
#######################################################
#                                                     #
#                        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  203 ( 1687),  selected  203 , name one
# Molecule2: number of CA atoms  207 ( 1714),  selected  203 , 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:   184      24_A - 207_A       4.97    12.01
  LCS_AVERAGE:     81.72

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   149      33_A - 181_A       2.00    12.31
  LONGEST_CONTINUOUS_SEGMENT:   149      34_A - 182_A       1.94    12.32
  LONGEST_CONTINUOUS_SEGMENT:   149      35_A - 183_A       2.00    12.34
  LCS_AVERAGE:     55.95

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    61     115_A - 175_A       0.93    12.12
  LCS_AVERAGE:     18.44

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  203
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     F     5_A     F     5_A      5    7   16      4    4    5    6    7    9    9    9   10   14   15   16   18   25   29   34   40   42   44   51 
LCS_GDT     T     6_A     T     6_A      5    8   18      4    4    6    6    8    9    9    9   10   11   11   11   11   13   16   16   18   20   20   23 
LCS_GDT     W     7_A     W     7_A      5    8   19      4    4    5    6    8    9    9    9   10   12   14   16   17   18   19   21   22   22   22   23 
LCS_GDT     G     8_A     G     8_A      5    8   21      4    4    5    6    8    9    9   10   12   20   22   26   29   31   34   36   40   41   44   51 
LCS_GDT     F     9_A     F     9_A      5    8   23      3    4    6    6    8    9    9    9   10   11   14   16   19   23   29   32   36   39   45   49 
LCS_GDT     G    10_A     G    10_A      5    8   26      3    4    6    6    8    9    9    9   10   13   17   17   18   24   33   34   40   41   45   51 
LCS_GDT     G    11_A     G    11_A      5    9   27      3    4    6    6    8   10   14   19   22   25   27   29   32   34   36   37   40   42   45   51 
LCS_GDT     S    12_A     S    12_A      5    9   27      3    4    6    8   10   15   19   22   24   26   28   29   32   34   36   37   40   46   49   52 
LCS_GDT     S    13_A     S    13_A      5    9   28      3    4    6    8    8   10   14   14   19   23   27   30   32   34   36   39   44   46   50   55 
LCS_GDT     K    14_A     K    14_A      5    9   28      4    4    6    8   11   15   19   22   24   26   28   30   32   34   36   40   44   46   52   59 
LCS_GDT     E    15_A     E    15_A      5   14   28      4    4    7    8   11   16   19   22   24   26   28   30   32   34   36   40   44   46   50   55 
LCS_GDT     K    16_A     K    16_A      6   15   28      4    5    8   10   14   16   19   22   24   26   28   30   32   34   36   40   44   46   50   55 
LCS_GDT     P    17_A     P    17_A      9   15   28      4    7   10   12   15   17   19   22   24   26   28   30   32   34   36   40   44   46   54   62 
LCS_GDT     N    18_A     N    18_A      9   15   28      3    8   10   12   15   17   19   22   24   26   28   30   32   34   36   40   44   46   50   53 
LCS_GDT     Y    19_A     Y    19_A      9   15   28      7    8   10   12   15   17   19   22   24   26   28   30   32   34   36   40   44   46   53   56 
LCS_GDT     D    20_A     D    20_A      9   15   28      7    8   10   12   15   17   19   22   24   26   28   30   32   34   36   40   44   46   49   53 
LCS_GDT     Y    21_A     Y    21_A      9   15   28      7    8   10   12   15   17   19   22   24   26   28   30   32   34   36   40   44   46   53   56 
LCS_GDT     S    22_A     S    22_A      9   15   28      7    8   10   12   15   17   19   22   24   26   28   30   32   34   36   40   44   46   49   53 
LCS_GDT     A    23_A     A    23_A      9   15   28      7    8   10   12   15   17   19   22   24   26   28   30   32   34   36   40   44   46   49   53 
LCS_GDT     D    24_A     D    24_A      9   15  184      7    8   10   12   15   17   19   22   24   26   28   30   32   34   36   62   76   83   90   99 
LCS_GDT     K    25_A     K    25_A      9   15  184      7    8   10   12   15   17   19   22   24   26   28   30   32   34   36   62   67   83   90   99 
LCS_GDT     K    26_A     K    26_A      8   15  184      7    7    8   12   15   17   19   22   24   26   28   30   32   34   57   62   76   83   90   99 
LCS_GDT     L    27_A     L    27_A      8   15  184      7    7    9   12   15   17   19   22   24   34   45   50   65   92  100  106  109  126  132  142 
LCS_GDT     I    28_A     I    28_A      8   15  184      7    7    8   12   15   17   19   40   59   67   73   88   97  102  114  140  162  169  173  175 
LCS_GDT     E    29_A     E    29_A      8   15  184      7    7    8   12   15   17   18   22   24   53   57   62   88   97  103  114  120  127  130  138 
LCS_GDT     I    30_A     I    30_A      8   15  184      7    7    8   10   14   16   18   22   29   67   73   88   95  102  109  114  135  165  170  175 
LCS_GDT     N    31_A     N    31_A      8   14  184      4    7    8    8   14   28   58   93  107  123  144  153  162  169  172  173  174  176  176  176 
LCS_GDT     T    32_A     T    32_A      4  143  184      4    4    4    6    9    9   12   82  110  119  132  150  164  169  172  173  174  176  176  176 
