
#######################################################
#                                                     #
#                        LGA                          #
#                  ---------------                    #
#                                                     #
#               Local-Global Alignment                #
#        A Method for Finding 3-D Similarities        #
#               in Protein Structures                 #
#                                                     #
#                  ------------ 10/2009               #
#                                                     #
#      Adam Zemla (adamz@llnl.gov)                    #
#      Lawrence Livermore National Laboratory, CA     #
#                                                     #
#######################################################

!!!   License for LGA program has expired  !!!
#   For updated version of the LGA program   #
# please contact Adam Zemla:  adamz@llnl.gov #

# Molecule1: number of CA atoms  251 ( 2082),  selected  239 , name one
# Molecule2: number of CA atoms  239 ( 1967),  selected  239 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:A  -ch2:A  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    79      55_A - 133_A       4.90    15.41
  LONGEST_CONTINUOUS_SEGMENT:    79      56_A - 134_A       4.70    15.39
  LONGEST_CONTINUOUS_SEGMENT:    79      57_A - 135_A       4.93    15.37
  LCS_AVERAGE:     25.25

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    43      62_A - 104_A       1.97    15.08
  LCS_AVERAGE:     10.14

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    26      16_A - 41_A        0.83    15.02
  LCS_AVERAGE:      4.95

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  239
LCS_GDT     RESIDUE       RESIDUE       SEGMENT_SIZE    GLOBAL DISTANCE TEST COLUMNS: number of residues under the threshold assigned to each residue pair
LCS_GDT   NAME NUMBER   NAME NUMBER    1.0  2.0  5.0    0.5  1.0  1.5  2.0  2.5  3.0  3.5  4.0  4.5  5.0  5.5  6.0  6.5  7.0  7.5  8.0  8.5  9.0  9.5 10.0
LCS_GDT     N     2_A     N     2_A      3    5   46      0    3    3   25   65   95  121  138  149  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     S     3_A     S     3_A      3    5   46      1    6   10   38   58   91  110  130  147  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     T     4_A     T     4_A      3    6   46      3    3   10   28   54   73  107  130  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     E     5_A     E     5_A      4    7   46      4    5    5   10   19   50   99  126  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     N     6_A     N     6_A      4   37   46      4    5   10   17   63   86  111  138  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     K     7_A     K     7_A      7   37   46      4    7   21   75  101  120  136  144  150  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     N     8_A     N     8_A      7   37   46     11   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     F     9_A     F     9_A      7   37   46     11   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     V    10_A     V    10_A     11   37   46      7   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     I    11_A     I    11_A     11   37   46      6   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     S    12_A     S    12_A     11   37   46     10   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     I    13_A     I    13_A     15   37   46      6   34   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     S    14_A     S    14_A     15   37   46      4   16   43   86  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     T    15_A     T    15_A     15   37   46      4   16   32   61   92  115  134  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     A    16_A     A    16_A     26   37   46      6   29   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     E    17_A     E    17_A     26   37   46     14   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     Q    18_A     Q    18_A     26   37   46      5   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     R    19_A     R    19_A     26   37   46     14   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     R    20_A     R    20_A     26   37   46     14   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     N    21_A     N    21_A     26   37   46     14   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     H    22_A     H    22_A     26   37   46     14   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     I    23_A     I    23_A     26   37   46     14   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     I    24_A     I    24_A     26   37   46      9   30   57   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     E    25_A     E    25_A     26   37   46     14   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     Q    26_A     Q    26_A     26   37   46     14   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     F    27_A     F    27_A     26   37   46     14   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     T    28_A     T    28_A     26   37   46     14   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     H    29_A     H    29_A     26   37   46     11   30   53   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     Q    30_A     Q    30_A     26   37   46      7   26   47   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     N    31_A     N    31_A     26   37   46      4   26   47   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     I    32_A     I    32_A     26   37   46     14   34   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     P    33_A     P    33_A     26   37   46     14   32   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     F    34_A     F    34_A     26   37   46      7   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     E    35_A     E    35_A     26   37   46      7   28   54   87  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     F    36_A     F    36_A     26   37   46      7   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     F    37_A     F    37_A     26   37   46     12   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     D    38_A     D    38_A     26   37   46      7   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     A    39_A     A    39_A     26   37   46      7   30   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     F    40_A     F    40_A     26   37   46      7   26   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     T    41_A     T    41_A     26   37   46      7   22   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     P    42_A     P    42_A      8   37   46      3    4   32   76  101  118  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     S    43_A     S    43_A      4   37   46      3    7   19   30   47   72   95  121  140  148  154  161  168  172  174  177  177  178  180  180 
LCS_GDT     D    44_A     D    44_A      4   10   46      3    4    5    8   11   18   36   47   70   79  101  109  127  140  160  167  170  176  179  180 
LCS_GDT     K    45_A     K    45_A      4    4   46      3    4    4    6    6   12   16   28   48   51   62   86   95  113  121  143  164  170  175  178 
