
#######################################################
#                                                     #
#                        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  179 ( 1442),  selected  179 , name one
# Molecule2: number of CA atoms  179 ( 1442),  selected  179 , 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:   179       1_A - 179_A       4.54     4.54
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    68       4_A - 71_A        1.99     5.06
  LCS_AVERAGE:     26.17

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    24     139_A - 162_A       0.97     6.47
  LCS_AVERAGE:      6.06

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  179
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     Q     1_A     Q     1_A      4   12  179      0    4    5   10   15   17   23   26   36   41   58  109  127  144  158  165  170  173  174  176 
LCS_GDT     D     2_A     D     2_A      4   12  179      3    4    6   15   28   71   93  112  131  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     K     3_A     K     3_A      4   59  179      3    4    5   10   15   61   93  112  136  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     P     4_A     P     4_A      4   68  179      3   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     G     5_A     G     5_A      5   68  179      2    4   22   49   86  107  116  129  140  147  151  157  162  164  167  168  170  173  174  176 
LCS_GDT     S     6_A     S     6_A      5   68  179      4    4   25   58   92  107  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     A     7_A     A     7_A      5   68  179      4    4   20   33   75   99  116  129  140  147  151  157  162  164  167  168  170  173  174  176 
LCS_GDT     K     8_A     K     8_A      5   68  179      4   17   32   66   96  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     A     9_A     A     9_A      5   68  179      4    6   31   47   86  104  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     G    10_A     G    10_A      5   68  179      3   14   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     G    11_A     G    11_A      5   68  179      4   14   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     W    12_A     W    12_A      5   68  179      3   17   35   63   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     T    13_A     T    13_A      5   68  179      4   17   40   73   96  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     T    14_A     T    14_A      6   68  179      4   16   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     Y    15_A     Y    15_A      6   68  179      4   24   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     N    16_A     N    16_A      6   68  179      6   28   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     T    17_A     T    17_A      6   68  179      4   24   51   79   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     D    18_A     D    18_A      6   68  179      4   22   50   79   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     N    19_A     N    19_A      6   68  179      4    9   27   69   88  108  118  126  139  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     T    20_A     T    20_A      5   68  179      3    4   29   55   88  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     F    21_A     F    21_A      4   68  179      3    4   34   69   92  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     K    22_A     K    22_A      6   68  179      3    7   56   79   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     G    23_A     G    23_A      8   68  179      1   30   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     G    24_A     G    24_A      8   68  179      2   22   54   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     S    25_A     S    25_A      8   68  179     13   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     Y    26_A     Y    26_A      8   68  179     12   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     A    27_A     A    27_A     10   68  179      8   32   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     K    28_A     K    28_A     10   68  179      4   22   55   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     Y    29_A     Y    29_A     10   68  179      6   16   46   79   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     V    30_A     V    30_A     14   68  179      9   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     L    31_A     L    31_A     15   68  179      4   31   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     S    32_A     S    32_A     15   68  179      4   31   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     P    33_A     P    33_A     15   68  179      4   28   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     N    34_A     N    34_A     16   68  179      4   19   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     L    35_A     L    35_A     16   68  179     13   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     A    36_A     A    36_A     16   68  179      5   32   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     L    37_A     L    37_A     16   68  179      9   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     K    38_A     K    38_A     16   68  179     13   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     G    39_A     G    39_A     16   68  179     