LCS_GDT     R    33_A     R    33_A      4  149  184      4   27   40   63   91   99  116  130  145  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     P    34_A     P    34_A     43  149  184      4    5   33   78  111  133  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     I    35_A     I    35_A     43  149  184      3   27   52  113  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     S    36_A     S    36_A     43  149  184      3    5   24   40   57  135  144  149  153  157  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     T    37_A     T    37_A     46  149  184     12   28   83  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     D    38_A     D    38_A     47  149  184     15   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     N    39_A     N    39_A     47  149  184     44   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     A    40_A     A    40_A     47  149  184     41   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     K    41_A     K    41_A     47  149  184     16   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     Y    42_A     Y    42_A     47  149  184     15   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     W    43_A     W    43_A     47  149  184     16   81  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     C    44_A     C    44_A     47  149  184     16   69  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     F    45_A     F    45_A     47  149  184     16   54  106  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     D    46_A     D    46_A     47  149  184     15   65  109  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     K    47_A     K    47_A     47  149  184     16   57  107  121  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     G    48_A     G    48_A     47  149  184     16   46  105  120  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     N    49_A     N    49_A     47  149  184     16   54  107  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     D    50_A     D    50_A     47  149  184     15   78  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     L    51_A     L    51_A     47  149  184     15   78  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     G    52_A     G    52_A     47  149  184     15   75  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     C    53_A     C    53_A     47  149  184     15   69  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     L    54_A     L    54_A     47  149  184     16   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     S    55_A     S    55_A     47  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     L    56_A     L    56_A     47  149  184     36   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     E    57_A     E    57_A     47  149  184     41   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     K    58_A     K    58_A     47  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     L    59_A     L    59_A     47  149  184     29   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     E    60_A     E    60_A     47  149  184     16   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     A    61_A     A    61_A     47  149  184     12   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     L    62_A     L    62_A     47  149  184      7   36   79  121  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     E    63_A     E    63_A     47  149  184     12   36   65  115  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     S    64_A     S    64_A     47  149  184     16   42   73  121  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     K    65_A     K    65_A     47  149  184     16   42   69  115  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     D    66_A     D    66_A     47  149  184      7   42   81  121  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     L    67_A     L    67_A     47  149  184     18   42   97  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     K    68_A     K    68_A     47  149  184     22   71  109  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     K    69_A     K    69_A     47  149  184     10   72  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     V    70_A     V    70_A     47  149  184     20   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     V    71_A     V    71_A     47  149  184     32   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     K    72_A     K    72_A     47  149  184     16   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     F    73_A     F    73_A     47  149  184     13   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     Y    74_A     Y    74_A     47  149  184     33   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     E    75_A     E    75_A     47  149  184     15   78  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     K    76_A     K    76_A     47  149  184      4   66  108  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     T    77_A     T    77_A     47  149  184      4   24   90  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     I    78_A     I    78_A     47  149  184      4   57   86  116  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     P    79_A     P    79_A     47  149  184      4    7   46  118  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     E    80_A     E    80_A     47  149  184     12   77  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     Y    81_A     Y    81_A     47  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     C    82_A     C    82_A     47  149  184     38   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     Y    83_A     Y    83_A     47  149  184     14   80  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     D    84_A     D    84_A     47  149  184     15   78  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     K    85_A     K    85_A     43  149  184     30   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     K    86_A     K    86_A     43  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     F    87_A     F    87_A     43  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     A    88_A     A    88_A     43  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     P    89_A     P    89_A     43  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     A    90_A     A    90_A     43  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     C    