LCS_GDT     L    46_A     L    46_A      3    4   46      1    4    4    5    8   14   19   28   36   43   59   72   80   99  116  127  144  168  175  178 
LCS_GDT     T    47_A     T    47_A      3    4   46      3    4    5    7    8   12   19   23   28   34   39   61   68   75   93  108  120  136  149  164 
LCS_GDT     D    48_A     D    48_A      3    4   24      3    3    5    5    7    8   10   13   16   18   21   24   26   33   39   43   48   55   84   90 
LCS_GDT     H    49_A     H    49_A      3    4   24      3    3    5    5    7    9   11   12   16   17   24   27   29   33   43   54   59   75   84  103 
LCS_GDT     L    50_A     L    50_A      3    4   24      3    4    5    5    8   13   15   22   28   34   39   49   58   70   80   94  104  122  135  148 
LCS_GDT     Q    51_A     Q    51_A      3    4   24      3    3    4    5    8   11   14   19   25   33   37   42   55   58   62   78   93  100  111  122 
LCS_GDT     R    52_A     R    52_A      3    6   24      3    3    5    5    6    9   11   17   19   24   26   32   36   42   49   56   61   68   77   84 
LCS_GDT     Y    53_A     Y    53_A      5    8   24      4    5    7    8    8   11   14   18   25   30   35   41   47   54   62   74   93  103  110  122 
LCS_GDT     L    54_A     L    54_A      5    8   72      4    5    7    8   10   16   21   25   35   44   51   62   74   91  107  123  130  140  149  175 
LCS_GDT     P    55_A     P    55_A      5    8   79      4    5    7    8    8   11   19   25   35   44   48   55   67   80   94  110  122  133  144  153 
LCS_GDT     N    56_A     N    56_A      5    8   79      5    5    5   10   16   28   40   48   64   77   89  103  118  128  141  155  169  176  179  180 
LCS_GDT     V    57_A     V    57_A      5    8   79      5    5    7   13   27   39   62   77   95  109  126  140  155  165  171  175  177  178  180  180 
LCS_GDT     A    58_A     A    58_A      5    8   79      5    5    7   15   21   28   37   45   57   77   91  109  125  143  156  167  172  178  180  180 
LCS_GDT     N    59_A     N    59_A      5    8   79      5    5    7   16   21   30   38   46   60   88  105  127  135  148  158  167  172  178  180  180 
LCS_GDT     A    60_A     A    60_A      5   40   79      5    5   11   15   39   79  104  121  140  148  154  164  169  172  174  177  177  178  180  180 
LCS_GDT     A    61_A     A    61_A      5   42   79      3   11   35   56   83  104  118  132  145  151  159  166  171  172  174  177  177  178  180  180 
LCS_GDT     Q    62_A     Q    62_A     20   43   79      3   14   44   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     L    63_A     L    63_A     25   43   79      3   22   58   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     T    64_A     T    64_A     25   43   79      3   22   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     M    65_A     M    65_A     25   43   79      3   13   35   62   98  112  130  143  149  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     G    66_A     G    66_A     25   43   79      3   17   35   64   98  116  133  144  150  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     E    67_A     E    67_A     25   43   79      6   17   33   76  101  118  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     K    68_A     K    68_A     25   43   79      5   21   42   80  101  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     G    69_A     G    69_A     25   43   79      4   19   42   68  101  118  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     C    70_A     C    70_A     25   43   79      4   21   51   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     L    71_A     L    71_A     25   43   79      6   22   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     M    72_A     M    72_A     25   43   79     11   22   48   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     S    73_A     S    73_A     25   43   79     11   22   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     H    74_A     H    74_A     25   43   79     11   22   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     F    75_A     F    75_A     25   43   79     11   22   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     M    76_A     M    76_A     25   43   79     11   22   51   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     L    77_A     L    77_A     25   43   79     11   22   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     W    78_A     W    78_A     25   43   79     11   22   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     K    79_A     K    79_A     25   43   79     11   22   46   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     K    80_A     K    80_A     25   43   79     11   22   46   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     C    81_A     C    81_A     25   43   79      6   21   43   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     I    82_A     I    82_A     25   43   79      7   22   43   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     D    83_A     D    83_A     25   43   79      7   22   51   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     E    84_A     E    84_A     25   43   79     11   22   46   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     N    85_A     N    85_A     25   43   79     11   22   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     L    86_A     L    86_A     25   43   79      7   22   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     D    87_A     D    87_A     25   43   79      6   22   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     Y    88_A     Y    88_A     25   43   79     10   21   54   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     I    89_A     I    89_A     25   43   79     10   21   55   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     T    90_A     T    90_A     25   43   79     10   21   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     L    91_A     L    91_A     25   43   79      6   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     F    92_A     F    92_A     25   43   79      6   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     E    93_A     E    93_A     11   43   79      6   34   56   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     D    94_A     D    94_A     11   43   79      4   34   56   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     D    95_A     D    95_A     11   43   79     14   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     I    96_A     I    96_A     11   43   79     14   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     L    97_A     L    97_A     11   43   79      6   24   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     L    98_A     L    98_A     11   43   79      3   19   47   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     G    99_A     G    99_A      5   43   79      3   10   25   57   97  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     E   100_A     E   100_A      6   43   79      3    9   47   73  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     N   101_A     N   101_A      8   43   79      4    7   25   54   94  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     A   102_A     A   102_A      8   43   79      3    7   22   59   94  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     N   103_A     N   103_A      8   43   79      3    8   29   59   91  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     K   104_A     K   104_A      8   43   79      4   13   37   63   94  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     F   105_A     F   105_A      8   39   79      4   14   28   50   77  113  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     L   106_A     L   106_A      8   19   79      4    7   12   20   48   72  102  137  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     A   107_A     A   107_A      8   19   79      3    6    9   20   28   41   71  104  131  155  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     E   108_A     E   108_A      8   19   79      3    6    9   18   25   49   73  100  125  143  162  167  171  172  174  177  177  178  180  180 
