
#######################################################
#                                                     #
#                        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:   155      68_A - 222_A       4.99    18.65
  LCS_AVERAGE:     55.36

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   136      76_A - 211_A       1.97    19.10
  LONGEST_CONTINUOUS_SEGMENT:   136      77_A - 212_A       1.98    19.37
  LONGEST_CONTINUOUS_SEGMENT:   136      78_A - 213_A       2.00    19.47
  LCS_AVERAGE:     42.51

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   126      77_A - 202_A       0.97    18.52
  LCS_AVERAGE:     35.13

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      4    9   43      4    4    5    5    8   11   12   13   14   17   21   23   26   29   33   34   40   46   52   56 
LCS_GDT     P     2_A     P     2_A      4   19   43      4    4    5    6    9   11   15   17   20   23   27   32   33   34   35   38   40   46   62   65 
LCS_GDT     H     3_A     H     3_A     10   33   43      4    4    9   15   18   22   26   30   32   33   34   34   35   37   38   39   53  100  112  118 
LCS_GDT     M     4_A     M     4_A     16   33   43      9   10   16   20   24   29   31   32   33   33   34   34   36   37   75   85   94  103  112  118 
LCS_GDT     E     5_A     E     5_A     16   33   43      9   10   17   23   27   30   31   32   33   33   34   34   36   37   75   89   94  103  112  122 
LCS_GDT     Q     6_A     Q     6_A     18   33   43      9   10   18   23   27   30   31   32   33   33   34   34   36   37   78   89   94  103  112  122 
LCS_GDT     L     7_A     L     7_A     19   33   43      9   11   18   25   27   30   31   32   33   33   34   34   36   68   78   89   94  103  115  122 
LCS_GDT     E     8_A     E     8_A     25   33   43      9   13   23   26   28   30   31   32   33   33   34   34   36   46   50   59   94  103  112  122 
LCS_GDT     G     9_A     G     9_A     25   33   43      9   16   23   26   28   30   31   32   33   33   34   35   39   51   64   69   82   93  112  122 
LCS_GDT     I    10_A     I    10_A     26   33   43      9   19   24   26   28   30   31   32   33   33   34   38   45   52   64   89   94  103  112  122 
LCS_GDT     M    11_A     M    11_A     26   33   43      9   19   24   26   28   30   31   32   33   33   34   35   40   49   61   89   94  103  112  122 
LCS_GDT     L    12_A     L    12_A     26   33   43      9   19   24   26   28   30   31   32   33   33   34   38   45   52   61   69   76   85   96  106 
LCS_GDT     S    13_A     S    13_A     26   33   43     12   19   24   26   28   30   31   32   33   33   34   38   45   52   61   69   76   84   96  105 
LCS_GDT     P    14_A     P    14_A     26   33   43     12   19   24   26   28   30   31   32   33   33   34   39   45   52   61   69   75   84   92  103 
LCS_GDT     A    15_A     A    15_A     26   33   43     12   19   24   26   28   30   31   32   33   33   34   39   45   52   61   69   75   84   96  104 
LCS_GDT     F    16_A     F    16_A     26   33   43     12   19   24   26   28   30   31   32   33   33   34   39   45   52   64   69   78   89  112  119 
LCS_GDT     Q    17_A     Q    17_A     26   33   43     12   19   24   26   28   30   31   32   33   33   34   39   45   52   64   69   78  103  112  119 
LCS_GDT     E    18_A     E    18_A     26   33   43     12   19   24   26   28   30   31   32   33   33   34   39   45   52   61   69   76   85   96  106 
LCS_GDT     Q    19_A     Q    19_A     26   33   43     12   19   24   26   28   30   31   32   33   33   34   39   45   52   64   69   78   89  104  119 
LCS_GDT     M    20_A     M    20_A     26   33   43     12   19   24   26   28   30   31   32   33   33   34   39   64   70   78   89   94  104  115  125 
LCS_GDT     N    21_A     N    21_A     26   33   47     12   19   24   26   28   30   31   32   33   33   34   39   44   52   78   89   94  103  112  122 
LCS_GDT     A    22_A     A    22_A     26   33   47     12   19   24   26   28   30   31   32   33   33   36   40   45   52   64   69   78   89  104  119 
LCS_GDT     L    23_A     L    23_A     26   33   47     12   19   24   26   28   30   31   32   33   33   36   40   45   52   64   69   86   97  110  122 
LCS_GDT     M    24_A     M    24_A     26   33   47     12   18   24   26   28   30   31   32   33   33   36   40   45   70   78   89   97  107  119  128 
LCS_GDT     L    25_A     L    25_A     26   33   47      8   19   24   26   28   30   31   32   33   33   36   40   44   52   64   71   94  103  112  122 
LCS_GDT     D    26_A     D    26_A     26   33   47      3   14   24   26   28   30   31   32   33   33   36   40   46   52   64   71   86   97  110  122 
