
#######################################################
#                                                     #
#                        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  222 ( 1696),  selected  222 , name one
# Molecule2: number of CA atoms  222 ( 1696),  selected  222 , 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:   144      61_A - 204_A       4.90    23.74
  LONGEST_CONTINUOUS_SEGMENT:   144      62_A - 205_A       4.79    23.77
  LONGEST_CONTINUOUS_SEGMENT:   144      63_A - 206_A       4.89    23.76
  LCS_AVERAGE:     51.84

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   126      72_A - 197_A       1.85    26.29
  LONGEST_CONTINUOUS_SEGMENT:   126      73_A - 198_A       1.82    26.56
  LCS_AVERAGE:     38.13

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    92      77_A - 168_A       0.99    26.64
  LCS_AVERAGE:     21.82

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  222
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     G     1_A     G     1_A      3    3   37      3    3    3    3   15   20   24   26   29   31   35   37   50   59   68   75  130  137  140  144 
LCS_GDT     P     2_A     P     2_A      4    4   37      3    4    4   18   23   25   28   30   32   35   36   39   41   59   66  119  130  137  140  143 
LCS_GDT     H     3_A     H     3_A      4    4   37      3    4    4   15   19   22   26   29   32   34   35   39   40   77  117  125  130  137  143  147 
LCS_GDT     M     4_A     M     4_A      4   14   54      3    6   10   15   19   22   25   28   31   34   51   61   67   88   99  124  130  137  143  147 
LCS_GDT     E     5_A     E     5_A      4   14   56      3    4    4    7    9   10   14   18   30   59   70   89   96  108  115  124  130  138  143  147 
LCS_GDT     Q     6_A     Q     6_A     11   24   57      3    6   11   17   19   23   26   29   32   36   41   45   63  113  117  125  130  137  140  147 
LCS_GDT     L     7_A     L     7_A     16   25   58      4   11   13   18   20   25   28   30   32   59   70   89   96  108  115  124  130  138  143  147 
LCS_GDT     E     8_A     E     8_A     17   25   59      4   12   14   18   23   26   29   32   33   37   82   89   96  116  127  131  134  138  143  147 
LCS_GDT     G     9_A     G     9_A     18   25   59      4   12   16   21   25   28   29   32   37   39   43  111  120  123  124  129  134  138  143  147 
LCS_GDT     I    10_A     I    10_A     18   25   62      9   13   17   21   25   28   31   36   38   42   82   89   96  108  115  126  134  138  143  147 
LCS_GDT     M    11_A     M    11_A     18   25   64      4   13   17   21   25   28   34   39   42   59   70   81   91  108  118  128  132  138  143  147 
LCS_GDT     L    12_A     L    12_A     18   25   64     10   15   18   22   25   31   35   39   42   45   50   53   56   60   71   97  134  138  143  147 
LCS_GDT     S    13_A     S    13_A     18   25   64     10   15   18   22   25   29   34   39   41   45  105  111  120  124  127  129  134  138  143  147 
LCS_GDT     P    14_A     P    14_A     18   25   64     10   15   18   22   25   29   35   39   42   45   50   54   56  124  127  129  134  138  143  147 
LCS_GDT     A    15_A     A    15_A     18   25   64     10   15   18   22   25   28   34   39   42   45   82   89   96  108  115  125  134  138  143  147 
LCS_GDT     F    16_A     F    16_A     18   25   64     10   15   18   22   25   31   35   39   42   59   70   75   82  108  115  124  130  138  143  147 
LCS_GDT     Q    17_A     Q    17_A     18   25   64     10   15   18   22   28   33   38   41   46   51   59   62   82   92  103  116  129  138  143  147 
LCS_GDT     E    18_A     E    18_A     18   25   64     10   15   18   22   28   33   38   41   46   59   70   75   91   96  110  118  130  138  143  147 
LCS_GDT     Q    19_A     Q    19_A     18   25   64     10   15   18   22   28   33   38   44   53   57   61   65   67   77   99  101  107  117  126  143 
LCS_GDT     M    20_A     M    20_A     18   36   64     10   15   18   23   31   36   41   47   53   59   61   65   67   77   83   88  102  111  126  130 
LCS_GDT     N    21_A     N    21_A     18   36   64     10   15   18   23   31   36   41   47   53   59   61   65   67   70   83   89  103  112  126  134 
LCS_GDT     A    22_A     A    22_A     18   36   64      9   15   18   23   31   36   41   47   53   59   61   65   67   77   83   88   97  111  126  130 
LCS_GDT     L    23_A     L    23_A     18   36   64      9   14   18   26   31   36   41   47   53   59   61   65   67   70   73   75   79   88   96  113 
LCS_GDT     M    24_A     M    24_A     18   36   64      8   14   19   26   31   36   41   47   53   59   61   65   67   70   73   75   77   84   94  101 
LCS_GDT     L    25_A     L    25_A     18   36   64      8   15   18   26   31   36   41   47   53   59   61   65   67   70   73   75   79   90   96  107 
LCS_GDT     D    26_A     D    26_A     18   36   64      4   15   18   26   31   36   41   47   53   59   61   65   67   70   73   75   77   80   87   96 
LCS_GDT     P    27_A     P    27_A     18   36   64      7   15   18   26   31   36   41   47   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     R    28_A     R    28_A     17   36   64      8   11   15   25   31   36   41   47   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     M    29_A     M    29_A     14   36   64      8   11   19   26   31   36   41   47   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     L    30_A     L    30_A     14   36   64      8   12   19   26   31   36   41   47   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     D    31_A     D    31_A     14   36   64      8   11   17   26   31   36   41   47   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     M    32_A     M    32_A     14   36   64      8   11   19   26   31   36   41   47   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     M    33_A     M    33_A     14   36   64      8   12   19   26   31   36   41   47   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     I    34_A     I    34_A     14   36   64      8   11   17   26   31   36   41   47   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     D    35_A     D    35_A     14   36   64      8   11   19   26   31   36   41   47   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     Q    36_A     Q    36_A     14   36   64      5   12   19   26   31   