LCS_GDT     G   109_A     G   109_A      7   19   79      3    8   11   17   29   49   75  112  135  155  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     D   110_A     D   110_A      7   19   79      4    8   14   29   63   86  110  137  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     W   111_A     W   111_A      7   11   79      4    8   10   24   50   68   95  129  148  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     L   112_A     L   112_A      7   11   79      4   10   29   59   84  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     K   113_A     K   113_A      7   11   79      4   13   39   65   98  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     V   114_A     V   114_A      7   11   79      4   15   29   59   84  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     R   115_A     R   115_A      6   11   79      2    4   14   28   70  104  129  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     F   116_A     F   116_A      4   11   79      7   15   44   76  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     N   117_A     N   117_A      4   11   79      5   20   46   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     F   118_A     F   118_A      4   11   79      3   15   42   70  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     Q   119_A     Q   119_A      4   10   79      4   14   38   62   96  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     E   120_A     E   120_A      4    9   79      3   14   27   57   81  115  134  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     I   121_A     I   121_A      4    9   79      3    4    8   13   30   52   81  107  131  152  159  164  171  172  174  177  177  178  180  180 
LCS_GDT     F   122_A     F   122_A      5    9   79      4   12   27   61   98  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     V   123_A     V   123_A      5    9   79      4   15   36   61   98  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     L   124_A     L   124_A      5    9   79      4    6   19   38   84  118  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     R   125_A     R   125_A      5    9   79      4    7   14   34   72   95  129  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     L   126_A     L   126_A      5    9   79      3    4    6    9   23   42   62   88  118  150  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     E   127_A     E   127_A      3    9   79      3    3    5   10   16   42   57   88  108  135  161  167  171  172  174  177  177  178  180  180 
LCS_GDT     T   128_A     T   128_A      4    9   79      3    3   16   28   42   79  107  138  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     F   129_A     F   129_A      4    9   79      3    3    5    7   23   37  100  128  148  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     L   130_A     L   130_A      4    9   79      3    3    5   11   23   66  103  130  148  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     M   131_A     M   131_A      4    9   79      3    3   11   40   69  107  128  140  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     P   132_A     P   132_A      3   10   79      3    3    8   34   93  118  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     V   133_A     V   133_A      6   10   79      3   11   29   57   79  110  120  130  143  150  156  161  168  172  174  177  177  178  180  180 
LCS_GDT     Q   134_A     Q   134_A      6   10   79      3    5    6   13   25   32   50   66   84  101  125  132  144  155  160  169  172  176  178  180 
LCS_GDT     L   135_A     L   135_A      6   10   79      4    5    9   13   16   17   19   28   40   52   59   71   89  105  117  126  138  146  157  166 
LCS_GDT     E   136_A     E   136_A      6   10   30      4    5    8   13   16   17   19   21   23   24   26   34   55   61   77   89  102  114  125  134 
LCS_GDT     K   137_A     K   137_A      6   10   30      4    4    6    9   16   17   19   21   23   24   26   31   37   44   46   64   70   76   94   99 
LCS_GDT     Q   138_A     Q   138_A      6   10   30      4    4    6    8   10   14   19   21   23   24   26   28   29   32   38   46   48   66   70   77 
LCS_GDT     T   139_A     T   139_A      6   10   30      3    5    6   13   16   17   19   21   23   24   26   28   29   30   32   39   45   56   60   64 
LCS_GDT     Q   140_A     Q   140_A      3   15   30      3    4    4    8   15   16   18   21   23   24   26   28   29   32   38   46   48   58   62   65 
LCS_GDT     I   141_A     I   141_A      3   15   30      3    4    6    7   10   13   18   21   23   24   28   31   34   38   43   49   53   58   67   73 
LCS_GDT     P   142_A     P   142_A      3   15   30      3    3    3    5   11   16   18   21   23   24   28   31   34   38   45   49   53   58   67   73 
LCS_GDT     P   143_A     P   143_A      3   15   30      3    3    8   13   16   17   19   21   23   24   28   31   34   39   45   49   53   62   67   73 
LCS_GDT     F   144_A     F   144_A      6   15   30      4    6    9   13   16   17   19   21   23   24   26   28   29   30   32   35   37   38   38   41 
LCS_GDT     Q   145_A     Q   145_A      7   15   30      5    6    8   13   16   17   19   21   23   24   26   28   29   30   32   35   37   38   38   41 
LCS_GDT     Q   146_A     Q   146_A      9   15   30      5    6    9   13   16   17   19   21   23   24   26   28   29   30   32   35   37   59   65   73 
LCS_GDT     R   147_A     R   147_A      9   15   30      5    7    9   13   16   17   19   21   23   24   26   28   29   30   32   35   37   38   63   73 
LCS_GDT     D   148_A     D   148_A      9   15   30      5    7    9   13   16   17   19   21   23   24   26   28   36   41   46   54   55   62   67   73 
LCS_GDT     I   149_A     I   149_A      9   15   30      5    7    9   13   16   17   19   21   23   24   28   31   34   38   46   54   55   62   67   73 
LCS_GDT     D   150_A     D   150_A      9   15   30      4    4    8   13   16   17   19   21   22   24   30   31   38   42   49   62   71   78   85   90 
LCS_GDT     I   151_A     I   151_A      9   15   30      4    7    9   13   16   17   19   21   23   24   30   31   38   44   55   64   71   81   94   99 
LCS_GDT     L   152_A     L   152_A      9   15   65      4    7    9   13   16   17   19   22   23   33   50   60   65   70   84   96  108  118  126  135 
LCS_GDT     T   153_A     T   153_A      9   15   67      4    7    9   13   16   17   19   22   35   46   57   74   86   97  116  124  139  152  161  167 