91_A     C    91_A     43  149  184     36   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     N    92_A     N    92_A     43  149  184     29   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     I    93_A     I    93_A     43  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     P    94_A     P    94_A     43  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     A    95_A     A    95_A     43  149  184     44   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     I    96_A     I    96_A     43  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     D    97_A     D    97_A     43  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     L    98_A     L    98_A     43  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     I    99_A     I    99_A     43  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     Q   100_A     Q   100_A     43  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     Q   101_A     Q   101_A     43  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     K   102_A     K   102_A     43  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     L   103_A     L   103_A     43  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     S   104_A     S   104_A     43  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     Y   105_A     Y   105_A     43  149  184     44   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     Y   106_A     Y   106_A     43  149  184     16   77  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     V   107_A     V   107_A     43  149  184     12   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     R   108_A     R   108_A     43  149  184     38   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     N   109_A     N   109_A     43  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     D   110_A     D   110_A     43  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     I   111_A     I   111_A      3  149  184      3    3    4    8   14   22   85  142  151  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     D   112_A     D   112_A      3  149  184      3    3    7   12   56   89  108  145  151  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     N   113_A     N   113_A      3  149  184      3   12   23   43   67  105  138  145  152  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     K   114_A     K   114_A      3  149  184      3    3   20   51   80  131  137  146  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     T   115_A     T   115_A     61  149  184     13   58  107  122  132  138  144  149  153  157  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     I   116_A     I   116_A     61  149  184      5   36   77  114  131  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     K   117_A     K   117_A     61  149  184     17   71   98  121  131  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     T   118_A     T   118_A     61  149  184     18   79  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     F   119_A     F   119_A     61  149  184     20   77  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     Y   120_A     Y   120_A     61  149  184     16   74  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     S   121_A     S   121_A     61  149  184     21   79  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     D   122_A     D   122_A     61  149  184     35   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     Y   123_A     Y   123_A     61  149  184     33   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     A   124_A     A   124_A     61  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     K   125_A     K   125_A     61  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     A   126_A     A   126_A     61  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     L   127_A     L   127_A     61  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     S   128_A     S   128_A     61  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     E   129_A     E   129_A     61  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     S   130_A     S   130_A     61  149  184     34   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     K   131_A     K   131_A     61  149  184     31   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     A   132_A     A   132_A     61  149  184     36   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     D   133_A     D   133_A     61  149  184     44   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     V   134_A     V   134_A     61  149  184     44   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     K   135_A     K   135_A     61  149  184     41   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     M   136_A     M   136_A     61  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     L   137_A     L   137_A     61  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     E   138_A     E   138_A     61  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     Y   139_A     Y   139_A     61  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     G   140_A     G   140_A     61  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     C   141_A     C   141_A     61  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     N   142_A     N   142_A     61  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     E   143_A     E   143_A     61  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     L   144_A     L   144_A     61  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     K   145_A     K   145_A     61  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     S   146_A     S   146_A     61  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     A   147_A     A   147_A     61  149  184     46   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     Y   148_A     Y   148_A     61  