13   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     E    40_A     E    40_A     16   68  179     13   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     Y    41_A     Y    41_A     16   68  179     13   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     E    42_A     E    42_A     16   68  179     13   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     W    43_A     W    43_A     16   68  179     13   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     N    44_A     N    44_A     16   68  179      3   29   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     N    45_A     N    45_A     16   68  179      3   31   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     S    46_A     S    46_A     16   68  179      5   24   53   79   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     S    47_A     S    47_A     16   68  179     13   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     L    48_A     L    48_A     16   68  179      3   20   53   79   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     N    49_A     N    49_A     16   68  179      3   19   57   79   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     S    50_A     S    50_A     12   68  179      3   13   38   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     F    51_A     F    51_A     12   68  179     13   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     K    52_A     K    52_A     12   68  179     13   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     A    53_A     A    53_A     12   68  179     13   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     G    54_A     G    54_A     12   68  179      5   33   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     A    55_A     A    55_A     12   68  179     13   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     E    56_A     E    56_A     12   68  179      4   18   33   67   94  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     Y    57_A     Y    57_A     12   68  179     13   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     V    58_A     V    58_A     12   68  179     13   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     A    59_A     A    59_A     12   68  179     13   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     T    60_A     T    60_A     12   68  179     13   32   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     P    61_A     P    61_A     12   68  179      6   24   57   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     Y    62_A     Y    62_A     12   68  179      3    5   32   39   44   60   92  121  138  145  152  157  162  164  167  168  170  173  174  176 
LCS_GDT     L    63_A     L    63_A     12   68  179      4   21   36   63   88  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     K    64_A     K    64_A     12   68  179      4   21   53   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     T    65_A     T    65_A     12   68  179     13   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     E    66_A     E    66_A     12   68  179      9   30   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     V    67_A     V    67_A     12   68  179      9   30   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     M    68_A     M    68_A     10   68  179      2    8   17   36   53   97  116  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     T    69_A     T    69_A      7   68  179      5   31   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     E    70_A     E    70_A      7   68  179      5   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     Y    71_A     Y    71_A      7   68  179      5   21   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     N    72_A     N    72_A      7   66  179      4   13   34   76   92  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     T    73_A     T    73_A      7   66  179      3   18   43   80   95  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     D    74_A     D    74_A      7   66  179      3    8   24   51   68   97  111  124  138  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     N    75_A     N    75_A      7   66  179      3    8   19   29   48   70   85  113  129  143  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     T    76_A     T    76_A      6   66  179      3    6   13   23   38   73   85  113  129  143  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     F    77_A     F    77_A      9   66  179     13   33   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     R    78_A     R    78_A      9   66  179      6   24   56   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     V    79_A     V    79_A      9   66  179      5   21   43   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     T    80_A     T    80_A      9   66  179      4   22   54   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     V    81_A     V    81_A      9   66  179     13   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     V    82_A     V    82_A      9   66  179     13   30   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     T    83_A     T    83_A      9   66  179      6   22   51   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     E    84_A     E    84_A      9   66  179      5   21   36   63   86  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     G    85_A     G    85_A      9   66  179      5   25   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     R    86_A     R    86_A      6   57  179      4    7   32   39   49   87  109  125  138  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     Y    87_A     Y    87_A      6   57  179      4   12   28   36   43   56   77  101  119  136  148  153  159  164  167  168  169  173  174  176 