LCS_GDT     S   154_A     S   154_A      9   15   67      3    7    9   13   15   17   26   38   52   70   85   97  124  142  155  162  172  174  177  179 
LCS_GDT     K   155_A     K   155_A      4   23   67      3    4    4   10   22   30   41   60   87   94  132  146  156  166  170  174  176  177  179  180 
LCS_GDT     H   156_A     H   156_A      4   25   67      2   12   27   45   67   94  127  142  149  156  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     F   157_A     F   157_A      4   25   67      4    7   11   35   60   93  112  137  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     G   158_A     G   158_A      6   25   67      3   16   39   77  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     T   159_A     T   159_A     17   25   67      4   22   46   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     A   160_A     A   160_A     17   25   67      5   17   36   73  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     G   161_A     G   161_A     17   25   67      3   17   34   62  105  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     Y   162_A     Y   162_A     17   25   67      8   24   46   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     V   163_A     V   163_A     17   25   67      7   22   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     I   164_A     I   164_A     17   25   67      7   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     S   165_A     S   165_A     17   25   67      5   18   56   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     Q   166_A     Q   166_A     17   25   67     10   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     G   167_A     G   167_A     17   25   67      6   32   55   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     A   168_A     A   168_A     17   25   67      6   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     A   169_A     A   169_A     17   25   67      6   20   56   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     K   170_A     K   170_A     17   25   67     10   21   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     Y   171_A     Y   171_A     17   25   67     10   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     L   172_A     L   172_A     17   25   67     10   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     I   173_A     I   173_A     17   25   67      9   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     A   174_A     A   174_A     17   25   67     10   35   56   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     L   175_A     L   175_A     17   25   67     10   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     F   176_A     F   176_A     17   25   67     10   20   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     E   177_A     E   177_A     17   25   67      4   20   36   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     K   178_A     K   178_A     17   25   67      4   16   36   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     L   179_A     L   179_A     17   25   67      6   18   32   84  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     T   180_A     T   180_A     17   25   67      4    6   16   47   93  115  132  143  149  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     T   181_A     T   181_A      5   25   67      3    5    5    5   15   47   66  111  139  154  161  166  171  172  174  177  177  178  180  180 
LCS_GDT     E   182_A     E   182_A      5   19   67      3    5    5    5   17   26   47   79  105  132  149  163  169  172  174  175  177  178  179  180 
LCS_GDT     E   183_A     E   183_A      5   11   67      3    5    9   13   42   64   94  125  141  153  162  167  170  172  174  177  177  178  179  180 
LCS_GDT     I   184_A     I   184_A      8   23   67      3    8   27   60  101  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     K   185_A     K   185_A      8   23   67      5   20   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     P   186_A     P   186_A      8   23   67      5   20   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     I   187_A     I   187_A      8   23   67     11   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     D   188_A     D   188_A      8   23   67      4   18   46   72  100  116  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     E   189_A     E   189_A      8   23   67      4   18   46   72  100  116  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     I   190_A     I   190_A      8   23   67      4   26   48   72  102  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     M   191_A     M   191_A      8   23   67     12   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     F   192_A     F   192_A      6   23   67      4   26   47   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     N   193_A     N   193_A      6   23   67      4   13   37   65   98  117  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     Q   194_A     Q   194_A      5   23   67      3    6   18   49   77  117  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     Q   195_A     Q   195_A      5   23   67      3   10   28   69  100  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     I   196_A     I   196_A      5   23   67      3    9   37   61   85  115  129  144  149  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     N   197_A     N   197_A      6   23   67      6   29   48   88  105  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     A   198_A     A   198_A      6   23   67     10   26   44   69  100  119  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     T   199_A     T   199_A      6   23   67     10   30   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     D   200_A     D   200_A      6   23   67      7   30   51   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     Y   201_A     Y   201_A      6   23   67      6   35   59   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     R   202_A     R   202_A      7   23   67      1   17   46   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     V   203_A     V   203_A      7   23   67      5   17   42   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     Y   204_A     Y   204_A      7   23   67      4   17   42   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     Q   205_A     Q   205_A      7   23   67      4   12   44   82  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     L   206_A     L   206_A      7   23   67      4   19   43   77  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     N   207_A     N   207_A      7   23   67      4    7   26   52   86  114  132  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     P   208_A     P   208_A      7   19   67      4    5   12   37   62   85  116  135  147  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     A   209_A     A   209_A      3   19   67      3    4   11   32   59   87  124  140  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     I   210_A     I   210_A      3   19   67      3    3   16   44   70  109  132  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     C   211_A     C   211_A      5   19   67      3   13   36   69  100  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     V   212_A     V   212_A      5   19   67      4   18   47   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     Q   213_A     Q   213_A      5   19   67      6   20   47   88  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     E   214_A     E   214_A      5   19   67      3   10   21   54   80  110  128  141  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     L   215_A     L   215_A      5    8   67      4   17   43   78  106  120  136  144  151  157  163  167  171  172  174  177  177  178  180  180 