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     I   149_A     I   149_A     61  149  184     34   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     C   150_A     C   150_A     61  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     R   151_A     R   151_A     61  149  184     26   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     D   152_A     D   152_A     61  149  184     17   66  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     L   153_A     L   153_A     61  149  184     44   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     R   154_A     R   154_A     61  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     D   155_A     D   155_A     61  149  184     26   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     M   156_A     M   156_A     61  149  184     44   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     Y   157_A     Y   157_A     61  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     K   158_A     K   158_A     61  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     Y   159_A     Y   159_A     61  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     L   160_A     L   160_A     61  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     G   161_A     G   161_A     61  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     D   162_A     D   162_A     61  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     K   163_A     K   163_A     61  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     E   164_A     E   164_A     61  149  184     32   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     K   165_A     K   165_A     61  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     T   166_A     T   166_A     61  149  184     47   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     K   167_A     K   167_A     61  149  184     34   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     E   168_A     E   168_A     61  149  184     34   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     Y   169_A     Y   169_A     61  149  184     40   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     N   170_A     N   170_A     61  149  184     26   83  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     D   171_A     D   171_A     61  149  184     22   74  100  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     K   172_A     K   172_A     61  149  184     17   65   99  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     M   173_A     M   173_A     61  149  184     12   42   93  121  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     K   174_A     K   174_A     61  149  184     17   41   87  111  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     N   175_A     N   175_A     61  149  184     12   31   50   96  117  137  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     G   176_A     G   176_A     29  149  184      5    6    7   14   37   67   99  115  146  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     D   177_A     D   177_A     29  149  184      5   22   37   56   91  110  134  147  152  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     E   178_A     E   178_A     29  149  184     12   32   53   95  112  131  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     K   179_A     K   179_A     27  149  184      5    6    7   86  112  129  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     W   180_A     W   180_A      6  149  184      5    6    7   11   73   97  125  140  152  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     N   181_A     N   181_A      6  149  184     13   37   78  104  125  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     S   182_A     S   182_A      5  149  184      5    5   17   34   85  114  134  148  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     V   183_A     V   183_A      5  149  184      5    5    5    6   38   45   61   94  142  154  162  167  168  170  173  174  174  176  176  176 
LCS_GDT     L   184_A     L   184_A      5  118  184      5    5    5    9   11   67  102  136  150  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     Y   185_A     Y   185_A      5   73  184      5    5    5    6    7   40   94  124  151  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     D   186_A     D   186_A      5   73  184      5    5    5   31   41   56   65   91  146  153  160  167  168  170  173  174  174  176  176  176 
LCS_GDT     Y   187_A     Y   187_A      4   73  184      4    4   16   36   60   94  117  143  152  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     K   188_A     K   188_A      4    5  184      4    4    5   11   16   29   47   81   93  118  152  165  168  170  173  174  174  176  176  176 
LCS_GDT     H   189_A     H   189_A      4    5  184      4    4    5    7   13   19   23   48   64  100  133  158  163  170  173  174  174  176  176  176 
LCS_GDT     M   190_A     M   190_A      4    5  184      4    4    6   11   20   37   48   59   89  116  140  158  167  170  173  174  174  176  176  176 
LCS_GDT     R   191_A     R   191_A      4    5  184      4    4    5   23   31   46  139  146  152  157  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     Y   192_A     Y   192_A      5    8  184      4    4    9   22   56  121  139  147  153  157  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     I   193_A     I   193_A      5    8  184      4   10   59  107  127  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     H   194_A     H   194_A      5    8  184      4   10   19   44  118  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     G   195_A     G   195_A      5    8  184      4    4    9   33   54  101  141  148  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     G   196_A     G   196_A      5   12  184      4   21   38   51  100  134  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     Y   197_A     Y   197_A     11   12  184      5    7   12   13   13   19  120  138  149  157  163  166  168  170  173  174  174  176  176  176 