LCS_GDT     P    88_A     P    88_A      6   52  179      4    5   12   22   33   43   53   61   79   97  118  132  144  155  161  165  169  172  173  176 
LCS_GDT     V    89_A     V    89_A      6   15  179      4    6   10   19   29   39   45   50   60   75   95  118  127  135  150  155  161  167  170  172 
LCS_GDT     D    90_A     D    90_A      6   15  179      3    5   10   19   29   39   45   50   56   63   86  108  127  135  142  149  159  164  168  172 
LCS_GDT     P    91_A     P    91_A      4   12  179      3    3    4   12   30   45   56   62   80   97  118  137  150  158  163  166  169  172  174  176 
LCS_GDT     N    92_A     N    92_A      6   24  179      4    8   13   22   31   42   59   76  103  132  146  154  159  164  167  168  170  173  174  176 
LCS_GDT     L    93_A     L    93_A      7   24  179      5   14   34   44   53   60   70   97  133  144  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     E    94_A     E    94_A     10   24  179      5   16   34   44   54   61   72  114  138  144  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     L    95_A     L    95_A     10   26  179      7   17   34   48   55   61   78  119  138  145  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     F    96_A     F    96_A     10   26  179      7   23   43   49   56   63   87  123  139  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     P    97_A     P    97_A     10   27  179      5   33   43   49   56   65   87  124  139  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     G    98_A     G    98_A     10   27  179      4    9   37   49   56   68   99  124  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     G    99_A     G    99_A     10   27  179      5    9   19   47   56   87  113  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     W   100_A     W   100_A     10   27  179      5    9   15   36   56   79  113  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     Y   101_A     Y   101_A     10   27  179      5    9   15   32   52   90  116  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     T   102_A     T   102_A     10   27  179      5    9   12   18   50   90  116  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     W   103_A     W   103_A     10   27  179      5    8   14   28   54   91  116  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     N   104_A     N   104_A      9   27  179      5    8   14   33   57   96  116  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     N   105_A     N   105_A      9   27  179      5    7   14   36   60   96  116  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     S   106_A     S   106_A      9   27  179      5    8   14   28   57   96  116  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     S   107_A     S   107_A      9   27  179      3    6   31   47   56   76  110  127  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     L   108_A     L   108_A      8   27  179      3   15   34   49   55   61   66   78  111  128  139  155  160  164  167  168  170  173  174  176 
LCS_GDT     N   109_A     N   109_A      8   27  179      3   13   29   41   53   57   63   71   83  125  149  156  162  164  167  168  170  173  174  176 
LCS_GDT     K   110_A     K   110_A     10   27  179      7   23   34   49   55   61   71   95  117  137  151  157  162  164  167  168  170  173  174  176 
LCS_GDT     G   111_A     G   111_A     10   27  179      3    9   29   44   53   66   81  111  129  145  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     A   112_A     A   112_A     10   27  179      7   33   43   49   56   70  102  127  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     P   113_A     P   113_A     10   27  179      7   33   43   49   56   91  116  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     Y   114_A     Y   114_A     10   27  179      7   33   43   49   78  103  116  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     T   115_A     T   115_A     10   27  179      7   33   43   49   56   98  116  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     R   116_A     R   116_A     10   27  179      7   33   43   64   94  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     A   117_A     A   117_A     10   27  179      9   33   43   51   91  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     E   118_A     E   118_A     10   27  179      7   33   43   64   91  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     Y   119_A     Y   119_A     10   27  179      7   33   43   56   91  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     K   120_A     K   120_A      5   27  179      4    9   22   39   48   57   67   97  133  144  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     L   121_A     L   121_A      5   27  179      3    6   13   26   40   48   55   76   99  122  147  154  159  164  167  168  170  173  174  176 
LCS_GDT     T   122_A     T   122_A      5   27  179      3    5   11   19   29   40   48   58   76   96  120  136  153  162  164  168  170  173  174  176 