36   41   47   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     N    37_A     N    37_A     13   36   64      5   11   17   24   30   36   41   47   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     P    38_A     P    38_A     13   36   64      5   11   15   24   30   36   41   47   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     Q    39_A     Q    39_A     13   36   64      5   11   15   20   29   35   41   47   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     L    40_A     L    40_A     13   36   64      5   11   15   24   30   36   41   47   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     R    41_A     R    41_A     13   36   64      5   12   19   26   31   36   41   47   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     N    42_A     N    42_A     13   36   64      4   12   19   26   31   36   41   47   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     M    43_A     M    43_A     13   36   64      7   12   19   26   31   36   41   47   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     G    44_A     G    44_A     13   36   64      8   12   19   26   31   36   41   47   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     P    45_A     P    45_A     13   36   64      8   12   19   26   31   36   41   47   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     E    46_A     E    46_A     13   36   64      8   12   19   26   31   36   41   47   53   59   61   65   67   70   73   75   77   80   83   90 
LCS_GDT     A    47_A     A    47_A     13   36   64      8   12   19   26   31   36   41   47   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     R    48_A     R    48_A     13   36   64      8   12   19   26   31   36   41   47   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     Q    49_A     Q    49_A     13   36   64      8   12   19   26   31   36   41   47   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     M    50_A     M    50_A     13   36   64      8   12   19   26   31   36   41   47   53   59   61   65   67   70   73   75   77   80   83   90 
LCS_GDT     L    51_A     L    51_A     13   36   64      8   11   13   22   31   36   41   45   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     R    52_A     R    52_A     13   36   64      9   11   14   19   30   36   41   46   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     P    53_A     P    53_A     13   36   64      9   11   19   26   31   36   41   47   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     M    54_A     M    54_A     13   36   64      9   11   19   26   31   36   41   47   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     F    55_A     F    55_A     13   36   64      9   15   18   26   31   36   41   47   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     R    56_A     R    56_A     13   36   64      9   11   13   20   30   36   41   47   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     E    57_A     E    57_A     13   36   64      9   11   16   22   30   36   41   47   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     M    58_A     M    58_A     13   36   64      9   11   15   23   30   36   41   47   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     M    59_A     M    59_A     13   33   64      9   11   13   18   21   32   40   47   53   59   61   65   67   70   76   85   97  110  123  129 
LCS_GDT     S    60_A     S    60_A     13   23  142      9   11   12   16   20   32   38   41   53   59   61   65   67   70   73   75   77   90  102  113 
LCS_GDT     N    61_A     N    61_A     13   23  144      5   11   12   16   25   33   39   47   53   59   61   65   67   70   73   75   81   95  110  120 
LCS_GDT     P    62_A     P    62_A     15   23  144      7   11   14   15   19   32   38   44   53   57   70   77   91  103  118  127  135  140  142  142 
LCS_GDT     E    63_A     E    63_A     15   22  144      7   11   14   16   18   22   24   30   31   37   53   64   74   90  106  120  129  140  142  142 
LCS_GDT     S    64_A     S    64_A     15   22  144      7   11   14   16   18   22   24   30   31   37   53   59   66   72   83   94  109  123  129  141 
LCS_GDT     M    65_A     M    65_A     15   22  144      7   11   14   16   24   34   39   47   53   59   71   83   91  104  121  128  135  140  142  147 
LCS_GDT     R    66_A     R    66_A     15   22  144      7   11   14   18   29   35   52   70   83  100  118  126  132  132  132  133  136  140  143  147 
LCS_GDT     S    67_A     S    67_A     15   22  144      7   11   14   16   20   25   27   31   49   56   70   88  105  115  128  133  136  140  142  142 
LCS_GDT     M    68_A     M    68_A     15   22  144      6   11   14   16   20   25   35   46   53   62   73   86   96  116  126  131  136  140  143  147 
LCS_GDT     M    69_A     M    69_A     15   22  144      7   11   14   16   33   51   68   85  100  119  123  127  132  132  132  133  136  140  143  147 
LCS_GDT     N    70_A     N    70_A     15   22  144      6   11   14   27   50   73   97  117  121  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     M    71_A     M    71_A     15   22  144      6   11   14   16   20   25   39   58   78   93  113  126  132  132  132  133  136  140  143  147 
LCS_GDT     G    72_A     G    72_A     15  126  144      4   11   14   16   19   39   59   74   92  109  122  126  132  132  132  133  136  140  143  147 
LCS_GDT     R    73_A     R    73_A     15  126  144      6   27   68   99  113  117  119  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     A    74_A     A    74_A     15  126  144      6   10   14   31   84  107  118  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     W    75_A     W    75_A     15  126  144      6   10   14   22   46   73   96  117  122  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     G    76_A     G    76_A     90  126  144      4   14   45   69  106  113  117  121  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     S    77_A     S    77_A     92  126  144      4   59  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     K    78_A     K    78_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     K    79_A     K    79_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     I    80_A     I    80_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     L    81_A     L    81_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     I    