LCS_GDT     S   198_A     S   198_A     11   12  184      5    7   38   51   85  131  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     S   199_A     S   199_A     11   12  184      5   24   96  121  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     W   200_A     W   200_A     11   12  184      7   70  110  122  132  138  144  149  153  158  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     W   201_A     W   201_A     11   12  184      5    7   18   60  118  135  143  149  153  157  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     L   202_A     L   202_A     11   12  184     11   40   97  114  129  138  143  149  153  157  163  167  168  170  173  174  174  176  176  176 
LCS_GDT     L   203_A     L   203_A     11   12  184      3    7   12   19   92  124  133  143  151  157  162  167  168  170  173  174  174  176  176  176 
LCS_GDT     E   204_A     E   204_A     11   12  184      3    7   12   15   46   59   71  111  144  148  153  158  165  170  173  174  174  176  176  176 
LCS_GDT     K   205_A     K   205_A     11   12  184      3    7   12   31   46   59   85  111  138  148  152  157  165  170  173  174  174  176  176  176 
LCS_GDT     I   206_A     I   206_A     11   12  184      3    7   12   13   17   35   48   84   96  110  141  157  165  170  173  174  174  176  176  176 
LCS_GDT     K   207_A     K   207_A     11   12  184      3    7   12   13   15   20   24   26   33   42   49   69  132  136  143  151  166  172  175  175 
LCS_AVERAGE  LCS_A:  52.04  (  18.44   55.95   81.72 )

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     47     83    110    122    132    138    144    149    153    158    163    167    168    170    173    174    174    176    176    176 
GDT PERCENT_AT  22.71  40.10  53.14  58.94  63.77  66.67  69.57  71.98  73.91  76.33  78.74  80.68  81.16  82.13  83.57  84.06  84.06  85.02  85.02  85.02
GDT RMS_LOCAL    0.34   0.56   0.81   0.98   1.19   1.28   1.48   1.61   1.76   2.19   2.20   2.43   2.46   2.66   2.83   2.88   2.88   3.08   3.08   3.08
GDT RMS_ALL_AT  12.16  12.20  12.17  12.20  12.25  12.24  12.25  12.24  12.25  12.30  12.28  12.29  12.30  12.30  12.30  12.29  12.29  12.26  12.26  12.26

# Checking swapping
#   possible swapping detected:  F     9_A      F     9_A
#   possible swapping detected:  Y    19_A      Y    19_A
#   possible swapping detected:  D    20_A      D    20_A
#   possible swapping detected:  Y    21_A      Y    21_A
#   possible swapping detected:  Y    42_A      Y    42_A
#   possible swapping detected:  E    60_A      E    60_A
#   possible swapping detected:  E    63_A      E    63_A
#   possible swapping detected:  F    73_A      F    73_A
#   possible swapping detected:  E    75_A      E    75_A
#   possible swapping detected:  Y    81_A      Y    81_A
#   possible swapping detected:  F    87_A      F    87_A
#   possible swapping detected:  Y   106_A      Y   106_A
#   possible swapping detected:  D   110_A      D   110_A
#   possible swapping detected:  Y   123_A      Y   123_A
#   possible swapping detected:  E   129_A      E   129_A
#   possible swapping detected:  E   138_A      E   138_A
#   possible swapping detected:  Y   139_A      Y   139_A
#   possible swapping detected:  E   164_A      E   164_A
#   possible swapping detected:  E   168_A      E   168_A
#   possible swapping detected:  D   186_A      D   186_A
#   possible swapping detected:  Y   192_A      Y   192_A
#   possible swapping detected:  E   204_A      E   204_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    F     5_A      F     5_A    36.575     0    0.574   1.318    37.766    0.000    0.000
LGA    T     6_A      T     6_A    38.664     0    0.042   0.168    40.035    0.000    0.000
LGA    W     7_A      W     7_A    39.715     0    0.096   1.002    41.168    0.000    0.000
LGA    G     8_A      G     8_A    39.690     0    0.254   0.254    39.734    0.000    0.000
LGA    F     9_A      F     9_A    40.405     0    0.626   1.319    42.982    0.000    0.000
LGA    G    10_A      G    10_A    40.424     0    0.171   0.171    42.610    0.000    0.000
LGA    G    11_A      G    11_A    43.718     0    0.195   0.195    43.718    0.000    0.000
LGA    S    12_A      S    12_A    43.609     0    0.102   0.696    45.528    0.000    0.000
LGA    S    13_A      S    13_A    40.867     0    0.357   0.597    41.300    0.000    0.000
LGA    K    14_A      K    14_A    37.185     0    0.186   0.716    38.278    0.000    0.000
LGA    E    15_A      E    15_A    36.239     0    0.086   0.929    41.337    0.000    0.000
LGA    K    16_A      K    16_A    33.944     0    0.051   0.585    40.807    0.000    0.000
LGA    P    17_A      P    17_A    30.295     0    0.141   0.139    31.725    0.000    0.000
LGA    N    18_A      N    18_A    34.639     0    0.065   0.142    41.394    0.000    0.000
LGA    Y    19_A      Y    19_A    29.864     0    0.140   0.901    31.108    0.000    0.000
LGA    D    20_A      D    20_A    32.863     0    0.036   1.103    37.133    0.000    0.000
LGA    Y    21_A      Y    21_A    27.590     0    0.086   1.387    29.666    0.000    0.000
LGA    S    22_A      S    22_A    32.543     0    0.011   0.056    36.458    0.000    0.000
LGA    A    23_A      A    23_A    30.015     0    0.042   0.060    30.910    0.000    0.000
LGA    D    24_A      D    24_A    22.616     0    0.175   0.262    25.359    0.000    0.000
LGA    K    25_A      K    25_A    24.747     0    0.047   0.096    35.256    0.000    0.000
LGA    K    26_A      K    26_A    25.403     0    0.050   1.203    34.804    0.000    0.000
LGA    L    27_A      L    27_A    18.941     0    0.022   1.369    21.421    0.000    0.000
LGA    I    28_A      I    28_A    15.858     0    0.022   0.174    17.014    0.000    0.000