LCS_GDT     Q   216_A     Q   216_A      3    8   67      4    6   20   25   43   54   93  108  125  139  150  161  168  169  172  177  177  178  180  180 
LCS_GDT     L   217_A     L   217_A      3    8   67      4   12   20   33   48   76   93  110  131  141  150  161  168  169  173  177  177  178  180  180 
LCS_GDT     N   218_A     N   218_A      3    8   67      4    5    7   18   34   52   66   80  101  120  134  150  158  169  172  173  177  178  180  180 
LCS_GDT     Q   219_A     Q   219_A      4    5   67      3    3    4    4    7   18   30   52   58   70   74   82   93  101  115  125  152  165  173  176 
LCS_GDT     E   220_A     E   220_A      4    5   67      3    3    4    4    7   12   16   30   38   49   57   69   75   94  106  112  119  126  153  165 
LCS_GDT     A   221_A     A   221_A      4    5   67      3    3    6   12   18   22   26   38   46   55   63   72   79  111  123  136  149  168  173  175 
LCS_GDT     S   222_A     S   222_A      4    5   67      3    3   15   21   23   26   31   45   68   85  101  126  142  154  163  169  174  176  179  180 
LCS_GDT     L   223_A     L   223_A      3    4   67      3    3    5    7   10   11   12   14   38   45   53   71   83  103  118  133  149  161  170  172 
LCS_GDT     L   224_A     L   224_A      3    4   23      3    3    5    7   10   11   12   15   15   17   22   27   30   37   75   93  114  121  132  147 
LCS_GDT     V   225_A     V   225_A      3   15   23      3    3    3    5   14   14   14   16   16   16   22   31   34   47   55   65   83  102  116  126 
LCS_GDT     S   226_A     S   226_A      4   15   23      3    4    6    9   12   14   14   16   16   16   22   27   30   36   43   59   73   87  102  116 
LCS_GDT     N   227_A     N   227_A      4   15   23      3    4   10   13   14   14   14   16   16   17   22   27   30   36   41   49   56   66   79   85 
LCS_GDT     L   228_A     L   228_A     10   15   23      3    7   10   13   14   14   14   16   16   16   21   25   30   33   38   42   47   55   63   73 
LCS_GDT     E   229_A     E   229_A     10   15   23      3    7   11   13   14   14   14   16   16   16   21   27   30   36   41   49   61   72   81   91 
LCS_GDT     Q   230_A     Q   230_A     10   15   23      3    6   11   13   14   14   14   16   16   18   22   27   38   46   59   79   92  102  113  123 
LCS_GDT     E   231_A     E   231_A     10   15   23      3    5   11   13   14   14   14   16   16   17   22   27   30   36   42   50   62   72   90  104 
LCS_GDT     R   232_A     R   232_A     10   15   23      4    8   11   13   14   14   14   16   16   16   17   20   27   32   38   42   50   56   66   75 
LCS_GDT     K   233_A     K   233_A     10   15   23      4    8   11   13   14   14   14   16   16   16   18   22   28   36   40   49   62   72   89  104 
LCS_GDT     I   234_A     I   234_A     10   15   23      4    8   11   13   14   14   14   16   16   16   18   24   30   36   41   50   62   72   89  104 
LCS_GDT     N   235_A     N   235_A     10   15   23      4    8   11   13   14   14   14   16   16   16   17   20   27   30   38   42   49   54   62   73 
LCS_GDT     L   236_A     L   236_A     10   15   23      4    8   11   13   14   14   14   16   16   16   17   18   20   25   29   37   44   47   55   64 
LCS_GDT     K   237_A     K   237_A     10   15   23      4    8   11   13   14   14   14   16   16   16   17   18   21   28   34   41   49   58   68   79 
LCS_GDT     Y   238_A     Y   238_A     10   15   23      4    8   11   13   14   14   14   16   16   16   17   18   19   21   32   37   44   52   60   79 
LCS_GDT     E   239_A     E   239_A      9   15   23      4    8   11   13   14   14   14   16   16   16   17   18   19   21   26   31   34   37   42   55 
LCS_GDT     K   240_A     K   240_A      4   15   23      3    4    4    6    9   13   14   16   16   16   17   17   18   19   26   31   34   37   42   52 
LCS_AVERAGE  LCS_A:  13.45  (   4.95   10.14   25.25 )

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     14     35     59     88    106    120    136    144    151    157    163    167    171    172    174    177    177    178    180    180 
GDT PERCENT_AT   5.86  14.64  24.69  36.82  44.35  50.21  56.90  60.25  63.18  65.69  68.20  69.87  71.55  71.97  72.80  74.06  74.06  74.48  75.31  75.31
GDT RMS_LOCAL    0.33   0.75   1.16   1.47   1.67   1.91   2.17   2.33   2.62   2.70   2.87   3.05   3.21   3.28   3.35   3.50   3.50   3.55   3.89   3.81
GDT RMS_ALL_AT  14.91  14.85  14.85  14.92  14.95  15.03  15.05  15.08  15.19  15.18  15.22  15.25  15.26  15.21  15.24  15.20  15.20  15.21  15.13  15.15

# Checking swapping
#   possible swapping detected:  E    25_A      E    25_A
#   possible swapping detected:  F    36_A      F    36_A
#   possible swapping detected:  F    37_A      F    37_A
#   possible swapping detected:  D    48_A      D    48_A
#   possible swapping detected:  F    75_A      F    75_A
#   possible swapping detected:  D    87_A      D    87_A
#   possible swapping detected:  F    92_A      F    92_A
#   possible swapping detected:  E    93_A      E    93_A
#   possible swapping detected:  D    95_A      D    95_A
#   possible swapping detected:  F   105_A      F   105_A
#   possible swapping detected:  E   120_A      E   120_A
#   possible swapping detected:  F   144_A      F   144_A
#   possible swapping detected:  D   148_A      D   148_A
#   possible swapping detected:  D   150_A      D   150_A
#   possible swapping detected:  Y   162_A      Y   162_A
#   possible swapping detected:  Y   171_A      Y   171_A
#   possible swapping detected:  F   176_A      F   176_A
#   possible swapping detected:  E   183_A      E   183_A
#   possible swapping detected:  D   200_A      D   200_A
#   possible swapping detected:  E   229_A      E   229_A
#   possible swapping detected:  E   231_A      E   231_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    N     2_A      N     2_A     5.302     0    0.722   0.910     7.533   16.905   19.226
LGA    S     3_A      S     3_A     6.093     0    0.116   0.248     6.770   24.048   21.111
LGA    T     4_A      T     4_A     6.743     0    0.548   0.742     9.180   15.357   10.408
LGA    E     5_A      E     5_A     7.187     0    0.586   1.540    14.461   17.143    7.937
LGA    N     6_A      N     6_A     5.514     0    0.137   1.094     8.193   24.881   15.714
LGA    K     7_A      K     7_A     2.890     0    0.786   1.894     4.554   62.976   50.794
LGA    N     8_A      N     8_A     1.299     0    0.158   0.934     2.876   79.286   75.298
LGA    F     9_A      F     9_A     1.220     0    0.045   1.088     4.740   81.429   69.307
LGA    V    10_A      V    10_A     1.802     0    0.243   0.435     3.447   70.833   66.122
LGA    I    11_A      I    11_A     1.427     0    0.134   1.632     3.717   81.429   69.583
LGA    S    12_A      S    12_A     0.889     0    0.125   0.154     1.534   88.214   84.524
LGA    I    13_A      I    13_A     1.173     0    0.107   1.551     4.385   77.381   67.679