LCS_GDT     P   123_A     P   123_A      5   27  179      3    5   11   18   23   29   33   40   51   65   71  107  124  138  152  165  169  173  174  176 
LCS_GDT     D   124_A     D   124_A      4   13  179      3    8   13   26   41   52   68  102  130  144  154  156  162  164  167  168  170  173  174  176 
LCS_GDT     L   125_A     L   125_A      6   13  179      5   15   34   59   88  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     K   126_A     K   126_A      7   13  179      9   33   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     L   127_A     L   127_A      7   13  179      9   33   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     L   128_A     L   128_A      7   13  179      7   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     S   129_A     S   129_A      7   13  179     11   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     Q   130_A     Q   130_A      7   13  179      5   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     V   131_A     V   131_A      7   13  179      4   33   44   73   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     V   132_A     V   132_A      7   13  179      6   33   43   53   86  107  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     Y   133_A     Y   133_A      6   13  179      2   13   28   47   55   70  106  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     N   134_A     N   134_A      4   13  179      3    4   10   16   30   45   54   59   73  104  123  141  152  162  167  168  170  173  174  176 
LCS_GDT     T   135_A     T   135_A      4   13  179      3    4   10   15   27   45   51   58   64   86   99  127  142  157  164  166  170  173  174  176 
LCS_GDT     D   136_A     D   136_A      4   13  179      3    6   10   15   24   29   36   51   59   66   79  107  131  147  157  166  170  173  174  176 
LCS_GDT     N   137_A     N   137_A      4   13  179      3    4    4   15   22   29   35   47   54   66   79   92  120  147  161  166  170  173  174  176 
LCS_GDT     T   138_A     T   138_A      3   27  179      3    3    7   16   37   52   75  106  129  144  151  157  162  164  167  168  170  173  174  176 
LCS_GDT     F   139_A     F   139_A     24   38  179      3   33   43   54   91  107  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     K   140_A     K   140_A     24   38  179      5   31   43   74   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     F   141_A     F   141_A     24   38  179      6   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     D   142_A     D   142_A     24   38  179      9   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     T   143_A     T   143_A     24   38  179      9   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     G   144_A     G   144_A     24   38  179      9   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     L   145_A     L   145_A     24   38  179      8   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     E   146_A     E   146_A     24   38  179      7   32   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     Y   147_A     Y   147_A     24   38  179      8   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     K   148_A     K   148_A     24   38  179      3   23   56   76   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     L   149_A     L   149_A     24   38  179      8   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     S   150_A     S   150_A     24   38  179      9   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     P   151_A     P   151_A     24   38  179     13   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     N   152_A     N   152_A     24   38  179      4   33   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     L   153_A     L   153_A     24   38  179      7   33   43   74   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     K   154_A     K   154_A     24   38  179      7   33   48   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     V   155_A     V   155_A     24   38  179      8   33   43   69   96  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     K   156_A     K   156_A     24   38  179      6   33   43   74   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     F   157_A     F   157_A     24   38  179      9   33   43   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     E   158_A     E   158_A     24   38  179      6   33   56   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     Y   159_A     Y   159_A     24   38  179      9   33   43   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     G   160_A     G   160_A     24   38  179      9   31   56   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     W   161_A     W   161_A     24   38  179      7   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     N   162_A     N   162_A     24   38  179      7   34   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     N   163_A     N   163_A     11   38  179      3   14   40   76   92  108  118  128  139  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     S   164_A     S   164_A      5   38  179      3    5   15   31   47   85  110  124  131  144  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     S   165_A     S   165_A      5   38  179      3    4    5   19   83  105  118  128  139  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     L   166_A     L   166_A      7   38  179      5   25   51   79   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     