LGA    E    29_A      E    29_A    20.436     0    0.098   1.414    26.330    0.000    0.000
LGA    I    30_A      I    30_A    17.685     0    0.191   1.411    22.376    0.000    0.000
LGA    N    31_A      N    31_A    11.196     0    0.571   1.021    13.556    0.714    0.357
LGA    T    32_A      T    32_A    10.931     0    0.049   0.123    14.992    0.119    0.068
LGA    R    33_A      R    33_A     7.932     0    0.660   1.443    10.006    9.286    4.416
LGA    P    34_A      P    34_A     4.066     0    0.585   0.567     4.113   41.905   42.517
LGA    I    35_A      I    35_A     2.759     0    0.624   0.502     5.572   42.976   59.048
LGA    S    36_A      S    36_A     4.030     0    0.553   0.694     6.127   46.786   39.286
LGA    T    37_A      T    37_A     1.976     0    0.109   0.973     4.250   75.476   68.095
LGA    D    38_A      D    38_A     0.995     0    0.016   0.143     1.738   88.214   82.679
LGA    N    39_A      N    39_A     0.625     0    0.036   1.302     3.800   92.857   81.369
LGA    A    40_A      A    40_A     0.480     0    0.022   0.024     0.909   95.238   94.286
LGA    K    41_A      K    41_A     1.112     0    0.036   0.342     3.586   83.690   72.804
LGA    Y    42_A      Y    42_A     1.227     0    0.016   0.090     1.829   79.286   77.143
LGA    W    43_A      W    43_A     1.360     0    0.015   0.070     1.836   77.143   77.755
LGA    C    44_A      C    44_A     1.660     0    0.029   0.046     2.072   72.976   72.937
LGA    F    45_A      F    45_A     2.137     0    0.016   0.107     2.570   66.786   64.113
LGA    D    46_A      D    46_A     2.162     0    0.028   0.617     2.405   64.762   65.774
LGA    K    47_A      K    47_A     2.354     0    0.047   0.232     3.381   60.952   60.582
LGA    G    48_A      G    48_A     2.542     0    0.022   0.022     2.542   62.857   62.857
LGA    N    49_A      N    49_A     2.085     0    0.016   0.306     2.352   68.810   66.786
LGA    D    50_A      D    50_A     1.409     0    0.076   0.243     1.731   79.286   79.286
LGA    L    51_A      L    51_A     1.305     0    0.034   1.376     3.882   81.429   71.429
LGA    G    52_A      G    52_A     1.315     0    0.079   0.079     1.315   81.429   81.429
LGA    C    53_A      C    53_A     1.448     0    0.013   0.042     2.033   81.429   77.222
LGA    L    54_A      L    54_A     1.092     0    0.044   1.384     3.299   88.333   79.881
LGA    S    55_A      S    55_A     0.572     0    0.029   0.693     2.481   95.238   89.365
LGA    L    56_A      L    56_A     0.623     0    0.043   0.174     1.363   90.476   88.214
LGA    E    57_A      E    57_A     0.557     0    0.015   0.712     2.548   95.238   80.317
LGA    K    58_A      K    58_A     0.422     0    0.017   0.725     4.400   97.619   76.984
LGA    L    59_A      L    59_A     0.546     0    0.034   0.046     1.153   90.595   95.298
LGA    E    60_A      E    60_A     1.107     0    0.053   0.249     1.723   81.548   80.529
LGA    A    61_A      A    61_A     1.089     0    0.044   0.040     1.906   79.405   81.619
LGA    L    62_A      L    62_A     2.190     0    0.029   0.078     2.940   62.976   61.964
LGA    E    63_A      E    63_A     2.760     0    0.017   0.724     3.826   57.262   53.333
LGA    S    64_A      S    64_A     2.520     0    0.035   0.066     2.708   59.048   60.952
LGA    K    65_A      K    65_A     2.739     0    0.056   0.609     3.458   55.357   54.762
LGA    D    66_A      D    66_A     2.493     0    0.050   0.070     2.583   62.857   63.810
LGA    L    67_A      L    67_A     2.216     0    0.044   0.054     2.673   68.810   65.833
LGA    K    68_A      K    68_A     1.669     0    0.056   0.701     2.663   75.000   70.265
LGA    K    69_A      K    69_A     1.555     0    0.061   0.132     3.021   77.143   69.577
LGA    V    70_A      V    70_A     0.907     0    0.030   0.040     1.132   90.595   89.252
LGA    V    71_A      V    71_A     0.718     0    0.037   0.057     1.343   92.857   89.252
LGA    K    72_A      K    72_A     0.947     0    0.034   1.038     7.075   88.214   59.788
LGA    F    73_A      F    73_A     0.986     0    0.011   0.088     1.289   88.214   85.541
LGA    Y    74_A      Y    74_A     0.925     0    0.077   0.093     1.762   83.810   86.746
LGA    E    75_A      E    75_A     1.512     0    0.129   0.393     3.728   75.000   62.910
LGA    K    76_A      K    76_A     1.767     0    0.069   0.979    10.667   79.286   45.661
LGA    T    77_A      T    77_A     1.831     0    0.027   0.151     4.006   75.000   63.469
LGA    I    78_A      I    78_A     2.623     0    0.041   0.712     6.276   64.881   49.286
LGA    P    79_A      P    79_A     2.694     0    0.106   0.268     3.390   62.857   59.388
LGA    E    80_A      E    80_A     1.548     0    0.039   0.787     4.856   77.143   57.672
LGA    Y    81_A      Y    81_A     0.399     0    0.011   0.225     0.943   97.619   96.032
LGA    C    82_A      C    82_A     0.721     0    0.054   0.110     0.839   90.476   90.476
LGA    Y    83_A      Y    83_A     1.169     0    0.015   0.204     1.507   81.429   80.714
LGA    D    84_A      D    84_A     1.396     0    0.043   0.277     2.620   81.429   76.250
LGA    K    85_A      K    85_A     0.899     0    0.036   0.749     3.073   88.214   79.259
LGA    K    86_A      K    86_A     0.260     0    0.026   0.584     2.018   97.619   95.026
LGA    F    87_A      F    87_A     0.200     0    0.018   0.094     0.405  100.000  100.000
LGA    A    88_A      A    88_A     0.069     0    0.046   0.055     0.136  100.000  100.000
LGA    P    89_A      P    89_A     0.062     0    0.104   0.125     0.475  100.000  100.000
LGA    A    90_A      A    90_A     0.402     0    0.020   0.025     0.775   95.238   94.286
LGA    C    91_A      C    91_A     0.705     0    0.038   0.100     0.746   92.857   92.063