LCS_GDT     P    27_A     P    27_A     26   33   47     10   19   24   26   28   30   31   32   33   33   36   40   44   47   64   69   86   97  110  122 
LCS_GDT     R    28_A     R    28_A     26   33   47     10   18   24   26   28   30   31   32   33   33   36   40   45   52   64   69   78   89  104  119 
LCS_GDT     M    29_A     M    29_A     26   33   47     10   19   24   26   28   30   31   32   33   33   36   40   45   52   64   69   78   89  104  119 
LCS_GDT     L    30_A     L    30_A     26   33   47     10   19   24   26   28   30   31   32   33   33   36   40   44   47   59   69   78   93  110  122 
LCS_GDT     D    31_A     D    31_A     26   33   47     10   19   24   26   28   30   31   32   33   33   36   40   44   50   61   69   78   89  104  119 
LCS_GDT     M    32_A     M    32_A     26   33   47     10   14   24   26   28   30   31   32   33   33   36   40   45   52   61   69   75   84   96  108 
LCS_GDT     M    33_A     M    33_A     26   33   47     10   10   23   26   28   30   31   32   33   33   36   40   45   52   61   69   75   84   99  119 
LCS_GDT     I    34_A     I    34_A     26   33   47     10   18   24   26   28   30   31   32   33   33   36   40   44   47   56   69   75   84   99  127 
LCS_GDT     D    35_A     D    35_A     26   33   47     10   12   23   26   28   29   31   32   33   33   36   40   45   52   61   69   75   84   99  114 
LCS_GDT     Q    36_A     Q    36_A     16   33   47     10   10   17   26   27   29   29   31   33   33   35   40   45   52   61   69   75   84   97  110 
LCS_GDT     N    37_A     N    37_A     11   33   47      4    6   11   12   16   23   28   28   30   32   36   40   44   55   67   73   80  141  143  144 
LCS_GDT     P    38_A     P    38_A      6   30   47      4    5    7   10   12   15   18   24   28   32   36   40   44   47   50   55   80   88  143  144 
LCS_GDT     Q    39_A     Q    39_A      6   18   47      4    6   10   12   16   20   24   28   31   33   36   40   44   47   50  137  140  143  147  147 
LCS_GDT     L    40_A     L    40_A      6   15   47      4    5    7   11   12   17   21   25   31   33   77  132  134  136  138  139  140  142  143  147 
LCS_GDT     R    41_A     R    41_A      6   19   47      3    5    8   10   13   16   21   25   31   33   36   40   44  134  138  139  140  142  143  147 
LCS_GDT     N    42_A     N    42_A      9   20   47      3    5    8   12   16   20   22   25   31  122  131  132  134  136  138  139  141  145  147  148 
LCS_GDT     M    43_A     M    43_A     14   20   47      4   10   13   16   51   87  119  127  130  130  132  134  135  136  138  139  141  145  147  148 
LCS_GDT     G    44_A     G    44_A     14   20   47      7   16   34   61   86  110  126  127  130  130  132  134  135  136  138  139  141  145  147  148 
LCS_GDT     P    45_A     P    45_A     14   20   47      7   10   16   27   46   67   86  103  119  130  132  134  135  136  138  139  140  142  143  147 
LCS_GDT     E    46_A     E    46_A     14   20   47      7   10   15   16   17   20   22   64   84  104  122  129  134  136  137  138  139  140  142  144 
LCS_GDT     A    47_A     A    47_A     14   20   47      7   10   15   21   32   48   67   88  107  121  131  134  135  136  138  139  140  141  143  144 
LCS_GDT     R    48_A     R    48_A     14   20   47      7   10   15   21   29   43   61   80   94  112  124  132  135  136  138  139  140  141  143  144 
LCS_GDT     Q    49_A     Q    49_A     14   20   47      7   10   15   16   17   24   36   48   60   78   95  106  119  128  134  137  139  140  142  143 
LCS_GDT     M    50_A     M    50_A     14   20   47      7   10   15   16   17   20   29   38   50   63   77   96  109  120  131  137  139  140  142  143 
LCS_GDT     L    51_A     L    51_A     14   20   47      7   10   15   16   17   26   33   45   61   74   91  101  112  123  129  136  139  140  142  143 
LCS_GDT     R    52_A     R    52_A     14   20   47      6   10   15   16   17   20   24   31   39   48   57   68   86   94  108  118  124  128  137  141 
LCS_GDT     P    53_A     P    53_A     14   20   47      6   10   15   16   17   20   22   25   31   38   48   57   68   79   89  101  111  120  126  131 
LCS_GDT     M    54_A     M    54_A     14   20   47      6   10   15   16   17   20   22   26   34   43   53   62   75   91  102  111  122  128  132  141 
LCS_GDT     F    55_A     F    55_A     14   20   47      6   10   15   16   17   20   22   26   31   36   42   52   63   79   89   98  111  118  126  131 
LCS_GDT     R    56_A     R    56_A     14   20   47      6   10   15   16   17   20   22   26   31   33   38   41   50   58   67   78   87   97  107  116 