N   167_A     N   167_A      7   38  179     10   30   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     E   168_A     E   168_A      7   38  179      5   21   60   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     F   169_A     F   169_A      7   38  179      5   21   42   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     T   170_A     T   170_A      7   38  179      7   33   43   49   81   99  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     V   171_A     V   171_A      7   38  179      4   23   43   49   67   99  113  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     Q   172_A     Q   172_A      7   38  179      6   33   43   49   57   90  112  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     F   173_A     F   173_A      6   38  179      3   26   43   54   92  107  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     E   174_A     E   174_A      6   38  179      7   31   43   74   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     Y   175_A     Y   175_A      6   38  179      4   21   52   80   97  108  118  129  140  147  154  157  162  164  167  168  170  173  174  176 
LCS_GDT     D   176_A     D   176_A      6   38  179      3    6   25   53   86  107  118  129  140  147  151  157  162  164  167  168  170  173  174  176 
LCS_GDT     L   177_A     L   177_A      6   13  179      3    3    6   20   30   59  101  113  130  140  150  154  160  163  165  168  169  173  174  176 
LCS_GDT     S   178_A     S   178_A      6   13  179      3   16   35   47   75  101  116  129  140  147  151  157  162  164  167  168  170  173  174  176 
LCS_GDT     S   179_A     S   179_A      6   13  179      3    4    6   19   30   52   75  101  119  135  145  150  156  161  165  166  169  171  172  173 
LCS_AVERAGE  LCS_A:  44.08  (   6.06   26.17  100.00 )

GLOBAL_DISTANCE_TEST (summary information about detected largest sets of residues (represented by selected AToms) that can fit under specified thresholds)
GDT DIST_CUTOFF  0.50   1.00   1.50   2.00   2.50   3.00   3.50   4.00   4.50   5.00   5.50   6.00   6.50   7.00   7.50   8.00   8.50   9.00   9.50  10.00
GDT NUMBER_AT     13     34     60     80     97    108    118    129    140    147    154    157    162    164    167    168    170    173    174    176 
GDT PERCENT_AT   7.26  18.99  33.52  44.69  54.19  60.34  65.92  72.07  78.21  82.12  86.03  87.71  90.50  91.62  93.30  93.85  94.97  96.65  97.21  98.32
GDT RMS_LOCAL    0.33   0.74   1.04   1.31   1.54   1.74   1.93   2.33   2.61   2.75   3.10   3.10   3.31   3.42   3.58   3.61   3.86   4.05   4.08   4.23
GDT RMS_ALL_AT   5.26   4.84   4.91   4.92   4.90   4.90   4.85   4.72   4.72   4.69   4.59   4.62   4.60   4.58   4.57   4.57   4.57   4.58   4.57   4.55

# Checking swapping
#   possible swapping detected:  Y    15_A      Y    15_A
#   possible swapping detected:  D    18_A      D    18_A
#   possible swapping detected:  F    21_A      F    21_A
#   possible swapping detected:  E    40_A      E    40_A
#   possible swapping detected:  Y    57_A      Y    57_A
#   possible swapping detected:  Y    62_A      Y    62_A
#   possible swapping detected:  E    66_A      E    66_A
#   possible swapping detected:  Y    87_A      Y    87_A
#   possible swapping detected:  D    90_A      D    90_A
#   possible swapping detected:  E    94_A      E    94_A
#   possible swapping detected:  Y   101_A      Y   101_A
#   possible swapping detected:  Y   114_A      Y   114_A
#   possible swapping detected:  E   118_A      E   118_A
#   possible swapping detected:  Y   119_A      Y   119_A
#   possible swapping detected:  Y   133_A      Y   133_A
#   possible swapping detected:  D   136_A      D   136_A
#   possible swapping detected:  F   141_A      F   141_A
#   possible swapping detected:  E   158_A      E   158_A
#   possible swapping detected:  E   168_A      E   168_A
#   possible swapping detected:  F   173_A      F   173_A
#   possible swapping detected:  E   174_A      E   174_A
#   possible swapping detected:  D   176_A      D   176_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    Q     1_A      Q     1_A    11.307     0    0.548   1.114    18.615    0.119    0.053
LGA    D     2_A      D     2_A     6.437     0    0.197   0.867     7.714   16.786   37.738
LGA    K     3_A      K     3_A     6.096     0    0.578   1.012    11.606   27.143   14.180
LGA    P     4_A      P     4_A     0.641     0    0.117   0.260     3.565   65.833   71.293
LGA    G     5_A      G     5_A     4.164     0    0.641   0.641     4.164   52.262   52.262
LGA    S     6_A      S     6_A     2.938     0    0.049   0.122     4.309   46.905   48.016
LGA    A     7_A      A     7_A     4.341     0    0.062   0.075     6.850   45.119   38.762
LGA    K     8_A      K     8_A     2.925     0    0.187   1.288    12.765   44.167   25.344
LGA    A     9_A      A     9_A     3.725     0    0.081   0.107     6.203   55.595   47.905
LGA    G    10_A      G    10_A     1.533     0    0.217   0.217     2.579   71.071   71.071
LGA    G    11_A      G    11_A     1.598     0    0.115   0.115     2.232   68.810   68.810
LGA    W    12_A      W    12_A     2.300     0    0.283   0.952    13.380   69.524   23.810
LGA    T    13_A      T    13_A     2.917     0    0.260   0.334     7.525   63.214   42.109
LGA    T    14_A      T    14_A     1.022     0    0.392   1.009     5.586   81.548   60.340