LGA    S    14_A      S    14_A     2.519     0    0.154   0.513     3.713   55.833   58.889
LGA    T    15_A      T    15_A     4.043     0    0.179   0.194     6.858   50.357   38.912
LGA    A    16_A      A    16_A     0.785     0    0.200   0.224     1.813   83.810   81.619
LGA    E    17_A      E    17_A     0.928     0    0.083   1.172     6.301   88.333   62.169
LGA    Q    18_A      Q    18_A     1.563     0    0.125   1.135     6.386   79.286   59.841
LGA    R    19_A      R    19_A     1.210     0    0.036   1.513     6.964   79.286   61.558
LGA    R    20_A      R    20_A     1.568     0    0.075   0.980     3.002   72.976   68.615
LGA    N    21_A      N    21_A     1.814     0    0.089   1.127     4.359   72.857   68.452
LGA    H    22_A      H    22_A     1.669     0    0.026   0.160     2.019   72.857   72.048
LGA    I    23_A      I    23_A     1.549     0    0.081   1.045     3.999   70.833   69.226
LGA    I    24_A      I    24_A     1.882     0    0.135   1.338     5.171   70.833   60.119
LGA    E    25_A      E    25_A     2.079     0    0.073   0.789     3.572   70.833   65.079
LGA    Q    26_A      Q    26_A     1.997     0    0.053   1.042     3.896   70.833   62.593
LGA    F    27_A      F    27_A     2.103     0    0.110   0.746     3.099   64.881   63.593
LGA    T    28_A      T    28_A     1.705     0    0.190   0.932     3.140   72.857   72.109
LGA    H    29_A      H    29_A     1.898     0    0.045   1.059     6.927   70.833   49.571
LGA    Q    30_A      Q    30_A     2.265     0    0.176   0.533     4.243   68.810   55.556
LGA    N    31_A      N    31_A     2.055     0    0.310   1.310     7.418   62.857   44.167
LGA    I    32_A      I    32_A     2.336     0    0.154   0.710     3.341   66.786   61.131
LGA    P    33_A      P    33_A     2.438     0    0.070   0.399     2.475   64.762   64.762
LGA    F    34_A      F    34_A     2.272     0    0.184   1.266     5.480   62.857   54.892
LGA    E    35_A      E    35_A     2.443     0    0.052   0.823     6.826   66.786   49.735
LGA    F    36_A      F    36_A     1.975     0    0.162   0.548     4.981   68.810   54.416
LGA    F    37_A      F    37_A     1.233     0    0.052   0.371     2.555   85.952   79.394
LGA    D    38_A      D    38_A     0.258     0    0.105   0.816     2.120   90.595   81.845
LGA    A    39_A      A    39_A     0.718     0    0.251   0.241     0.946   92.857   92.381
LGA    F    40_A      F    40_A     1.220     0    0.042   0.243     1.962   88.333   80.823
LGA    T    41_A      T    41_A     1.752     0    0.177   0.245     2.810   69.048   69.660
LGA    P    42_A      P    42_A     3.662     0    0.539   0.540     4.853   43.810   41.973
LGA    S    43_A      S    43_A     8.613     0    0.425   0.476    11.468    3.214    2.143
LGA    D    44_A      D    44_A    15.338     0    0.359   1.098    18.079    0.000    0.000
LGA    K    45_A      K    45_A    18.261     0    0.475   1.045    26.002    0.000    0.000
LGA    L    46_A      L    46_A    18.398     0    0.541   0.992    20.771    0.000    0.000
LGA    T    47_A      T    47_A    21.185     0    0.161   1.296    25.248    0.000    0.000
LGA    D    48_A      D    48_A    28.302     0    0.043   1.303    33.261    0.000    0.000
LGA    H    49_A      H    49_A    26.224     0    0.288   1.443    26.864    0.000    0.000
LGA    L    50_A      L    50_A    20.848     0    0.145   1.056    23.340    0.000    0.000
LGA    Q    51_A      Q    51_A    25.619     0    0.224   1.343    29.689    0.000    0.000
LGA    R    52_A      R    52_A    29.539     0    0.102   1.226    36.277    0.000    0.000
LGA    Y    53_A      Y    53_A    24.012     0    0.355   1.387    25.625    0.000    0.000
LGA    L    54_A      L    54_A    19.254     0    0.139   1.297    20.954    0.000    0.000
LGA    P    55_A      P    55_A    21.560     0    0.066   0.245    24.722    0.000    0.000
LGA    N    56_A      N    56_A    16.959     0    0.347   1.037    20.201    0.000    0.000
LGA    V    57_A      V    57_A    12.060     0    0.068   0.658    14.194    0.000    0.000
LGA    A    58_A      A    58_A    13.790     0    0.087   0.118    16.153    0.000    0.000
LGA    N    59_A      N    59_A    14.074     0    0.227   1.028    18.642    0.000    0.000
LGA    A    60_A      A    60_A     8.340     0    0.527   0.510    10.334    6.190    5.238
LGA    A    61_A      A    61_A     6.086     0    0.363   0.370     8.315   30.238   25.143
LGA    Q    62_A      Q    62_A     2.139     0    0.362   0.997     8.847   60.952   36.032
LGA    L    63_A      L    63_A     2.735     0    0.072   1.357     3.579   59.048   52.857
LGA    T    64_A      T    64_A     2.236     0    0.103   1.195     3.795   55.714   55.578
LGA    M    65_A      M    65_A     4.713     0    0.179   1.408    11.717   37.262   23.036
LGA    G    66_A      G    66_A     4.118     0    0.078   0.078     4.597   40.476   40.476
LGA    E    67_A      E    67_A     3.340     0    0.098   1.085     8.081   51.905   37.831
LGA    K    68_A      K    68_A     3.166     0    0.130   1.392     4.616   51.786   48.095
LGA    G    69_A      G    69_A     3.507     0    0.089   0.089     3.507   53.810   53.810
LGA    C    70_A      C    70_A     2.245     0    0.159   0.827     3.168   66.905   62.460
LGA    L    71_A      L    71_A     1.514     0    0.028   1.061     5.660   77.143   57.917
LGA    M    72_A      M    72_A     2.058     0    0.088   1.003     6.824   68.810   50.298
LGA    S    73_A      S    73_A     1.296     0    0.037   0.810     2.779   79.286   75.952
LGA    H    74_A      H    74_A     0.854     0    0.026   1.308     6.605   90.476   62.810
LGA    F    75_A      F    75_A     1.338     0    0.060   0.878     5.264   79.286   59.091
LGA    M    76_A      M    76_A     1.756     0    0.045   0.866     3.671   72.976   68.214
LGA    L    77_A      L    77_A     1.441     0    0.068   0.122     2.024   79.286   76.131
LGA    W    78_A      W    78_A     1.393     0    0.083   0.334     4.070   81.429   63.503
LGA    K    79_A      K    79_A     1.761     0    0.029   0.889     4.490   72.857   67.989
LGA    K    80_A      K    80_A     2.096     0    0.020   1.176     5.210   66.786   61.534
LGA    C    81_A      C    81_A     2.169     0    0.061   0.639     3.498   68.810   65.000
LGA    I    82_A      I    82_A     1.873     0    0.144   0.548     2.777   72.857   68.988
LGA    D    83_A      D    83_A     1.785     0    0.152   0.631     2.409   68.810   71.905
LGA    E    84_A      E    84_A     2.077     0    0.107   0.513     2.789   66.786   68.466
LGA    N    85_A      N    85_A     1.894     0    0.155   1.101     6.138   75.000   55.655
LGA    L    86_A      L    86_A     1.135     0    0.165   1.093     3.594   81.429   73.631
LGA    D    87_A      D    87_A     1.759     0    0.047   0.443     2.984   72.857   65.952
LGA    Y    88_A      Y    88_A     1.876     0    0.077   1.309     5.462   72.857   60.913
LGA    I    89_A      I    89_A     1.331     0    0.045   1.225     3.386   79.286   70.357
LGA    T    90_A      T    90_A     1.038     0    0.144   1.110     2.882   85.952   79.320
LGA    L    91_A      L    91_A     1.017     0    0.090   0.995     2.508   88.214   79.702
LGA    F    92_A      F    92_A     1.371     0    0.148   0.491     3.552   77.143   68.528