LCS_GDT     E    57_A     E    57_A     14   20   47      6   10   15   16   17   20   22   26   31   34   38   41   47   55   66   76   85   94  102  111 
LCS_GDT     M    58_A     M    58_A     14   20   47      4   10   15   16   17   20   22   26   31   34   38   41   52   60   71   79   88   99  109  118 
LCS_GDT     M    59_A     M    59_A     11   20   47      3    6   10   16   17   19   22   26   30   34   38   41   42   44   46   51   53   55   69   81 
LCS_GDT     S    60_A     S    60_A      7   20   47      4    6    9   13   17   19   22   26   30   34   38   41   42   44   46   50   52   55   59   61 
LCS_GDT     N    61_A     N    61_A      7   20   47      4    8   11   13   17   20   22   26   30   34   38   41   42   44   46   50   53   55   59   61 
LCS_GDT     P    62_A     P    62_A     12   20   47      8    9   12   13   17   20   22   25   31   34   38   41   42   44   46   51   53   55   60   74 
LCS_GDT     E    63_A     E    63_A     12   19   47      8    9   12   12   17   19   22   25   31   34   38   41   42   44   46   51   53   57   64   71 
LCS_GDT     S    64_A     S    64_A     12   17   47      8    9   12   12   15   19   21   24   28   34   38   41   48   57   66   79   88   97  107  116 
LCS_GDT     M    65_A     M    65_A     12   17   47      8    9   12   12   17   19   22   26   31   34   39   47   58   69   81   90  106  115  123  129 
LCS_GDT     R    66_A     R    66_A     12   16  139      8    9   12   12   17   19   22   26   31   34   38   41   44   53   63   72   83   94  103  115 
LCS_GDT     S    67_A     S    67_A     12   16  145      8    9   12   12   16   19   22   26   30   34   38   41   48   57   66   79   88   99  109  118 
LCS_GDT     M    68_A     M    68_A     12   16  155      8    9   12   12   15   18   22   29   34   46   56   71   88   99  112  120  127  136  141  142 
LCS_GDT     M    69_A     M    69_A     12   16  155      8    9   12   12   15   18   22   31   39   48   59   71   89  102  112  120  128  136  141  142 
LCS_GDT     N    70_A     N    70_A     12   16  155      6    9   12   12   15   18   22   26   33   39   50   60   74   91  102  113  122  128  137  142 
LCS_GDT     M    71_A     M    71_A     12   16  155      4    8   12   12   14   18   22   26   36   53   67   88  106  120  131  137  139  140  142  143 
LCS_GDT     G    72_A     G    72_A     12   16  155      4    6   12   18   28   43   61   79   96  116  130  134  135  136  138  139  140  142  143  146 
LCS_GDT     R    73_A     R    73_A     12   16  155      4    7   12   12   15   27   34   50   62   81   98  113  123  133  136  138  139  140  142  144 
LCS_GDT     A    74_A     A    74_A      3  134  155      3    3    8   16   27   43   61   81  101  121  132  134  135  136  138  139  140  142  144  148 
LCS_GDT     W    75_A     W    75_A      3  134  155      3    4    8   12   27   42   60   88  116  130  132  134  135  136  138  139  141  145  147  148 
LCS_GDT     G    76_A     G    76_A     93  136  155      3    3    3    5   10   43   76  101  130  130  132  134  135  140  142  144  145  145  147  148 
LCS_GDT     S    77_A     S    77_A    126  136  155      3    7   48   95  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     K    78_A     K    78_A    126  136  155     97  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     K    79_A     K    79_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     I    80_A     I    80_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     L    81_A     L    81_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     I    82_A     I    82_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     V    83_A     V    83_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     E    84_A     E    84_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     S    85_A     S    85_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     D    86_A     D    86_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     T    87_A     T    87_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     A    88_A     A    88_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     L    89_A     L    89_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     S    90_A     S    90_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     A    91_A     A    91_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     T    92_A     T    92_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     L    93_A     L    93_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     R    94_A     R    94_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     S    95_A     S    95_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     A    96_A     A    96_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     