LGA    Y    15_A      Y    15_A     1.537     0    0.086   1.135     6.570   81.548   60.476
LGA    N    16_A      N    16_A     2.203     0    0.321   0.593     3.293   61.190   65.119
LGA    T    17_A      T    17_A     2.799     0    0.225   0.887     4.744   55.357   50.476
LGA    D    18_A      D    18_A     2.731     0    0.133   1.241     5.999   59.048   49.405
LGA    N    19_A      N    19_A     3.838     0    0.617   0.961     5.736   40.357   35.357
LGA    T    20_A      T    20_A     3.126     0    0.111   1.238     6.529   50.119   39.592
LGA    F    21_A      F    21_A     3.036     0    0.146   1.318     6.058   57.262   40.260
LGA    K    22_A      K    22_A     2.287     0    0.188   1.159     7.153   55.595   45.556
LGA    G    23_A      G    23_A     2.026     0    0.316   0.316     2.200   66.786   66.786
LGA    G    24_A      G    24_A     2.373     0    0.272   0.272     2.373   70.952   70.952
LGA    S    25_A      S    25_A     0.935     0    0.082   0.135     2.063   85.952   80.238
LGA    Y    26_A      Y    26_A     0.752     0    0.039   0.163     3.050   90.476   77.698
LGA    A    27_A      A    27_A     1.256     0    0.074   0.087     1.445   85.952   85.048
LGA    K    28_A      K    28_A     1.952     0    0.120   0.752     5.050   68.810   53.757
LGA    Y    29_A      Y    29_A     2.503     0    0.231   0.920     8.308   60.952   39.762
LGA    V    30_A      V    30_A     1.277     0    0.105   0.177     2.161   79.286   75.374
LGA    L    31_A      L    31_A     1.703     0    0.105   0.992     3.867   77.143   70.298
LGA    S    32_A      S    32_A     1.478     0    0.073   0.185     2.378   81.429   77.222
LGA    P    33_A      P    33_A     1.794     0    0.046   0.363     2.352   72.976   70.612
LGA    N    34_A      N    34_A     1.840     0    0.408   1.080     6.358   83.929   58.214
LGA    L    35_A      L    35_A     0.999     0    0.162   0.856     1.997   85.952   83.810
LGA    A    36_A      A    36_A     1.562     0    0.073   0.099     2.156   79.286   76.381
LGA    L    37_A      L    37_A     1.399     0    0.086   0.848     2.510   83.690   80.714
LGA    K    38_A      K    38_A     0.965     0    0.039   0.857     4.744   83.690   67.460
LGA    G    39_A      G    39_A     1.292     0    0.098   0.098     1.309   81.429   81.429
LGA    E    40_A      E    40_A     1.495     0    0.102   0.987     2.861   72.976   68.519
LGA    Y    41_A      Y    41_A     1.379     0    0.103   1.298     8.285   79.286   52.738
LGA    E    42_A      E    42_A     1.074     0    0.151   0.820     5.077   81.429   65.714
LGA    W    43_A      W    43_A     0.923     0    0.062   1.139     8.144   81.667   55.408
LGA    N    44_A      N    44_A     2.427     0    0.200   1.143     5.416   57.500   47.083
LGA    N    45_A      N    45_A     2.379     0    0.402   1.144     3.417   61.071   62.083
LGA    S    46_A      S    46_A     1.694     0    0.560   0.760     2.820   68.929   69.048
LGA    S    47_A      S    47_A     1.315     0    0.426   0.598     5.204   79.286   66.746
LGA    L    48_A      L    48_A     1.864     0    0.545   0.965     5.464   71.071   56.964
LGA    N    49_A      N    49_A     2.391     0    0.079   1.252     3.964   61.071   56.488
LGA    S    50_A      S    50_A     2.644     0    0.185   0.236     4.439   66.905   58.016
LGA    F    51_A      F    51_A     1.591     0    0.101   0.536     4.768   75.000   55.671
LGA    K    52_A      K    52_A     0.956     0    0.062   0.751     3.294   83.690   73.598
LGA    A    53_A      A    53_A     1.678     0    0.149   0.207     2.772   77.143   73.143
LGA    G    54_A      G    54_A     1.414     0    0.258   0.258     1.414   85.952   85.952
LGA    A    55_A      A    55_A     0.607     0    0.134   0.161     0.863   90.476   90.476
LGA    E    56_A      E    56_A     2.770     0    0.347   1.322    11.058   77.619   39.101
LGA    Y    57_A      Y    57_A     1.182     0    0.036   1.126     4.739   81.429   70.238
LGA    V    58_A      V    58_A     1.325     0    0.200   1.048     3.860   83.690   74.898
LGA    A    59_A      A    59_A     1.465     0    0.093   0.091     2.122   75.119   73.048
LGA    T    60_A      T    60_A     1.511     0    0.084   0.745     3.270   75.000   69.660
LGA    P    61_A      P    61_A     2.221     0    0.655   0.615     3.817   69.048   60.952
LGA    Y    62_A      Y    62_A     5.912     0    0.284   0.309    12.677   30.357   11.111
LGA    L    63_A      L    63_A     3.289     0    0.113   1.013     4.165   54.167   49.643
LGA    K    64_A      K    64_A     1.882     0    0.073   0.545     5.115   75.119   63.439
LGA    T    65_A      T    65_A     0.642     0    0.096   1.124     3.348   83.810   78.299
LGA    E    66_A      E    66_A     1.483     0    0.211   1.035     4.800   75.119   60.159
LGA    V    67_A      V    67_A     1.307     0    0.081   0.131     2.249   75.119   74.150
LGA    M    68_A      M    68_A     3.943     0    0.446   0.802    10.034   59.405   33.155
LGA    T    69_A      T    69_A     1.073     0    0.104   1.133     4.047   83.690   76.463
LGA    E    70_A      E    70_A     0.671     0    0.093   1.197     5.796   83.810   62.434
LGA    Y    71_A      Y    71_A     1.992     0    0.100   0.359     2.496   70.952   72.262
LGA    N    72_A      N    72_A     3.642     0    0.239   0.672     5.965   36.310   35.536
LGA    T    73_A      T    73_A     3.302     0    0.173   1.030     4.742   46.667   49.660