82_A     I    82_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     V    83_A     V    83_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     E    84_A     E    84_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     S    85_A     S    85_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     D    86_A     D    86_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     T    87_A     T    87_A     92  126  144     45  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     A    88_A     A    88_A     92  126  144     45  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     L    89_A     L    89_A     92  126  144     52  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     S    90_A     S    90_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     A    91_A     A    91_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     T    92_A     T    92_A     92  126  144     56  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     L    93_A     L    93_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     R    94_A     R    94_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     S    95_A     S    95_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     A    96_A     A    96_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     L    97_A     L    97_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     E    98_A     E    98_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     G    99_A     G    99_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     R   100_A     R   100_A     92  126  144     42   95  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     G   101_A     G   101_A     92  126  144     42   95  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     F   102_A     F   102_A     92  126  144     52  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     T   103_A     T   103_A     92  126  144     52  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     V   104_A     V   104_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     D   105_A     D   105_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     E   106_A     E   106_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     T   107_A     T   107_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     T   108_A     T   108_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     D   109_A     D   109_A     92  126  144     20   93  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     G   110_A     G   110_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     K   111_A     K   111_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     G   112_A     G   112_A     92  126  144     25   79  106  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     S   113_A     S   113_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     V   114_A     V   114_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     E   115_A     E   115_A     92  126  144     58  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     Q   116_A     Q   116_A     92  126  144     59  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     I   117_A     I   117_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     R   118_A     R   118_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     R   119_A     R   119_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     D   120_A     D   120_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     R   121_A     R   121_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     P   122_A     P   122_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     D   123_A     D   123_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     L   124_A     L   124_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     V   125_A     V   125_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     V   126_A     V   126_A     92  126  144     53  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     L   127_A     L   127_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     A   128_A     A   128_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     V   129_A     V   129_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     D   130_A     D   130_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     L   131_A     L   131_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     S   132_A     S   132_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     A   133_A     A   133_A     92  126  144      3    4    5   93  114  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     G   134_A     G   134_A     92  126  144      5    6   89  107  114  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     Q   135_A     Q   135_A     92  126  144      5   29   82  107  114  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     N   136_A     N   136_A     92  126  144     57  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     G   137_A     G   137_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     Y   138_A     Y   138_A     92  126  144     36  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     L   139_A     L   139_A     92  126  144     26  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     I   140_A     I   140_A     92  126  144     29  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     C   141_A     C   141_A     92  126  144     56  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     G   142_A     G   142_A     92  126  144     55  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     K   143_A     K   143_A     92  126  144     51  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     L   144_A     L   144_A     92  126  144     51  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     K   145_A     K   145_A     92  126  144     56  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     K   146_A     K   146_A     92  126  144     51  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     D   147_A     D   147_A     92  126  144     46  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     D   148_A     D   148_A     92  126  144     39  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     D   149_A     D   149_A     92  126  144     36  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     L   150_A     L   150_A     92  126  144     43  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     K   151_A     