LGA    E    93_A      E    93_A     1.841     0    0.115   0.470     2.702   75.000   68.466
LGA    D    94_A      D    94_A     1.816     0    0.401   0.868     3.519   63.095   65.417
LGA    D    95_A      D    95_A     1.566     0    0.241   0.718     3.178   72.976   69.048
LGA    I    96_A      I    96_A     1.472     0    0.185   1.427     4.711   71.071   64.881
LGA    L    97_A      L    97_A     0.938     0    0.219   0.815     1.614   88.214   86.012
LGA    L    98_A      L    98_A     1.439     0    0.284   1.030     4.955   77.262   67.976
LGA    G    99_A      G    99_A     3.061     0    0.474   0.474     3.061   57.262   57.262
LGA    E   100_A      E   100_A     2.451     0    0.136   1.000     3.168   57.262   59.735
LGA    N   101_A      N   101_A     3.179     0    0.272   1.077     6.837   53.571   38.690
LGA    A   102_A      A   102_A     2.917     0    0.096   0.121     3.769   55.357   52.952
LGA    N   103_A      N   103_A     2.833     0    0.155   0.851     5.760   59.167   47.083
LGA    K   104_A      K   104_A     3.385     0    0.059   1.549     9.837   45.476   30.847
LGA    F   105_A      F   105_A     4.271     0    0.139   1.119     6.631   33.333   31.732
LGA    L   106_A      L   106_A     5.860     0    0.174   0.227     7.421   19.048   23.333
LGA    A   107_A      A   107_A     7.536     0    0.138   0.145     9.719    5.952    7.429
LGA    E   108_A      E   108_A     9.498     0    0.678   0.973    10.337    2.024    1.958
LGA    G   109_A      G   109_A     8.423     0    0.311   0.311     8.683    8.690    8.690
LGA    D   110_A      D   110_A     6.793     0    0.276   1.021    11.650   14.762    8.631
LGA    W   111_A      W   111_A     6.872     0    0.217   1.151    13.017   21.071    6.803
LGA    L   112_A      L   112_A     3.457     0    0.326   0.968     5.681   54.762   48.036
LGA    K   113_A      K   113_A     2.991     0    0.106   1.086    10.694   63.333   36.455
LGA    V   114_A      V   114_A     3.679     0    0.202   0.281     4.901   43.452   38.299
LGA    R   115_A      R   115_A     4.216     0    0.148   1.615    13.235   45.119   19.827
LGA    F   116_A      F   116_A     2.084     0    0.652   1.487     7.258   57.857   48.139
LGA    N   117_A      N   117_A     1.349     0    0.414   1.145     4.324   81.429   67.024
LGA    F   118_A      F   118_A     2.469     0    0.183   1.062     7.223   66.786   38.009
LGA    Q   119_A      Q   119_A     3.526     0    0.302   0.976     5.305   43.452   37.460
LGA    E   120_A      E   120_A     3.990     0    0.410   0.751     6.447   32.500   38.836
LGA    I   121_A      I   121_A     7.373     0    0.754   0.865    13.584   22.262   11.190
LGA    F   122_A      F   122_A     3.120     0    0.278   1.108     9.493   42.143   26.320
LGA    V   123_A      V   123_A     2.987     0    0.059   1.065     5.168   55.357   49.660
LGA    L   124_A      L   124_A     3.736     0    0.162   1.095     4.787   38.810   44.524
LGA    R   125_A      R   125_A     4.429     0    0.053   1.581     5.948   30.833   44.719
LGA    L   126_A      L   126_A     8.028     0    0.362   0.855    10.617    5.357    3.452
LGA    E   127_A      E   127_A     8.424     0    0.631   0.711    10.363    4.881    3.175
LGA    T   128_A      T   128_A     5.791     0    0.694   0.826     6.788   18.214   18.435
LGA    F   129_A      F   129_A     6.725     0    0.211   0.595     8.580   14.286   11.126
LGA    L   130_A      L   130_A     6.249     0    0.668   1.122     8.263   13.095   16.905
LGA    M   131_A      M   131_A     5.201     0    0.156   0.788     8.298   41.786   25.357
LGA    P   132_A      P   132_A     3.605     0    0.545   0.506     6.051   41.786   33.129
LGA    V   133_A      V   133_A     6.542     0    0.111   1.266     8.975   15.595   10.748
LGA    Q   134_A      Q   134_A    13.098     0    0.311   1.509    15.880    0.000    0.000
LGA    L   135_A      L   135_A    19.306     0    0.240   1.171    21.817    0.000    0.000
LGA    E   136_A      E   136_A    26.066     0    0.115   1.117    28.403    0.000    0.000
LGA    K   137_A      K   137_A    32.736     0    0.112   1.127    35.161    0.000    0.000
LGA    Q   138_A      Q   138_A    38.294     0    0.286   1.139    41.399    0.000    0.000
LGA    T   139_A      T   139_A    45.362     0    0.667   0.583    46.414    0.000    0.000
LGA    Q   140_A      Q   140_A    46.814     0    0.536   1.354    49.050    0.000    0.000
LGA    I   141_A      I   141_A    44.308     0    0.154   1.556    44.525    0.000    0.000
LGA    P   142_A      P   142_A    46.591     0    0.152   0.193    47.751    0.000    0.000
LGA    P   143_A      P   143_A    47.111     0    0.148   0.305    50.145    0.000    0.000
LGA    F   144_A      F   144_A    48.903     0    0.260   1.225    52.077    0.000    0.000
LGA    Q   145_A      Q   145_A    49.441     0    0.091   1.095    55.819    0.000    0.000
LGA    Q   146_A      Q   146_A    43.232     0    0.299   1.298    45.775    0.000    0.000
LGA    R   147_A      R   147_A    39.379     0    0.183   1.736    43.821    0.000    0.000
LGA    D   148_A      D   148_A    36.937     0    0.164   1.038    37.133    0.000    0.000
LGA    I   149_A      I   149_A    36.726     0    0.141   1.261    40.553    0.000    0.000
LGA    D   150_A      D   150_A    32.370     0    0.162   1.158    33.574    0.000    0.000
LGA    I   151_A      I   151_A    29.128     0    0.141   1.083    31.874    0.000    0.000
LGA    L   152_A      L   152_A    21.644     0    0.292   0.923    24.534    0.000    0.000
LGA    T   153_A      T   153_A    18.659     0    0.311   0.398    19.586    0.000    0.000
LGA    S   154_A      S   154_A    13.470     0    0.469   0.976    15.280    0.000    0.000
LGA    K   155_A      K   155_A    10.524     0    0.259   0.805    18.173    2.381    1.058
LGA    H   156_A      H   156_A     4.998     0    0.550   1.292     7.181   24.762   27.238
LGA    F   157_A      F   157_A     4.967     0    0.403   1.094     7.426   37.381   24.459
LGA    G   158_A      G   158_A     1.902     0    0.551   0.551     2.456   68.810   68.810
LGA    T   159_A      T   159_A     1.050     0    0.138   0.692     1.850   79.286   77.755
LGA    A   160_A      A   160_A     2.465     0    0.357   0.376     3.668   66.786   62.095
LGA    G   161_A      G   161_A     2.564     0    0.322   0.322     2.606   62.976   62.976
LGA    Y   162_A      Y   162_A     1.429     0    0.207   0.962     6.302   85.952   60.635
LGA    V   163_A      V   163_A     0.597     0    0.048   0.985     3.932   90.476   78.776
LGA    I   164_A      I   164_A     1.406     0    0.068   1.496     2.986   79.405   71.310
LGA    S   165_A      S   165_A     2.286     0    0.102   0.616     5.318   70.833   59.921
LGA    Q   166_A      Q   166_A     1.281     0    0.174   1.140     5.922   75.000   57.831
LGA    G   167_A      G   167_A     2.046     0    0.043   0.043     2.046   68.810   68.810
LGA    A   168_A      A   168_A     1.863     0    0.066   0.080     1.895   72.857   72.857
LGA    A   169_A      A   169_A     1.520     0    0.128   0.132     1.651   75.000   74.571
LGA    K   170_A      K   170_A     1.610     0    0.143   0.857     4.608   72.857   64.709
LGA    Y   171_A      Y   171_A     1.552     0    0.085   0.333     2.391   77.143   73.016