LGA    N    92_A      N    92_A     0.906     0    0.061   1.134     3.227   90.476   83.155
LGA    I    93_A      I    93_A     0.580     0    0.040   0.076     0.977   90.476   90.476
LGA    P    94_A      P    94_A     0.580     0    0.022   0.029     0.703   90.476   90.476
LGA    A    95_A      A    95_A     0.614     0    0.033   0.041     0.774   90.476   90.476
LGA    I    96_A      I    96_A     0.598     0    0.031   0.069     0.649   90.476   90.476
LGA    D    97_A      D    97_A     0.503     0    0.063   0.221     0.735   90.476   92.857
LGA    L    98_A      L    98_A     0.581     0    0.081   0.102     0.915   90.476   90.476
LGA    I    99_A      I    99_A     0.567     0    0.025   0.044     0.640   90.476   90.476
LGA    Q   100_A      Q   100_A     0.466     0    0.027   0.837     3.143   92.857   84.339
LGA    Q   101_A      Q   101_A     0.565     0    0.040   0.816     3.842   90.476   78.677
LGA    K   102_A      K   102_A     0.783     0    0.040   0.134     1.368   90.476   87.460
LGA    L   103_A      L   103_A     0.718     0    0.059   0.962     2.276   90.476   83.929
LGA    S   104_A      S   104_A     0.440     0    0.038   0.665     2.169   95.238   90.952
LGA    Y   105_A      Y   105_A     1.012     0    0.059   0.335     3.331   83.690   71.310
LGA    Y   106_A      Y   106_A     1.679     0    0.060   1.005     5.025   75.000   64.841
LGA    V   107_A      V   107_A     1.393     0    0.093   1.236     4.353   85.952   75.238
LGA    R   108_A      R   108_A     0.422     0    0.113   1.293     6.538   95.238   71.385
LGA    N   109_A      N   109_A     0.535     0    0.076   1.072     2.766   92.857   86.488
LGA    D   110_A      D   110_A     0.759     0    0.438   1.183     6.551   70.714   50.119
LGA    I   111_A      I   111_A     6.503     0    0.639   0.995    10.643   16.310    9.524
LGA    D   112_A      D   112_A     7.377     0    0.369   0.759    10.648   10.833    6.905
LGA    N   113_A      N   113_A     7.212     0    0.182   0.239    12.163   13.571    7.024
LGA    K   114_A      K   114_A     5.202     0    0.601   0.904    11.763   33.690   16.772
LGA    T   115_A      T   115_A     1.837     0    0.593   0.586     5.343   75.000   57.211
LGA    I   116_A      I   116_A     2.763     0    0.093   1.179     6.581   57.262   48.095
LGA    K   117_A      K   117_A     2.393     0    0.058   0.844     6.594   62.857   46.772
LGA    T   118_A      T   118_A     1.633     0    0.057   0.082     1.720   75.000   77.823
LGA    F   119_A      F   119_A     1.607     0    0.049   0.348     2.145   72.857   72.944
LGA    Y   120_A      Y   120_A     1.720     0    0.014   0.168     3.220   75.000   65.714
LGA    S   121_A      S   121_A     1.403     0    0.033   0.706     3.291   81.548   76.270
LGA    D   122_A      D   122_A     1.081     0    0.021   0.078     1.157   83.690   85.952
LGA    Y   123_A      Y   123_A     0.975     0    0.026   0.195     1.106   88.214   88.968
LGA    A   124_A      A   124_A     0.696     0    0.017   0.018     0.865   92.857   92.381
LGA    K   125_A      K   125_A     0.662     0    0.034   0.788     4.187   92.857   73.968
LGA    A   126_A      A   126_A     0.534     0    0.016   0.018     0.603   92.857   92.381
LGA    L   127_A      L   127_A     0.342     0    0.023   0.077     0.529   97.619   98.810
LGA    S   128_A      S   128_A     0.361     0    0.053   0.083     0.415  100.000  100.000
LGA    E   129_A      E   129_A     0.453     0    0.112   0.202     0.756   97.619   94.709
LGA    S   130_A      S   130_A     0.668     0    0.023   0.036     1.168   92.857   90.556
LGA    K   131_A      K   131_A     0.940     0    0.019   0.200     1.545   85.952   83.545
LGA    A   132_A      A   132_A     0.988     0    0.063   0.068     1.046   90.476   88.667
LGA    D   133_A      D   133_A     0.509     0    0.013   0.148     0.922   92.857   94.048
LGA    V   134_A      V   134_A     0.497     0    0.050   0.044     0.631   92.857   93.197
LGA    K   135_A      K   135_A     0.760     0    0.021   0.972     3.890   90.476   81.323
LGA    M   136_A      M   136_A     0.529     0    0.035   0.124     1.379   95.238   90.595
LGA    L   137_A      L   137_A     0.194     0    0.030   0.070     0.632  100.000   98.810
LGA    E   138_A      E   138_A     0.583     0    0.029   0.290     2.156   90.476   83.704
LGA    Y   139_A      Y   139_A     0.608     0    0.017   0.090     0.703   95.238   92.857
LGA    G   140_A      G   140_A     0.419     0    0.016   0.016     0.460  100.000  100.000
LGA    C   141_A      C   141_A     0.394     0    0.031   0.049     0.580   97.619   96.825
LGA    N   142_A      N   142_A     0.182     0    0.081   0.084     0.570   97.619   98.810
LGA    E   143_A      E   143_A     0.119     0    0.021   0.696     2.646  100.000   80.952
LGA    L   144_A      L   144_A     0.186     0    0.019   0.048     0.428  100.000  100.000
LGA    K   145_A      K   145_A     0.124     0    0.055   0.130     0.253  100.000  100.000
LGA    S   146_A      S   146_A     0.377     0    0.029   0.100     0.576  100.000   96.825
LGA    A   147_A      A   147_A     0.512     0    0.055   0.067     0.900   97.619   96.190
LGA    Y   148_A      Y   148_A     0.501     0    0.084   0.429     1.063   90.476   92.143
LGA    I   149_A      I   149_A     0.616     0    0.033   0.596     1.718   90.476   88.274
LGA    C   150_A      C   150_A     0.491     0    0.021   0.065     0.716   92.857   93.651
LGA    R   151_A      R   151_A     0.867     0    0.063   0.141     1.021   88.214   89.654
LGA    D   152_A      D   152_A     1.257     0    0.012   0.269     2.572   85.952   75.417
LGA    L   153_A      L   153_A     0.572     0    0.040   0.107     0.682   95.238   92.857
LGA    R   154_A      R   154_A     0.427     0    0.013   0.519     1.726  100.000   89.870