K   151_A     92  126  144     55  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     N   152_A     N   152_A     92  126  144     51  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     V   153_A     V   153_A     92  126  144     51  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     P   154_A     P   154_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     I   155_A     I   155_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     V   156_A     V   156_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     I   157_A     I   157_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     I   158_A     I   158_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     G   159_A     G   159_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     N   160_A     N   160_A     92  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     P   161_A     P   161_A     92  126  144     30  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     D   162_A     D   162_A     92  126  144     53  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     G   163_A     G   163_A     92  126  144      4   22   97  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     F   164_A     F   164_A     92  126  144      5   72  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     A   165_A     A   165_A     92  126  144      5   46   94  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     Q   166_A     Q   166_A     92  126  144      5   21   63  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     H   167_A     H   167_A     92  126  144      5   60  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     R   168_A     R   168_A     92  126  144     22   81  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     K   169_A     K   169_A      9  126  144      4   11   74  109  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     L   170_A     L   170_A      9  126  144      3   26   82  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     K   171_A     K   171_A      9  126  144      3   10   25   99  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     A   172_A     A   172_A     24  126  144      3    5   24   43   88  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     H   173_A     H   173_A     24  126  144     56  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     A   174_A     A   174_A     24  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     D   175_A     D   175_A     24  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     E   176_A     E   176_A     24  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     Y   177_A     Y   177_A     24  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     V   178_A     V   178_A     24  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     A   179_A     A   179_A     24  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     K   180_A     K   180_A     24  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     P   181_A     P   181_A     24  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  139  143  147 
LCS_GDT     V   182_A     V   182_A     24  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     D   183_A     D   183_A     24  126  144     56  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     A   184_A     A   184_A     24  126  144     56  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     D   185_A     D   185_A     24  126  144     37  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     Q   186_A     Q   186_A     24  126  144     22  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     L   187_A     L   187_A     24  126  144     56  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     V   188_A     V   188_A     24  126  144      8  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     E   189_A     E   189_A     24  126  144     56  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     R   190_A     R   190_A     24  126  144     60  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     A   191_A     A   191_A     24  126  144      9  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     G   192_A     G   192_A     24  126  144      8   85  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     A   193_A     A   193_A     24  126  144     30  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     L   194_A     L   194_A     24  126  144     43  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     I   195_A     I   195_A     24  126  144     44  100  108  110  115  118  121  123  123  126  126  127  132  132  132  133  136  140  143  147 
LCS_GDT     G   196_A     G   196_A     24  126  144      3   21   45   90  115  118  121  123  123  126  126  127  132  132  132  133  136  140  142  147 
LCS_GDT     F   197_A     F   197_A      4  126  144      3   17   45   83  114  118  121  123  123  126  126  127  132  132  132  133  136  140  142  143 
LCS_GDT     P   198_A     P   198_A      5  126  144      3    4    5   17   22   31   50   57   76   98  115  124  127  128  129  132  134  135  142  142 
LCS_GDT     E   199_A     E   199_A      5  124  144      4    4    5   10   18   21   25   27   30   32   34   38   58  125  127  129  134  140  142  142 
LCS_GDT     G   200_A     G   200_A      5   25  144      4    4    5   10   17   56   79   97  116  123  126  127  132  132  132  133  136  140  142  147 
LCS_GDT     N   201_A     N   201_A     22   25  144     12   18   20   21   22   24   63   78  100  114  122  126  132  132  132  133  136  140  143  147 
LCS_GDT     S   202_A     S   202_A     22   25  144     12   19   20   21   22   24   26   27   30   33   55   73   90  107  118  130  136  140  142  142 
LCS_GDT     M   203_A     M   203_A     22   25  144     12   19   20   21   22   24   27   38   56   69   81   90  103  118  126  131  136  140  142  147 
LCS_GDT     M   204_A     M   204_A     22   25  144     12   19   20   21   22   24   30   41   55   68   81   91  103  118  127  131  136  140  143  147 
LCS_GDT     I   205_A     I   205_A     22   25  144     12   19   20   21   22   24   26   28   33   43   58   69   79   88   98  113  126  131  139  143 
LCS_GDT     A   206_A     A   206_A     22   25  144     12   19   20   21   22   24   26   27   30   33   37   43   53   63   74   85   91  103  114  124 
