   55.476   44.550
LGA    C    81_A      C    81_A     4.811     0    0.010   0.732     8.408   34.405   27.302
LGA    I    82_A      I    82_A     4.105     0    0.557   1.722     6.809   45.119   40.536
LGA    D    83_A      D    83_A     3.189     0    0.563   0.559     6.980   46.905   34.405
LGA    E    84_A      E    84_A     3.653     0    0.254   0.728    11.034   52.143   26.720
LGA    N    85_A      N    85_A     3.239     0    0.505   1.157     6.158   61.071   42.738
LGA    L    86_A      L    86_A     1.448     0    0.092   1.387     4.175   77.262   68.690
LGA    D    87_A      D    87_A     0.778     0    0.000   0.907     4.005   90.476   76.667
LGA    Y    88_A      Y    88_A     1.079     0    0.049   1.486     7.941   85.952   58.968
LGA    I    89_A      I    89_A     0.771     0    0.044   1.066     2.600   88.214   77.679
LGA    T    90_A      T    90_A     0.542     0    0.143   1.056     3.277   92.857   82.245
LGA    L    91_A      L    91_A     0.516     0    0.049   1.176     5.169   92.857   73.274
LGA    F    92_A      F    92_A     0.757     0    0.082   0.328     1.699   92.857   87.273
LGA    E    93_A      E    93_A     0.519     0    0.051   0.807     2.883   92.857   80.053
LGA    D    94_A      D    94_A     0.659     0    0.242   0.846     2.583   92.857   80.952
LGA    D    95_A      D    95_A     0.750     0    0.237   0.257     1.899   83.810   88.393
LGA    I    96_A      I    96_A     1.096     0    0.074   1.351     4.000   77.381   71.667
LGA    L    97_A      L    97_A     2.358     0    0.082   0.204     2.538   66.786   64.821
LGA    L    98_A      L    98_A     3.248     0    0.634   1.622     4.150   46.786   50.476
LGA    G    99_A      G    99_A     4.165     0    0.277   0.277     4.259   37.143   37.143
LGA    E   100_A      E   100_A     5.028     0    0.602   0.863     8.008   37.976   23.862
LGA    N   101_A      N   101_A     4.713     0    0.112   1.186     5.990   41.190   36.548
LGA    A   102_A      A   102_A     2.284     0    0.060   0.065     3.418   63.095   61.905
LGA    N   103_A      N   103_A     3.624     0    0.091   1.237     5.379   55.714   41.607
LGA    K   104_A      K   104_A     1.270     0    0.085   0.757     2.553   72.976   71.217
LGA    F   105_A      F   105_A     2.960     0    0.069   1.365     4.641   52.857   53.723
LGA    L   106_A      L   106_A     4.371     0    0.007   1.498     7.409   29.643   29.048
LGA    A   107_A      A   107_A     7.368     0    0.106   0.116    10.032    9.048    9.905
LGA    E   108_A      E   108_A     9.007     0    0.147   1.333    10.160    5.357    3.016
LGA    G   109_A      G   109_A    10.457     0    0.082   0.082    10.473    0.238    0.238
LGA    D   110_A      D   110_A     9.369     0    0.581   1.232    14.028    0.952    0.476
LGA    W   111_A      W   111_A     8.070     0    0.468   1.222    10.404   12.262    4.728
LGA    L   112_A      L   112_A     6.375     0    0.034   1.186     7.262   22.619   18.929
LGA    K   113_A      K   113_A     5.032     0    0.063   0.751    10.578   32.024   17.619
LGA    V   114_A      V   114_A     4.528     0    0.697   1.413     6.085   29.286   34.830
LGA    R   115_A      R   115_A     4.004     0    0.075   1.184     6.825   34.524   35.931
LGA    F   116_A      F   116_A     5.998     0    0.484   0.471     7.207   18.690   14.675
LGA    N   117_A      N   117_A     5.715     0    0.604   1.157     9.886   25.357   17.202
LGA    F   118_A      F   118_A     9.535     0    0.696   1.246    13.732    1.786    0.649
LGA    Q   119_A      Q   119_A     9.040     0    0.125   1.091     9.769    1.786    2.381
LGA    E   120_A      E   120_A     8.949     0    0.683   0.845    10.719    2.143    1.376
LGA    I   121_A      I   121_A     8.760     0    0.326   0.770    14.019   11.548    5.774
LGA    F   122_A      F   122_A     3.355     0    0.584   1.418     9.455   44.643   23.723
LGA    V   123_A      V   123_A     2.588     0    0.032   1.050     4.129   53.571   53.333