LGA    L   172_A      L   172_A     1.492     0    0.046   0.820     4.045   81.429   68.810
LGA    I   173_A      I   173_A     0.952     0    0.161   0.782     3.293   83.690   78.631
LGA    A   174_A      A   174_A     1.760     0    0.207   0.207     2.418   72.976   71.333
LGA    L   175_A      L   175_A     1.528     0    0.115   1.280     4.012   72.857   68.452
LGA    F   176_A      F   176_A     1.734     0    0.119   0.320     2.675   72.857   69.221
LGA    E   177_A      E   177_A     2.031     0    0.100   0.584     3.299   66.786   61.534
LGA    K   178_A      K   178_A     2.031     0    0.263   1.342     7.021   68.810   56.243
LGA    L   179_A      L   179_A     2.527     0    0.106   0.252     3.417   60.952   58.155
LGA    T   180_A      T   180_A     4.043     0    0.076   0.585     7.352   32.262   25.986
LGA    T   181_A      T   181_A     6.113     0    0.075   1.173     9.543   15.000    9.524
LGA    E   182_A      E   182_A     9.292     0    0.190   0.383    10.804    3.214    4.392
LGA    E   183_A      E   183_A     7.729     0    0.324   1.211     9.266   12.262    7.566
LGA    I   184_A      I   184_A     2.800     0    0.353   0.876     4.488   48.690   45.298
LGA    K   185_A      K   185_A     2.193     0    0.064   0.840     7.094   66.786   49.418
LGA    P   186_A      P   186_A     2.158     0    0.086   0.133     2.734   68.810   63.810
LGA    I   187_A      I   187_A     1.610     0    0.113   1.709     4.349   70.833   67.440
LGA    D   188_A      D   188_A     3.218     0    0.247   1.370     7.243   53.571   38.274
LGA    E   189_A      E   189_A     3.448     0    0.200   1.060     6.243   45.119   36.085
LGA    I   190_A      I   190_A     2.963     0    0.196   1.687     6.500   53.690   46.905
LGA    M   191_A      M   191_A     2.034     0    0.111   0.610     3.414   68.810   64.107
LGA    F   192_A      F   192_A     1.375     0    0.427   1.723     7.570   75.000   51.385
LGA    N   193_A      N   193_A     3.319     0    0.236   0.614     5.832   55.357   45.179
LGA    Q   194_A      Q   194_A     3.382     0    0.344   1.018     4.013   51.786   51.852
LGA    Q   195_A      Q   195_A     2.642     0    0.542   1.273     8.015   45.952   36.772
LGA    I   196_A      I   196_A     4.004     0    0.060   1.580     7.027   43.690   40.536
LGA    N   197_A      N   197_A     2.407     0    0.126   1.164     4.371   59.048   57.560
LGA    A   198_A      A   198_A     3.224     0    0.413   0.418     4.598   48.929   47.810
LGA    T   199_A      T   199_A     1.632     0    0.407   1.306     4.379   60.000   59.252
LGA    D   200_A      D   200_A     2.086     0    0.110   0.855     3.717   68.810   61.250
LGA    Y   201_A      Y   201_A     1.818     0    0.113   1.011     6.566   70.952   48.730
LGA    R   202_A      R   202_A     2.385     0    0.164   1.465     8.291   68.810   47.706
LGA    V   203_A      V   203_A     1.839     0    0.136   0.519     3.457   75.000   66.395
LGA    Y   204_A      Y   204_A     1.817     0    0.149   0.797     6.011   70.833   56.746
LGA    Q   205_A      Q   205_A     2.130     0    0.124   1.272     7.249   70.833   50.106
LGA    L   206_A      L   206_A     1.894     0    0.209   1.018     3.279   63.214   64.107
LGA    N   207_A      N   207_A     4.112     0    0.126   1.248     5.797   33.690   38.690
LGA    P   208_A      P   208_A     5.298     0    0.184   0.273     8.817   17.024   12.993
LGA    A   209_A      A   209_A     5.018     0    0.335   0.346     6.431   26.667   30.000
LGA    I   210_A      I   210_A     4.397     0    0.483   1.185     8.980   40.476   29.940
LGA    C   211_A      C   211_A     2.779     0    0.395   0.632     3.840   57.262   53.730
LGA    V   212_A      V   212_A     1.782     0    0.171   1.432     2.844   75.000   70.680
LGA    Q   213_A      Q   213_A     1.329     0    0.084   0.899     2.794   77.143   78.836
LGA    E   214_A      E   214_A     4.073     0    0.501   1.204     9.529   37.143   22.646
LGA    L   215_A      L   215_A     2.303     0    0.727   0.810     4.134   54.048   60.595
LGA    Q   216_A      Q   216_A     8.028     0    0.493   1.227    12.840    7.381    3.333
LGA    L   217_A      L   217_A     7.788     0    0.501   1.080    11.058    3.929   14.464
LGA    N   218_A      N   218_A    10.351     0    0.455   1.246    13.102    0.714    4.821
LGA    Q   219_A      Q   219_A    16.847     0    0.036   0.741    18.855    0.000    0.000
LGA    E   220_A      E   220_A    19.915     0    0.063   0.926    25.224    0.000    0.000
LGA    A   221_A      A   221_A    17.911     0    0.579   0.578    18.111    0.000    0.000
LGA    S   222_A      S   222_A    13.901     0    0.424   0.610    15.516    0.000    0.000
LGA    L   223_A      L   223_A    18.765     0    0.592   0.904    24.213    0.000    0.000
LGA    L   224_A      L   224_A    21.720     0    0.684   1.093    23.536    0.000    0.000
LGA    V   225_A      V   225_A    25.098     0    0.517   0.778    28.659    0.000    0.000
LGA    S   226_A      S   226_A    25.506     0    0.585   0.989    27.493    0.000    0.000
LGA    N   227_A      N   227_A    28.760     0    0.521   1.202    32.202    0.000    0.000
LGA    L   228_A      L   228_A    28.639     0    0.075   0.917    31.257    0.000    0.000
LGA    E   229_A      E   229_A    27.994     0    0.228   1.068    32.492    0.000    0.000
LGA    Q   230_A      Q   230_A    28.457     0    0.300   1.170    30.087    0.000    0.000
LGA    E   231_A      E   231_A    30.559     0    0.067   1.263    33.999    0.000    0.000
LGA    R   232_A      R   232_A    29.521     0    0.207   1.779    35.030    0.000    0.000
LGA    K   233_A      K   233_A    29.396     0    0.077   0.845    30.751    0.000    0.000
LGA    I   234_A      I   234_A    31.623     0    0.099   1.296    33.650    0.000    0.000
LGA    N   235_A      N   235_A    32.237     0    0.142   1.061    33.076    0.000    0.000
LGA    L   236_A      L   236_A    31.181     0    0.097   0.440    31.804    0.000    0.000
LGA    K   237_A      K   237_A    32.415     0    0.217   0.330    33.698    0.000    0.000
LGA    Y   238_A      Y   238_A    32.732     0    0.270   0.583    33.746    0.000    0.000
LGA    E   239_A      E   239_A    32.383     0    0.452   1.117    32.425    0.000    0.000
LGA    K   240_A      K   240_A    33.798     0    0.655   1.787    35.098    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      239     956    956  100.00    1967   1967  100.00               239
SUMMARY(RMSD_GDC):    14.739         14.774                 15.446           42.753   37.612

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  251  239    4.0    144    2.33    46.444    40.550     5.915

LGA_LOCAL      RMSD:   2.335  Number of atoms:  144  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  15.083  Number of assigned atoms:  239 
Std_ASGN_ATOMS RMSD:  14.739  Standard rmsd on all 239 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.547388 * X  +  -0.688128 * Y  +   0.476284 * Z  +  -4.783179
  Y_new =  -0.772817 * X  +   0.197259 * Y  +  -0.603193 * Z  + -31.137714
  Z_new =   0.321123 * X  +  -0.698261 * Y  +  -0.639775 * Z  + -12.930749 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -2.187072 -0.326915 -2.312511   [DEG: -125.3100  -18.7308 -132.4971 ]
ZXZ:  0.668370  2.265001  2.710546   [DEG:   38.2948  129.7750  155.3028 ]
 
# END of job