LCS_GDT     L   207_A     L   207_A     22   25  143     12   19   20   21   22   24   26   28   31   36   39   45   54   63   72   86   93  105  116  130 
LCS_GDT     G   208_A     G   208_A     22   25  141     12   19   20   21   22   24   26   27   30   37   39   44   53   57   67   71   78   90   99  109 
LCS_GDT     V   209_A     V   209_A     22   25   32     12   19   20   21   22   24   26   27   31   37   43   56   66   70   73   75   77   80   84   90 
LCS_GDT     A   210_A     A   210_A     22   25   32     12   19   20   21   22   24   26   27   31   37   53   61   67   70   73   75   77   80   84   90 
LCS_GDT     C   211_A     C   211_A     22   25   32     12   19   20   21   22   24   26   27   38   46   59   65   67   70   73   75   77   80   84   90 
LCS_GDT     A   212_A     A   212_A     22   25   32     12   19   20   21   22   24   26   31   40   54   60   65   67   70   73   75   77   80   84   90 
LCS_GDT     I   213_A     I   213_A     22   25   32     12   19   20   21   22   24   26   35   50   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     A   214_A     A   214_A     22   25   32     12   19   20   21   22   26   36   46   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     L   215_A     L   215_A     22   25   32      8   19   20   21   22   26   36   46   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     A   216_A     A   216_A     22   25   32      8   19   20   21   22   26   39   47   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     I   217_A     I   217_A     22   25   32      8   19   20   21   23   30   38   46   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     A   218_A     A   218_A     22   25   32      8   19   20   21   29   35   41   47   53   59   61   65   67   70   73   75   77   80   84   90 
LCS_GDT     A   219_A     A   219_A     22   25   32      6   19   20   21   29   35   40   47   53   59   61   65   67   70   73   75   76   80   82   85 
LCS_GDT     V   220_A     V   220_A     22   25   32      6   13   18   21   26   35   41   47   53   59   61   65   67   70   73   75   76   80   82   85 
LCS_GDT     Y   221_A     Y   221_A     22   25   32      6   19   20   21   22   24   26   43   46   50   57   58   64   67   69   73   76   77   80   83 
LCS_GDT     F   222_A     F   222_A     22   25   32      3    3   18   21   22   24   26   41   46   50   57   58   63   66   69   71   74   76   77   80 
LCS_AVERAGE  LCS_A:  37.26  (  21.82   38.13   51.84 )

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     60    100    108    110    115    118    121    123    123    126    126    127    132    132    132    133    136    140    143    147 
GDT PERCENT_AT  27.03  45.05  48.65  49.55  51.80  53.15  54.50  55.41  55.41  56.76  56.76  57.21  59.46  59.46  59.46  59.91  61.26  63.06  64.41  66.22
GDT RMS_LOCAL    0.34   0.54   0.67   0.74   0.99   1.08   1.22   1.40   1.35   1.77   1.77   1.94   2.79   2.79   2.79   3.03   3.64   4.41   4.88   5.16
GDT RMS_ALL_AT  26.77  26.62  26.72  26.72  26.86  26.77  26.87  26.70  26.67  26.37  26.37  26.29  25.40  25.40  25.40  25.23  24.61  23.96  22.61  22.45

# Checking swapping
#   possible swapping detected:  E     5_A      E     5_A
#   possible swapping detected:  F    16_A      F    16_A
#   possible swapping detected:  D    26_A      D    26_A
#   possible swapping detected:  E    46_A      E    46_A
#   possible swapping detected:  E    63_A      E    63_A
#   possible swapping detected:  E    84_A      E    84_A
#   possible swapping detected:  D   105_A      D   105_A
#   possible swapping detected:  E   115_A      E   115_A
#   possible swapping detected:  D   149_A      D   149_A
#   possible swapping detected:  D   162_A      D   162_A
#   possible swapping detected:  E   176_A      E   176_A
#   possible swapping detected:  D   183_A      D   183_A
#   possible swapping detected:  D   185_A      D   185_A
#   possible swapping detected:  E   199_A      E   199_A
#   possible swapping detected:  F   222_A      F   222_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    G     1_A      G     1_A    17.272     0    0.089   0.089    17.272    0.000    0.000
LGA    P     2_A      P     2_A    17.349     0    0.682   0.586    20.254    0.000    0.000
LGA    H     3_A      H     3_A    16.779     0    0.606   1.090    17.676    0.000    0.000
LGA    M     4_A      M     4_A    20.115     0    0.222   0.248    24.552    0.000    0.000
LGA    E     5_A      E     5_A    18.789     0    0.354   1.283    20.256    0.000    0.000
LGA    Q     6_A      Q     6_A    18.229     0    0.341   1.134    24.111    0.000    0.000
LGA    L     7_A      L     7_A    18.997     0    0.593   0.633    22.910    0.000    0.000
LGA    E     8_A      E     8_A    15.637     0    0.158   1.032    16.355    0.000    0.000
LGA    G     9_A      G     9_A    14.442     0    0.070   0.070    15.389    0.000    0.000
LGA    I    10_A      I    10_A    18.251     0    0.043   0.097    22.866    0.000    0.000
LGA    M    11_A      M    11_A    19.154     0    0.032   0.704    24.571    0.000    0.000
LGA    L    12_A      L    12_A    15.194     0    0.015   0.185    16.188    0.000    0.000
LGA    S    13_A      S    13_A    14.512     0    0.088   0.567    17.275    0.000    0.000
LGA    P    14_A      P    14_A    15.349     0    0.034   0.048    18.641    0.000    0.000
LGA    A    15_A      A    15_A    19.767     0    0.012   0.018    23.269    0.000    0.000
LGA    F    16_A      F    16_A    22.654     0    0.029   1.423    27.066    0.000    0.000
LGA    Q    17_A      Q    17_A    22.928     0    0.011   0.559    25.964    0.000    0.000
LGA    E    18_A      E    18_A    24.314     0    0.015   1.067    28.367    0.000    0.000
LGA    Q    19_A      Q    19_A    29.226     0    0.013   0.249    32.905    0.000    0.000
LGA    M    20_A      M    20_A    31.584     0    0.060   1.163    34.782    0.000    0.000
LGA    N    21_A      N    21_A    31.900     0    0.034   0.727    35.723    0.000    0.000
LGA    A    22_A      A    22_A    34.952     0    0.000   0.009    39.282    0.000    0.000
LGA    L    23_A      L    23_A    39.356     0    0.087   0.918    42.953    0.000    0.000
LGA    M    24_A      M    24_A    41.312     0    0.145   0.824    44.202    0.000    0.000
LGA    L    25_A      L    25_A    41.997     0    0.216   1.366    45.814    0.000    0.000
LGA    D    26_A      D    26_A    47.784     0    0.129   0.457    52.262    0.000    0.000