LGA    L   124_A      L   124_A     2.240     0    0.272   1.333     3.692   70.952   68.393
LGA    R   125_A      R   125_A     1.783     0    0.121   1.444     4.919   66.786   61.602
LGA    L   126_A      L   126_A     2.562     0    0.701   0.599     6.065   59.167   45.000
LGA    E   127_A      E   127_A     3.813     0    0.652   0.604    11.128   45.238   23.175
LGA    T   128_A      T   128_A     3.298     0    0.584   1.196     5.932   56.190   44.150
LGA    F   129_A      F   129_A     4.429     0    0.182   1.403     8.468   38.929   23.117
LGA    L   130_A      L   130_A     3.565     0    0.107   0.287     8.690   43.810   28.333
LGA    M   131_A      M   131_A     3.355     0    0.618   0.880     6.840   35.833   31.071
LGA    P   132_A      P   132_A     8.832     0    0.176   0.379    12.445    4.048    6.259
LGA    V   133_A      V   133_A    12.780     0    0.628   1.371    15.742    0.000    0.000
LGA    Q   134_A      Q   134_A    10.379     0    0.127   1.367    13.336    0.000    0.952
LGA    L   135_A      L   135_A    13.929     0    0.506   1.263    16.124    0.000    0.000
LGA    E   136_A      E   136_A    14.603     0    0.636   1.226    21.342    0.000    0.000
LGA    K   137_A      K   137_A    13.630     0    0.454   0.748    15.529    0.000    0.317
LGA    Q   138_A      Q   138_A    17.877     0    0.639   1.487    19.672    0.000    0.000
LGA    T   139_A      T   139_A    18.361     0    0.027   1.134    19.387    0.000    0.000
LGA    Q   140_A      Q   140_A    19.142     0    0.098   1.318    21.009    0.000    0.000
LGA    I   141_A      I   141_A    21.436     0    0.045   0.643    24.833    0.000    0.000
LGA    P   142_A      P   142_A    23.677     0    0.637   0.740    25.257    0.000    0.000
LGA    P   143_A      P   143_A    26.253     0    0.511   0.523    29.250    0.000    0.000
LGA    F   144_A      F   144_A    26.062     0    0.643   1.540    26.635    0.000    0.000
LGA    Q   145_A      Q   145_A    26.578     0    0.508   1.039    30.771    0.000    0.000
LGA    Q   146_A      Q   146_A    28.588     0    0.433   1.228    32.234    0.000    0.000
LGA    R   147_A      R   147_A    26.981     0    0.599   1.255    32.885    0.000    0.000
LGA    D   148_A      D   148_A    25.057     0    0.620   1.182    25.485    0.000    0.000
LGA    I   149_A      I   149_A    22.931     0    0.534   1.539    24.775    0.000    0.000
LGA    D   150_A      D   150_A    23.791     0    0.597   1.235    25.291    0.000    0.000
LGA    I   151_A      I   151_A    22.390     0    0.622   0.859    23.341    0.000    0.000
LGA    L   152_A      L   152_A    18.195     0    0.279   1.211    19.276    0.000    0.000
LGA    T   153_A      T   153_A    19.386     0    0.596   0.731    23.075    0.000    0.000
LGA    S   154_A      S   154_A    16.361     0    0.573   1.077    17.546    0.000    0.000
LGA    K   155_A      K   155_A    14.002     0    0.117   0.577    24.960    0.000    0.000
LGA    H   156_A      H   156_A     7.666     0    0.475   1.476     9.804    5.476   27.857
LGA    F   157_A      F   157_A     8.106     0    0.433   1.054    14.888   13.690    4.978
LGA    G   158_A      G   158_A     2.015     0    0.356   0.356     3.879   59.524   59.524
LGA    T   159_A      T   159_A     3.517     0    0.451   1.043     7.137   55.595   38.844
LGA    A   160_A      A   160_A     2.426     0    0.464   0.438     3.333   59.167   60.286
LGA    G   161_A      G   161_A     1.462     0    0.178   0.178     2.550   73.214   73.214
LGA    Y   162_A      Y   162_A     1.552     0    0.136   1.320    13.535   81.548   35.198
LGA    V   163_A      V   163_A     0.899     0    0.062   0.126     1.174   90.476   87.891
LGA    I   164_A      I   164_A     0.931     0    0.010   0.123     0.984   90.476   91.667
LGA    S   165_A      S   165_A     1.200     0    0.033   0.122     1.526   85.952   83.016