LGA    D    74_A      D    74_A     5.024     0    0.514   0.560     6.670   24.524   23.810
LGA    N    75_A      N    75_A     6.523     0    0.388   1.045    10.737   12.738    8.274
LGA    T    76_A      T    76_A     6.178     0    0.094   0.855    10.302   32.976   19.728
LGA    F    77_A      F    77_A     2.167     0    0.592   1.237     8.190   59.405   34.286
LGA    R    78_A      R    78_A     2.367     0    0.068   1.003     5.911   64.762   54.242
LGA    V    79_A      V    79_A     2.390     0    0.118   1.174     3.521   60.952   59.524
LGA    T    80_A      T    80_A     1.942     0    0.110   0.262     2.637   77.143   70.748
LGA    V    81_A      V    81_A     1.146     0    0.073   0.080     1.453   81.429   81.429
LGA    V    82_A      V    82_A     1.387     0    0.101   1.103     3.856   81.429   73.605
LGA    T    83_A      T    83_A     2.220     0    0.068   1.001     4.737   59.167   54.626
LGA    E    84_A      E    84_A     3.362     0    0.156   0.442     6.479   57.262   39.153
LGA    G    85_A      G    85_A     1.649     0    0.411   0.411     2.560   64.881   64.881
LGA    R    86_A      R    86_A     5.156     0    0.050   1.508    14.287   24.167   11.645
LGA    Y    87_A      Y    87_A     7.913     0    0.057   1.293    10.428    7.024    4.087
LGA    P    88_A      P    88_A    11.315     0    0.134   0.720    12.384    0.119    0.068
LGA    V    89_A      V    89_A    14.747     0    0.268   1.361    17.924    0.000    0.000
LGA    D    90_A      D    90_A    16.508     0    0.076   1.261    19.312    0.000    0.000
LGA    P    91_A      P    91_A    11.822     0    0.268   0.737    13.444    0.357    0.204
LGA    N    92_A      N    92_A     9.560     0    0.657   0.719    15.167    7.262    3.631
LGA    L    93_A      L    93_A     7.458     0    0.087   1.123     8.840    5.714    7.262
LGA    E    94_A      E    94_A     6.572     0    0.051   1.092    11.119   19.524   11.111
LGA    L    95_A      L    95_A     6.046     0    0.082   0.923     6.754   16.190   22.083
LGA    F    96_A      F    96_A     5.383     0    0.099   1.182    11.908   31.786   15.541
LGA    P    97_A      P    97_A     5.437     0    0.228   0.464     5.620   25.000   27.823
LGA    G    98_A      G    98_A     5.337     0    0.091   0.091     5.337   26.190   26.190
LGA    G    99_A      G    99_A     4.953     0    0.120   0.120     4.953   31.429   31.429
LGA    W   100_A      W   100_A     4.937     0    0.076   0.843     5.095   31.429   42.483
LGA    Y   101_A      Y   101_A     4.698     0    0.065   0.448     4.893   31.429   34.881
LGA    T   102_A      T   102_A     4.647     0    0.070   1.285     6.677   35.833   29.320
LGA    W   103_A      W   103_A     4.592     0    0.094   0.719     8.529   34.286   22.449
LGA    N   104_A      N   104_A     4.707     0    0.125   1.158     5.921   30.119   31.012
LGA    N   105_A      N   105_A     5.077     0    0.041   1.116     7.034   27.500   26.964
LGA    S   106_A      S   106_A     5.038     0    0.110   0.516     6.303   23.810   22.302
LGA    S   107_A      S   107_A     6.536     0    0.135   0.697     8.849    9.524   13.571
LGA    L   108_A      L   108_A     9.746     0    0.093   1.248    15.795    4.048    2.024
LGA    N   109_A      N   109_A     8.973     0    0.095   1.199    10.811    1.190    0.655
LGA    K   110_A      K   110_A     8.212     0    0.077   0.663    13.595   10.238    5.079
LGA    G   111_A      G   111_A     7.026     0    0.202   0.202     9.052    7.143    7.143
LGA    A   112_A      A   112_A     5.710     0    0.098   0.140     5.858   25.119   24.381
LGA    P   113_A      P   113_A     4.712     0    0.171   0.353     5.357   39.524   34.558
LGA    Y   114_A      Y   114_A     3.463     0    0.134   1.248     6.157   41.905   40.873
LGA    T   115_A      T   115_A     3.856     0    0.122   1.327     5.331   52.024   44.966
LGA    R   116_A      R   116_A     2.405     0    0.154   1.268     6.548   55.476   47.446
LGA    A   117_A      A   117_A     3.023     0    0.103   0.098     3.368   59.286   57.429
LGA    E   118_A      E   118_A     2.717     0    0.097   1.108     6.837   53.571   40.741
LGA    Y   119_A      Y   119_A     3.150     0    0.224   1.206     6.789   46.905   39.881
LGA    K   120_A      K   120_A     7.296     0    0.070   0.930    15.445    9.405    4.550
LGA    L   121_A      L   121_A     8.939     0    0.071   0.830    10.968    1.905    4.702
LGA    T   122_A      T   122_A    11.628     0    0.524   1.376    14.736    0.000    0.000
LGA    P   123_A      P   123_A    13.171     0    0.616   0.907    15.625    0.000    0.000
LGA    D   124_A      D   124_A     8.014     0    0.503   0.599    10.161   10.952    7.679
LGA    L   125_A      L   125_A     3.952     0    0.186   0.839     5.654   39.524   37.619
LGA    K   126_A      K   126_A     1.782     0    0.321   0.737     3.967   68.929   64.603
LGA    L   127_A      L   127_A     1.650     0    0.151   0.640     2.943   75.000   67.976
LGA    L   128_A      L   128_A     0.817     0    0.211   1.363     3.618   86.071   73.274
LGA    S   129_A      S   129_A     0.540     0    0.155   0.682     3.095   88.452   82.381
LGA    Q   130_A      Q   130_A     0.381     0    0.183   0.690     3.201   97.619   87.354
LGA    V   131_A      V   131_A     1.949     0    0.087   0.148     3.151   63.214   63.946