LGA    P    27_A      P    27_A    52.598     0    0.122   0.410    54.921    0.000    0.000
LGA    R    28_A      R    28_A    56.124     0    0.008   1.330    58.616    0.000    0.000
LGA    M    29_A      M    29_A    50.767     0    0.083   1.190    52.239    0.000    0.000
LGA    L    30_A      L    30_A    50.201     0    0.074   0.892    53.164    0.000    0.000
LGA    D    31_A      D    31_A    57.735     0    0.016   0.117    61.275    0.000    0.000
LGA    M    32_A      M    32_A    58.263     0    0.016   0.748    59.097    0.000    0.000
LGA    M    33_A      M    33_A    52.830     0    0.028   0.376    54.377    0.000    0.000
LGA    I    34_A      I    34_A    56.275     0    0.026   0.608    59.455    0.000    0.000
LGA    D    35_A      D    35_A    62.943     0    0.102   0.163    66.776    0.000    0.000
LGA    Q    36_A      Q    36_A    60.453     0    0.092   0.989    60.886    0.000    0.000
LGA    N    37_A      N    37_A    57.798     0    0.062   0.984    59.944    0.000    0.000
LGA    P    38_A      P    38_A    63.391     0    0.073   0.320    64.542    0.000    0.000
LGA    Q    39_A      Q    39_A    59.000     0    0.042   1.007    59.967    0.000    0.000
LGA    L    40_A      L    40_A    57.842     0    0.111   0.207    60.675    0.000    0.000
LGA    R    41_A      R    41_A    64.073     0    0.073   1.278    69.551    0.000    0.000
LGA    N    42_A      N    42_A    67.701     0    0.042   1.081    71.649    0.000    0.000
LGA    M    43_A      M    43_A    63.516     0    0.092   0.704    66.106    0.000    0.000
LGA    G    44_A      G    44_A    68.100     0    0.081   0.081    68.100    0.000    0.000
LGA    P    45_A      P    45_A    67.330     0    0.043   0.280    72.044    0.000    0.000
LGA    E    46_A      E    46_A    65.789     0    0.037   1.181    72.668    0.000    0.000
LGA    A    47_A      A    47_A    59.773     0    0.021   0.028    62.425    0.000    0.000
LGA    R    48_A      R    48_A    57.503     0    0.032   1.322    63.126    0.000    0.000
LGA    Q    49_A      Q    49_A    58.093     0    0.068   1.212    63.983    0.000    0.000
LGA    M    50_A      M    50_A    53.863     0    0.209   0.881    55.786    0.000    0.000
LGA    L    51_A      L    51_A    48.255     0    0.053   0.192    50.807    0.000    0.000
LGA    R    52_A      R    52_A    46.551     0    0.067   1.247    55.575    0.000    0.000
LGA    P    53_A      P    53_A    46.124     0    0.052   0.316    50.443    0.000    0.000
LGA    M    54_A      M    54_A    42.172     0    0.070   1.344    47.194    0.000    0.000
LGA    F    55_A      F    55_A    37.422     0    0.041   1.445    39.716    0.000    0.000
LGA    R    56_A      R    56_A    37.391     0    0.018   1.227    48.847    0.000    0.000
LGA    E    57_A      E    57_A    36.569     0    0.015   0.760    43.214    0.000    0.000
LGA    M    58_A      M    58_A    30.923     0    0.070   0.598    33.360    0.000    0.000
LGA    M    59_A      M    59_A    27.970     0    0.027   1.500    31.462    0.000    0.000
LGA    S    60_A      S    60_A    29.785     0    0.110   0.705    34.507    0.000    0.000
LGA    N    61_A      N    61_A    26.735     0    0.244   1.196    30.472    0.000    0.000
LGA    P    62_A      P    62_A    21.828     0    0.407   0.607    23.226    0.000    0.000
LGA    E    63_A      E    63_A    21.726     0    0.013   1.158    25.806    0.000    0.000
LGA    S    64_A      S    64_A    23.408     0    0.064   0.621    25.527    0.000    0.000
LGA    M    65_A      M    65_A    19.772     0    0.013   0.830    22.731    0.000    0.000
LGA    R    66_A      R    66_A    14.519     0    0.010   0.486    16.728    0.000    0.000
LGA    S    67_A      S    67_A    17.054     0    0.037   0.174    20.453    0.000    0.000
LGA    M    68_A      M    68_A    17.206     0    0.012   1.021    25.513    0.000    0.000
LGA    M    69_A      M    69_A    11.464     0    0.061   0.858    13.613    1.310    1.905
LGA    N    70_A      N    70_A     8.904     0    0.016   1.122    10.192    2.143    1.964
LGA    M    71_A      M    71_A    12.447     0    0.034   1.226    20.421    0.000    0.000
LGA    G    72_A      G    72_A    10.829     0    0.040   0.040    11.267    2.976    2.976
LGA    R    73_A      R    73_A     4.190     0    0.071   0.896     6.618   39.643   45.714
LGA    A    74_A      A    74_A     6.338     0    0.027   0.028     8.876   19.405   16.095
LGA    W    75_A      W    75_A     7.538     0    0.023   0.814    19.823   13.929    3.980
LGA    G    76_A      G    76_A     5.029     0    0.200   0.200     5.132   31.786   31.786
LGA    S    77_A      S    77_A     1.785     0    0.607   0.603     4.199   79.286   67.381
LGA    K    78_A      K    78_A     0.636     0    0.059   0.783     2.062   86.071   80.688
LGA    K    79_A      K    79_A     0.548     0    0.069   0.882     1.806   97.619   87.725
LGA    I    80_A      I    80_A     0.411     0    0.037   0.067     0.604  100.000   97.619
LGA    L    81_A      L    81_A     0.188     0    0.019   0.043     0.324  100.000  100.000
LGA    I    82_A      I    82_A     0.164     0    0.016   0.087     0.230  100.000  100.000
LGA    V    83_A      V    83_A     0.284     0    0.022   0.038     0.447  100.000  100.000
LGA    E    84_A      E    84_A     0.347     0    0.074   0.159     0.734   97.619   95.767
LGA    S    85_A      S    85_A     0.760     0    0.058   0.663     1.450   90.476   88.968
LGA    D    86_A      D    86_A     0.771     0    0.040   0.144     1.250   90.476   89.345
LGA    T    87_A      T    87_A     0.908     0    0.016   1.007     2.900   90.476   83.129
LGA    A    88_A      A    88_A     1.175     0    0.010   0.011     1.448   85.952   85.048
LGA    L    89_A      L    89_A     0.793     0    0.017   0.090     1.219   92.857   90.536
LGA    S    90_A      S    90_A     0.183     0    0.046   0.054     0.481  100.000  100.000
LGA    A    91_A      A    91_A     0.442     0    0.008   0.012     0.726  100.000   98.095
LGA    T    92_A      T    92_A     0.539     0    0.022   0.083     1.087   97.619   93.265
LGA    L    93_A      L    93_A     0.453     0    0.011   0.075     1.050   97.619   92.917
LGA    R    94_A      R    94_A     0.368     0    0.065   0.136     1.064  100.000   92.338
LGA    S    95_A      S    95_A     0.295     0    0.047   0.108     0.708  100.000   98.413