LGA    Q   166_A      Q   166_A     1.245     0    0.617   0.768     3.893   69.762   63.968
LGA    G   167_A      G   167_A     1.045     0    0.069   0.069     1.045   88.214   88.214
LGA    A   168_A      A   168_A     0.914     0    0.067   0.075     1.142   88.214   88.667
LGA    A   169_A      A   169_A     0.939     0    0.064   0.075     1.338   90.476   88.667
LGA    K   170_A      K   170_A     1.027     0    0.070   0.828     6.527   88.214   63.598
LGA    Y   171_A      Y   171_A     1.676     0    0.042   0.174     6.172   79.286   51.111
LGA    L   172_A      L   172_A     2.047     0    0.000   1.183     3.493   70.833   67.083
LGA    I   173_A      I   173_A     2.312     0    0.068   1.405     5.954   70.833   62.619
LGA    A   174_A      A   174_A     2.479     0    0.111   0.119     3.029   66.786   63.429
LGA    L   175_A      L   175_A     1.892     0    0.000   1.340     7.026   75.000   53.452
LGA    F   176_A      F   176_A     1.315     0    0.138   1.044     3.330   79.286   72.078
LGA    E   177_A      E   177_A     2.861     0    0.529   0.822     4.699   46.190   53.122
LGA    K   178_A      K   178_A     9.107     0    0.355   1.145    16.740    4.524    2.011
LGA    L   179_A      L   179_A     6.287     0    0.091   1.022     7.219   12.619   25.179
LGA    T   180_A      T   180_A     7.415     0    0.404   1.160     9.567    7.143    8.231
LGA    T   181_A      T   181_A     9.411     0    0.158   1.000    10.957    1.548    1.293
LGA    E   182_A      E   182_A    11.244     0    0.116   0.454    12.400    0.000    0.053
LGA    E   183_A      E   183_A     8.765     0    0.487   0.657     9.532    3.214    4.074
LGA    I   184_A      I   184_A     7.169     0    0.065   0.736    11.588   17.381   10.238
LGA    K   185_A      K   185_A     3.007     0    0.071   1.104     5.284   47.143   42.646
LGA    P   186_A      P   186_A     1.857     0    0.116   0.128     2.658   81.667   73.333
LGA    I   187_A      I   187_A     0.967     0    0.056   0.233     2.837   85.952   76.548
LGA    D   188_A      D   188_A     2.299     0    0.043   0.423     2.921   70.833   66.905
LGA    E   189_A      E   189_A     1.810     0    0.248   0.988     3.082   72.976   69.471
LGA    I   190_A      I   190_A     1.481     0    0.119   1.333     2.967   75.119   72.083
LGA    M   191_A      M   191_A     2.301     0    0.046   1.046     3.026   61.190   66.369
LGA    F   192_A      F   192_A     2.900     0    0.046   1.302     7.638   53.810   38.268
LGA    N   193_A      N   193_A     3.643     0    0.138   0.800     4.107   45.000   46.905
LGA    Q   194_A      Q   194_A     4.122     0    0.531   1.399     8.164   41.786   30.317
LGA    Q   195_A      Q   195_A     4.381     0    0.509   1.134     7.398   30.238   28.677
LGA    I   196_A      I   196_A     7.715     0    0.321   0.866    11.751    9.762    4.940
LGA    N   197_A      N   197_A     7.162     0    0.135   1.480     8.745   14.405   12.083
LGA    A   198_A      A   198_A     3.773     0    0.548   0.577     4.274   46.905   44.952
LGA    T   199_A      T   199_A     2.890     0    0.703   0.942     6.958   67.381   50.204
LGA    D   200_A      D   200_A     2.581     0    0.146   1.087     4.947   61.190   48.452
LGA    Y   201_A      Y   201_A     0.994     0    0.148   0.427     8.773   88.214   49.286
LGA    R   202_A      R   202_A     2.177     0    0.059   0.801     4.159   66.786   53.896
LGA    V   203_A      V   203_A     2.547     0    0.066   1.130     4.750   59.048   52.585
LGA    Y   204_A      Y   204_A     2.916     0    0.088   1.244     9.088   55.357   34.405
LGA    Q   205_A      Q   205_A     2.414     0    0.194   1.475     7.209   64.762   43.968
LGA    L   206_A      L   206_A     2.049     0    0.065   1.119     2.772   62.857   62.857
LGA    N   207_A      N   207_A     2.573     0    0.046   0.754     3.790   55.476   54.643
LGA    P   208_A      P   208_A     2.756     0    0.097   0.284     6.835   52.619   38.367