LGA    D   155_A      D   155_A     0.733     0    0.018   0.128     2.557   90.476   80.774
LGA    M   156_A      M   156_A     0.644     0    0.027   0.105     0.844   92.857   91.667
LGA    Y   157_A      Y   157_A     0.379     0    0.042   0.062     0.722   97.619   95.238
LGA    K   158_A      K   158_A     0.338     0    0.022   0.144     1.518  100.000   92.804
LGA    Y   159_A      Y   159_A     0.434     0    0.053   0.112     1.527  100.000   91.468
LGA    L   160_A      L   160_A     0.594     0    0.035   0.061     1.096   97.619   92.917
LGA    G   161_A      G   161_A     0.419     0    0.061   0.061     0.482  100.000  100.000
LGA    D   162_A      D   162_A     0.618     0    0.021   0.057     0.814   90.476   90.476
LGA    K   163_A      K   163_A     0.637     0    0.031   0.619     2.438   90.476   88.677
LGA    E   164_A      E   164_A     1.078     0    0.040   0.300     2.335   88.214   79.735
LGA    K   165_A      K   165_A     0.538     0    0.041   0.535     1.353   95.238   90.582
LGA    T   166_A      T   166_A     0.284     0    0.025   0.098     0.707   95.238   95.918
LGA    K   167_A      K   167_A     0.904     0    0.040   0.787     4.790   88.214   76.085
LGA    E   168_A      E   168_A     0.902     0    0.027   0.123     1.004   88.214   90.529
LGA    Y   169_A      Y   169_A     0.700     0    0.053   0.101     1.229   88.214   92.103
LGA    N   170_A      N   170_A     1.072     0    0.024   1.112     3.778   83.690   80.060
LGA    D   171_A      D   171_A     1.674     0    0.025   0.066     2.171   72.976   73.988
LGA    K   172_A      K   172_A     1.743     0    0.043   0.114     2.389   68.810   79.894
LGA    M   173_A      M   173_A     2.076     0    0.016   0.131     2.707   64.881   71.012
LGA    K   174_A      K   174_A     2.735     0    0.040   0.294     4.147   55.476   51.852
LGA    N   175_A      N   175_A     3.488     0    0.119   1.112     4.632   42.143   45.536
LGA    G   176_A      G   176_A     5.677     0    0.609   0.609     5.677   29.048   29.048
LGA    D   177_A      D   177_A     4.951     0    0.058   0.167     5.357   28.810   29.464
LGA    E   178_A      E   178_A     4.087     0    0.033   1.179     7.966   38.690   27.778
LGA    K   179_A      K   179_A     4.461     0    0.051   0.549     5.036   34.286   37.460
LGA    W   180_A      W   180_A     5.499     0    0.196   0.480    11.617   31.667   11.565
LGA    N   181_A      N   181_A     3.176     0    0.460   0.859     3.977   54.048   50.357
LGA    S   182_A      S   182_A     5.214     0    0.664   0.817     8.280   28.810   22.857
LGA    V   183_A      V   183_A     7.152     0    0.025   0.963    11.633   16.548    9.728
LGA    L   184_A      L   184_A     6.148     0    0.062   0.693    10.759   21.548   12.202
LGA    Y   185_A      Y   185_A     5.709     0    0.366   1.465     7.740   22.857   16.190
LGA    D   186_A      D   186_A     6.878     0    0.615   1.356    12.272   17.262    9.226
LGA    Y   187_A      Y   187_A     5.692     0    0.129   1.171     6.854   18.214   21.587
LGA    K   188_A      K   188_A     8.089     0    0.187   0.239    13.884    5.595    2.593
LGA    H   189_A      H   189_A     8.762     0    0.603   0.701    10.325    6.190    2.714
LGA    M   190_A      M   190_A     8.579     0    0.099   0.694    16.706   10.000    5.000
LGA    R   191_A      R   191_A     4.411     0    0.199   1.252    13.451   36.190   18.182
LGA    Y   192_A      Y   192_A     4.477     0    0.616   1.006    14.545   42.143   16.508
LGA    I   193_A      I   193_A     3.126     0    0.058   0.065     3.588   50.119   55.536
LGA    H   194_A      H   194_A     3.262     0    0.140   1.134     4.209   45.119   53.333
LGA    G   195_A      G   195_A     4.049     0    0.152   0.152     4.049   52.619   52.619
LGA    G   196_A      G   196_A     3.515     0    0.067   0.067     5.085   37.500   37.500
LGA    Y   197_A      Y   197_A     5.454     0    0.551   0.461    10.863   30.119   13.016
LGA    S   198_A      S   198_A     3.694     0    0.053   0.601     4.800   55.238   49.286
LGA    S   199_A      S   199_A     2.070     0    0.061   0.136     5.063   64.881   54.841
LGA    W   200_A      W   200_A     1.765     0    0.062   0.201     4.228   64.405   64.762
LGA    W   201_A      W   201_A     3.765     0    0.045   0.160     8.209   43.810   24.626
LGA    L   202_A      L   202_A     3.387     0    0.049   0.074     5.277   42.619   56.071
LGA    L   203_A      L   203_A     5.484     0    0.067   0.147     7.616   20.952   20.774
LGA    E   204_A      E   204_A     7.716     0    0.027   0.882     9.590    7.381   10.212
LGA    K   205_A      K   205_A     8.227     0    0.042   1.004     9.488    4.762    6.402
LGA    I   206_A      I   206_A     9.373     0    0.502   0.643    12.221    1.071    2.500
LGA    K   207_A      K   207_A    13.224     0    0.088   0.958    16.426    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      203     812    812  100.00    1687   1687  100.00               207
SUMMARY(RMSD_GDC):    10.907         10.836                 10.974           61.431   57.816

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  203  207    4.0    149    1.61    63.768    64.333     8.738

LGA_LOCAL      RMSD:   1.605  Number of atoms:  149  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  12.239  Number of assigned atoms:  203 
Std_ASGN_ATOMS RMSD:  10.907  Standard rmsd on all 203 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.942061 * X  +   0.310739 * Y  +  -0.126346 * Z  + -26.748104
  Y_new =   0.311420 * X  +  -0.670210 * Y  +   0.673673 * Z  +  -5.677032
  Z_new =   0.124658 * X  +  -0.673988 * Y  +  -0.728149 * Z  +  -1.224414 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  0.319264 -0.124983 -2.394803   [DEG:   18.2925   -7.1610 -137.2121 ]
ZXZ: -2.956198  2.386414  2.958704   [DEG: -169.3777  136.7314  169.5212 ]
 
# END of job