LGA    A    96_A      A    96_A     0.347     0    0.032   0.033     0.442  100.000  100.000
LGA    L    97_A      L    97_A     0.643     0    0.016   0.070     0.868   90.476   90.476
LGA    E    98_A      E    98_A     0.802     0    0.012   0.147     1.067   88.214   89.471
LGA    G    99_A      G    99_A     0.942     0    0.045   0.045     1.141   85.952   85.952
LGA    R   100_A      R   100_A     1.527     0    0.137   1.105     6.000   75.000   57.835
LGA    G   101_A      G   101_A     1.644     0    0.021   0.021     1.644   75.000   75.000
LGA    F   102_A      F   102_A     1.200     0    0.044   0.174     1.877   81.429   79.091
LGA    T   103_A      T   103_A     1.098     0    0.054   0.051     1.486   85.952   84.014
LGA    V   104_A      V   104_A     0.579     0    0.035   0.085     0.737   90.476   93.197
LGA    D   105_A      D   105_A     0.494     0    0.022   0.319     1.146  100.000   96.488
LGA    E   106_A      E   106_A     0.620     0    0.034   0.638     2.193   90.476   81.799
LGA    T   107_A      T   107_A     0.593     0    0.067   0.082     0.693   92.857   91.837
LGA    T   108_A      T   108_A     0.854     0    0.047   0.186     1.418   88.214   85.306
LGA    D   109_A      D   109_A     1.645     0    0.089   0.138     3.772   79.286   66.548
LGA    G   110_A      G   110_A     0.809     0    0.059   0.059     1.129   88.214   88.214
LGA    K   111_A      K   111_A     0.765     0    0.606   0.844     2.738   82.143   80.847
LGA    G   112_A      G   112_A     1.919     0    0.021   0.021     1.979   77.143   77.143
LGA    S   113_A      S   113_A     0.717     0    0.043   0.045     0.965   90.476   90.476
LGA    V   114_A      V   114_A     0.297     0    0.054   0.071     0.584  100.000   97.279
LGA    E   115_A      E   115_A     0.581     0    0.052   0.708     2.743   92.857   77.566
LGA    Q   116_A      Q   116_A     0.619     0    0.037   0.835     3.871   92.857   76.032
LGA    I   117_A      I   117_A     0.405     0    0.020   0.105     0.556  100.000   97.619
LGA    R   118_A      R   118_A     0.471     0    0.030   1.256     4.489   97.619   78.009
LGA    R   119_A      R   119_A     0.559     0    0.068   1.356     5.198   90.476   74.892
LGA    D   120_A      D   120_A     0.449     0    0.052   0.420     1.629   97.619   90.714
LGA    R   121_A      R   121_A     0.263     0    0.020   0.509     3.083  100.000   84.935
LGA    P   122_A      P   122_A     0.285     0    0.022   0.040     0.691  100.000   97.279
LGA    D   123_A      D   123_A     0.210     0    0.047   0.078     0.413  100.000  100.000
LGA    L   124_A      L   124_A     0.214     0    0.050   0.644     1.437  100.000   95.357
LGA    V   125_A      V   125_A     0.501     0    0.013   0.032     0.600   92.857   93.197
LGA    V   126_A      V   126_A     0.601     0    0.018   0.023     0.816   95.238   93.197
LGA    L   127_A      L   127_A     0.188     0    0.048   1.316     3.212  100.000   84.762
LGA    A   128_A      A   128_A     0.207     0    0.037   0.040     0.557   97.619   98.095
LGA    V   129_A      V   129_A     0.519     0    0.022   0.085     0.764   92.857   91.837
LGA    D   130_A      D   130_A     0.571     0    0.048   0.918     2.874   92.857   81.131
LGA    L   131_A      L   131_A     0.566     0    0.078   0.152     0.816   90.476   91.667
LGA    S   132_A      S   132_A     0.650     0    0.449   0.484     1.295   88.214   87.460
LGA    A   133_A      A   133_A     2.941     0    0.512   0.516     3.826   53.690   51.619
LGA    G   134_A      G   134_A     2.821     0    0.206   0.206     3.105   55.357   55.357
LGA    Q   135_A      Q   135_A     2.877     0    0.524   0.586     5.027   49.405   52.910
LGA    N   136_A      N   136_A     0.588     0    0.080   0.207     0.914   90.476   90.476
LGA    G   137_A      G   137_A     0.631     0    0.021   0.021     0.631   90.476   90.476
LGA    Y   138_A      Y   138_A     0.734     0    0.042   1.346    10.313   90.476   49.325
LGA    L   139_A      L   139_A     1.144     0    0.034   1.415     4.930   83.690   66.786
LGA    I   140_A      I   140_A     0.861     0    0.023   0.052     0.912   90.476   90.476
LGA    C   141_A      C   141_A     0.753     0    0.054   0.065     0.827   90.476   90.476
LGA    G   142_A      G   142_A     0.785     0    0.097   0.097     1.197   88.214   88.214
LGA    K   143_A      K   143_A     0.889     0    0.022   0.359     1.735   88.214   86.508
LGA    L   144_A      L   144_A     0.764     0    0.027   0.090     1.033   88.214   89.345
LGA    K   145_A      K   145_A     0.754     0    0.063   0.233     1.240   88.214   88.466
LGA    K   146_A      K   146_A     0.961     0    0.083   0.607     1.670   85.952   83.492
LGA    D   147_A      D   147_A     0.923     0    0.093   0.163     1.296   85.952   87.083
LGA    D   148_A      D   148_A     1.117     0    0.060   0.738     2.854   83.690   77.381
LGA    D   149_A      D   149_A     1.122     0    0.104   0.358     1.955   81.429   81.488
LGA    L   150_A      L   150_A     0.888     0    0.047   1.091     2.926   88.214   81.964
LGA    K   151_A      K   151_A     0.843     0    0.030   0.752     3.572   88.214   78.730
LGA    N   152_A      N   152_A     1.081     0    0.018   0.103     1.754   85.952   80.476
LGA    V   153_A      V   153_A     0.860     0    0.026   0.034     1.301   90.476   86.599
LGA    P   154_A      P   154_A     0.424     0    0.057   0.091     0.512   97.619   97.279
LGA    I   155_A      I   155_A     0.557     0    0.058   0.241     0.957   95.238   92.857
LGA    V   156_A      V   156_A     0.157     0    0.072   0.078     0.540   97.619   98.639
LGA    I   157_A      I   157_A     0.344     0    0.029   0.548     1.860  100.000   94.226
LGA    I   158_A      I   158_A     0.086     0    0.094   1.159     2.537  100.000   86.845
LGA    G   159_A      G   159_A     0.531     0    0.088   0.088     0.595   92.857   92.857
LGA    N   160_A      N   160_A     0.833     0    0.024   0.491     1.933   90.476   88.274
LGA    P   161_A      P   161_A     0.982     0    0.168   0.396     1.260   90.476   89.184
LGA    D   162_A      D   162_A     0.714     0    0.047   1.367     4.326   86.071   76.190
LGA    G   163_A      G   163_A     2.275     0    0.250   0.250     2.275   68.929   68.929
LGA    F   164_A      F   164_A     1.468     0    0.044   0.177     1.864   79.286   82.294