LGA    A   209_A      A   209_A     4.374     0    0.592   0.577     6.504   45.595   39.143
LGA    I   210_A      I   210_A     3.900     0    0.533   1.068     7.405   41.786   32.857
LGA    C   211_A      C   211_A     4.021     0    0.055   0.308     8.273   38.690   29.444
LGA    V   212_A      V   212_A     3.824     0    0.131   1.098     5.594   43.333   41.156
LGA    Q   213_A      Q   213_A     4.473     0    0.243   1.061     7.106   34.286   24.709
LGA    E   214_A      E   214_A     4.659     0    0.076   1.350     5.373   31.429   34.233
LGA    L   215_A      L   215_A     5.923     0    0.036   0.351     9.023   21.548   14.107
LGA    Q   216_A      Q   216_A     5.665     0    0.064   1.157    10.199   23.810   15.926
LGA    L   217_A      L   217_A     3.582     0    0.508   0.441     7.621   35.833   28.036
LGA    N   218_A      N   218_A     7.354     0    0.648   1.067    10.710   12.976    6.726
LGA    Q   219_A      Q   219_A    11.408     0    0.569   1.081    16.337    0.000    0.000
LGA    E   220_A      E   220_A    11.924     0    0.566   0.820    13.413    0.000    0.000
LGA    A   221_A      A   221_A    11.176     0    0.590   0.599    14.160    0.000    0.000
LGA    S   222_A      S   222_A    14.315     0    0.516   0.762    16.833    0.000    0.000
LGA    L   223_A      L   223_A    16.637     0    0.613   0.746    17.903    0.000    0.000
LGA    L   224_A      L   224_A    16.988     0    0.550   0.851    19.570    0.000    0.000
LGA    V   225_A      V   225_A    16.939     0    0.038   1.109    19.902    0.000    0.000
LGA    S   226_A      S   226_A    17.540     0    0.093   0.100    20.827    0.000    0.000
LGA    N   227_A      N   227_A    18.110     0    0.604   1.167    21.463    0.000    0.000
LGA    L   228_A      L   228_A    24.005     0    0.079   1.350    29.057    0.000    0.000
LGA    E   229_A      E   229_A    24.732     0    0.152   1.243    26.825    0.000    0.000
LGA    Q   230_A      Q   230_A    24.255     0    0.171   0.725    27.801    0.000    0.000
LGA    E   231_A      E   231_A    29.702     0    0.041   0.891    32.491    0.000    0.000
LGA    R   232_A      R   232_A    31.973     0    0.052   1.014    33.292    0.000    0.000
LGA    K   233_A      K   233_A    29.712     0    0.033   1.289    31.966    0.000    0.000
LGA    I   234_A      I   234_A    31.598     0    0.082   1.282    34.802    0.000    0.000
LGA    N   235_A      N   235_A    36.284     0    0.623   0.676    39.390    0.000    0.000
LGA    L   236_A      L   236_A    39.023     0    0.612   0.528    43.036    0.000    0.000
LGA    K   237_A      K   237_A    44.552     0    0.417   0.964    47.832    0.000    0.000
LGA    Y   238_A      Y   238_A    45.453     0    0.362   1.415    48.601    0.000    0.000
LGA    E   239_A      E   239_A    46.579     0    0.183   1.027    46.631    0.000    0.000
LGA    K   240_A      K   240_A    48.385     0    0.137   1.123    51.373    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      239     956    956  100.00    1967   1967  100.00               239
SUMMARY(RMSD_GDC):    13.124         13.227                 13.797           34.853   29.474

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  251  239    4.0    113    2.49    36.402    31.146     4.361

LGA_LOCAL      RMSD:   2.491  Number of atoms:  113  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  14.030  Number of assigned atoms:  239 
Std_ASGN_ATOMS RMSD:  13.124  Standard rmsd on all 239 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.145879 * X  +   0.960272 * Y  +   0.237899 * Z  + -301.829681
  Y_new =  -0.931011 * X  +  -0.051930 * Y  +  -0.361278 * Z  + 131.456116
  Z_new =  -0.334571 * X  +  -0.274190 * Y  +   0.901600 * Z  + -211.415573 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -1.726221  0.341150 -0.295227   [DEG:  -98.9052   19.5465  -16.9153 ]
ZXZ:  0.582323  0.447343 -2.257330   [DEG:   33.3646   25.6309 -129.3355 ]
 
# END of job