LGA    V   132_A      V   132_A     2.863     0    0.188   1.132     4.460   57.262   53.333
LGA    Y   133_A      Y   133_A     5.629     0    0.115   0.348     7.503   19.048   15.992
LGA    N   134_A      N   134_A     9.345     0    0.677   0.756    12.688    2.143    1.250
LGA    T   135_A      T   135_A    11.046     0    0.374   1.160    12.616    0.119    0.068
LGA    D   136_A      D   136_A    12.299     0    0.548   0.653    13.741    0.000    0.000
LGA    N   137_A      N   137_A    11.870     0    0.462   0.902    12.781    0.119    0.060
LGA    T   138_A      T   138_A     7.113     0    0.616   0.915     8.797   21.905   19.592
LGA    F   139_A      F   139_A     2.973     0    0.570   0.405     8.623   52.619   30.909
LGA    K   140_A      K   140_A     1.944     0    0.077   1.002     4.113   70.833   57.989
LGA    F   141_A      F   141_A     0.929     0    0.049   0.360     1.573   83.690   85.628
LGA    D   142_A      D   142_A     1.410     0    0.091   0.425     1.700   81.429   78.214
LGA    T   143_A      T   143_A     1.386     0    0.101   0.962     2.439   81.429   76.599
LGA    G   144_A      G   144_A     1.013     0    0.029   0.029     1.013   85.952   85.952
LGA    L   145_A      L   145_A     0.892     0    0.060   0.463     2.684   90.476   84.048
LGA    E   146_A      E   146_A     1.169     0    0.079   0.463     3.688   88.214   72.011
LGA    Y   147_A      Y   147_A     1.083     0    0.173   0.250     2.859   81.548   71.111
LGA    K   148_A      K   148_A     2.157     0    0.184   0.918     4.347   68.810   61.852
LGA    L   149_A      L   149_A     0.670     0    0.086   0.686     2.832   92.976   86.548
LGA    S   150_A      S   150_A     0.468     0    0.115   0.805     2.188   95.238   89.365
LGA    P   151_A      P   151_A     0.688     0    0.036   0.360     1.145   92.857   90.544
LGA    N   152_A      N   152_A     1.469     0    0.334   0.666     3.255   71.667   75.774
LGA    L   153_A      L   153_A     2.442     0    0.133   1.166     3.786   68.810   61.310
LGA    K   154_A      K   154_A     1.774     0    0.083   0.939     3.456   66.786   65.132
LGA    V   155_A      V   155_A     2.692     0    0.063   0.989     4.149   62.857   58.639
LGA    K   156_A      K   156_A     2.531     0    0.141   0.697     3.659   53.690   54.127
LGA    F   157_A      F   157_A     2.060     0    0.196   1.393     4.010   77.381   64.242
LGA    E   158_A      E   158_A     1.532     0    0.058   0.815     3.304   63.095   62.434
LGA    Y   159_A      Y   159_A     2.499     0    0.066   1.440     7.915   68.810   46.270
LGA    G   160_A      G   160_A     2.108     0    0.042   0.042     2.444   68.810   68.810
LGA    W   161_A      W   161_A     1.014     0    0.088   1.215     7.982   81.548   54.150
LGA    N   162_A      N   162_A     0.800     0    0.145   0.799     3.601   81.667   72.619
LGA    N   163_A      N   163_A     4.058     0    0.059   0.877     8.684   36.786   24.524
LGA    S   164_A      S   164_A     5.370     0    0.553   0.767    10.006   31.548   22.222
LGA    S   165_A      S   165_A     3.740     0    0.566   0.555     5.790   45.238   38.968
LGA    L   166_A      L   166_A     2.242     0    0.473   1.017     4.423   62.857   52.321
LGA    N   167_A      N   167_A     1.663     0    0.148   0.190     3.705   77.143   63.631
LGA    E   168_A      E   168_A     1.594     0    0.044   0.572     2.968   72.976   70.265
LGA    F   169_A      F   169_A     2.389     0    0.067   1.244     8.707   62.976   38.701
LGA    T   170_A      T   170_A     3.551     0    0.049   1.102     4.250   45.000   45.306
LGA    V   171_A      V   171_A     3.926     0    0.088   1.100     5.424   41.786   40.000
LGA    Q   172_A      Q   172_A     4.262     0    0.073   0.741     4.666   40.238   37.937
LGA    F   173_A      F   173_A     3.246     0    0.299   1.409     7.802   46.667   31.645
LGA    E   174_A      E   174_A     2.327     0    0.155   0.330     3.310   66.905   64.127
LGA    Y   175_A      Y   175_A     1.673     0    0.628   1.366     9.969   63.452   41.468
LGA    D   176_A      D   176_A     3.738     0    0.238   1.053     8.457   47.143   29.940
LGA    L   177_A      L   177_A     6.403     0    0.162   0.941    12.658   24.048   12.976
LGA    S   178_A      S   178_A     4.459     0    0.054   0.058     6.678   30.238   26.746
LGA    S   179_A      S   179_A     7.815     0    0.358   0.602     9.281    5.833    5.476

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      179     716    716  100.00    1442   1442  100.00               179
SUMMARY(RMSD_GDC):     4.539          4.497                  5.325           54.205   47.452

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  179  179    4.0    129    2.33    57.402    53.753     5.303

LGA_LOCAL      RMSD:   2.333  Number of atoms:  129  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   4.717  Number of assigned atoms:  179 
Std_ASGN_ATOMS RMSD:   4.539  Standard rmsd on all 179 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.742679 * X  +  -0.399165 * Y  +  -0.537675 * Z  + 113.883698
  Y_new =  -0.650106 * X  +   0.237230 * Y  +   0.721861 * Z  + -90.831223
  Z_new =  -0.160590 * X  +   0.885658 * Y  +  -0.435685 * Z  + -117.271736 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -2.422563  0.161288  2.027971   [DEG: -138.8026    9.2411  116.1942 ]
ZXZ: -2.501399  2.021596 -0.179374   [DEG: -143.3196  115.8289  -10.2773 ]
 
# END of job