LGA    A   165_A      A   165_A     2.251     0    0.015   0.015     2.754   64.881   63.333
LGA    Q   166_A      Q   166_A     2.965     0    0.046   0.738     5.719   60.952   44.815
LGA    H   167_A      H   167_A     1.504     0    0.048   0.997     4.227   81.667   64.571
LGA    R   168_A      R   168_A     1.274     0    0.020   1.038     4.022   75.119   70.606
LGA    K   169_A      K   169_A     3.128     0    0.074   0.546     6.298   53.690   45.767
LGA    L   170_A      L   170_A     2.881     0    0.147   0.249     3.393   55.357   53.571
LGA    K   171_A      K   171_A     3.751     0    0.195   0.246     4.914   43.333   39.259
LGA    A   172_A      A   172_A     3.797     0    0.114   0.121     5.338   50.357   45.524
LGA    H   173_A      H   173_A     1.005     0    0.422   1.187     4.740   85.952   64.143
LGA    A   174_A      A   174_A     0.597     0    0.026   0.034     0.725   90.476   90.476
LGA    D   175_A      D   175_A     0.623     0    0.032   0.119     0.908   90.476   90.476
LGA    E   176_A      E   176_A     0.681     0    0.047   0.515     1.562   90.476   86.561
LGA    Y   177_A      Y   177_A     0.812     0    0.062   0.067     0.953   90.476   90.476
LGA    V   178_A      V   178_A     0.678     0    0.036   0.046     0.730   90.476   90.476
LGA    A   179_A      A   179_A     0.467     0    0.015   0.020     0.557   95.238   96.190
LGA    K   180_A      K   180_A     0.513     0    0.018   0.385     1.177   92.857   89.524
LGA    P   181_A      P   181_A     0.530     0    0.047   0.365     0.813   95.238   93.197
LGA    V   182_A      V   182_A     0.460     0    0.088   1.064     2.351   95.238   85.850
LGA    D   183_A      D   183_A     0.702     0    0.049   0.679     3.938   97.619   78.690
LGA    A   184_A      A   184_A     0.552     0    0.066   0.078     0.637   90.476   90.476
LGA    D   185_A      D   185_A     0.805     0    0.050   0.568     3.083   92.857   82.143
LGA    Q   186_A      Q   186_A     0.760     0    0.024   1.367     3.613   90.476   78.571
LGA    L   187_A      L   187_A     0.323     0    0.051   1.206     2.599   97.619   87.857
LGA    V   188_A      V   188_A     0.876     0    0.082   1.290     3.616   90.476   81.156
LGA    E   189_A      E   189_A     0.767     0    0.050   1.026     3.108   90.476   77.460
LGA    R   190_A      R   190_A     0.450     0    0.019   1.714     6.274   97.619   70.606
LGA    A   191_A      A   191_A     0.906     0    0.016   0.019     1.398   85.952   86.857
LGA    G   192_A      G   192_A     1.369     0    0.145   0.145     2.091   77.262   77.262
LGA    A   193_A      A   193_A     1.051     0    0.022   0.026     1.051   85.952   86.857
LGA    L   194_A      L   194_A     0.626     0    0.164   0.224     1.471   88.214   91.726
LGA    I   195_A      I   195_A     0.861     0    0.700   0.610     3.545   74.286   82.440
LGA    G   196_A      G   196_A     3.294     0    0.681   0.681     5.508   44.881   44.881
LGA    F   197_A      F   197_A     3.743     0    0.049   1.247     8.237   32.024   28.571
LGA    P   198_A      P   198_A     9.838     0    0.609   0.554    11.159    1.905    2.109
LGA    E   199_A      E   199_A    12.253     0    0.077   0.987    14.841    0.000    0.000
LGA    G   200_A      G   200_A     9.789     0    0.139   0.139    11.769    0.238    0.238
LGA    N   201_A      N   201_A    11.331     0    0.208   0.743    14.535    0.000    0.000
LGA    S   202_A      S   202_A    16.427     0    0.086   0.676    18.697    0.000    0.000
LGA    M   203_A      M   203_A    17.558     0    0.028   0.205    20.424    0.000    0.000
LGA    M   204_A      M   204_A    17.011     0    0.050   1.154    20.164    0.000    0.000
LGA    I   205_A      I   205_A    19.380     0    0.040   0.113    23.099    0.000    0.000
LGA    A   206_A      A   206_A    23.870     0    0.028   0.037    27.040    0.000    0.000
LGA    L   207_A      L   207_A    25.219     0    0.015   1.398    28.274    0.000    0.000
LGA    G   208_A      G   208_A    25.881     0    0.016   0.016    29.681    0.000    0.000
LGA    V   209_A      V   209_A    29.838     0    0.017   0.058    33.873    0.000    0.000
LGA    A   210_A      A   210_A    33.347     0    0.024   0.027    36.804    0.000    0.000
LGA    C   211_A      C   211_A    34.650     0    0.039   0.087    38.343    0.000    0.000
LGA    A   212_A      A   212_A    36.350     0    0.009   0.011    40.497    0.000    0.000
LGA    I   213_A      I   213_A    40.678     0    0.033   0.132    44.804    0.000    0.000
LGA    A   214_A      A   214_A    43.709     0    0.017   0.023    47.466    0.000    0.000
LGA    L   215_A      L   215_A    45.199     0    0.042   0.110    48.973    0.000    0.000
LGA    A   216_A      A   216_A    47.396     0    0.014   0.015    51.819    0.000    0.000
LGA    I   217_A      I   217_A    52.020     0    0.015   0.066    56.000    0.000    0.000
LGA    A   218_A      A   218_A    54.354     0    0.020   0.027    58.053    0.000    0.000
LGA    A   219_A      A   219_A    55.484     0    0.006   0.005    59.536    0.000    0.000
LGA    V   220_A      V   220_A    59.576     0    0.082   0.135    63.882    0.000    0.000
LGA    Y   221_A      Y   221_A    63.489     0    0.014   1.377    66.679    0.000    0.000
LGA    F   222_A      F   222_A    64.548     0    0.484   1.409    65.194    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      222     888    888  100.00    1696   1696  100.00               222
SUMMARY(RMSD_GDC):    16.280         16.268                 16.704           48.093   45.578

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  222  222    4.0    123    1.40    52.477    49.686     8.178

LGA_LOCAL      RMSD:   1.404  Number of atoms:  123  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  26.702  Number of assigned atoms:  222 
Std_ASGN_ATOMS RMSD:  16.280  Standard rmsd on all 222 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.351496 * X  +  -0.068379 * Y  +   0.933689 * Z  +  19.914448
  Y_new =  -0.654839 * X  +   0.694793 * Y  +   0.297404 * Z  +  22.421656
  Z_new =  -0.669057 * X  +  -0.715952 * Y  +   0.199439 * Z  +  20.983803 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -1.078169  0.732939 -1.299118   [DEG:  -61.7746   41.9943  -74.4340 ]
ZXZ:  1.879161  1.370010 -2.390040   [DEG:  107.6680   78.4958 -136.9392 ]
 
# END of job