L    97_A     L    97_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     E    98_A     E    98_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     G    99_A     G    99_A    126  136  155     97  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     R   100_A     R   100_A    126  136  155     94  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     G   101_A     G   101_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     F   102_A     F   102_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     T   103_A     T   103_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     V   104_A     V   104_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     D   105_A     D   105_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     E   106_A     E   106_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     T   107_A     T   107_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     T   108_A     T   108_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     D   109_A     D   109_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     G   110_A     G   110_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     K   111_A     K   111_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     G   112_A     G   112_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     S   113_A     S   113_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     V   114_A     V   114_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     E   115_A     E   115_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     Q   116_A     Q   116_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     I   117_A     I   117_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     R   118_A     R   118_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     R   119_A     R   119_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     D   120_A     D   120_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     R   121_A     R   121_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     P   122_A     P   122_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     D   123_A     D   123_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     L   124_A     L   124_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     V   125_A     V   125_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     V   126_A     V   126_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     L   127_A     L   127_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     A   128_A     A   128_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     V   129_A     V   129_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     D   130_A     D   130_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     L   131_A     L   131_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     S   132_A     S   132_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     A   133_A     A   133_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     G   134_A     G   134_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     Q   135_A     Q   135_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     N   136_A     N   136_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     G   137_A     G   137_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     Y   138_A     Y   138_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     L   139_A     L   139_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     I   140_A     I   140_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     C   141_A     C   141_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     G   142_A     G   142_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     K   143_A     K   143_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     L   144_A     L   144_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     K   145_A     K   145_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     K   146_A     K   146_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     D   147_A     D   147_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     D   148_A     D   148_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     D   149_A     D   149_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     L   150_A     L   150_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     K   151_A     K   151_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     N   152_A     N   152_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     V   153_A     V   153_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     P   154_A     P   154_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     I   155_A     I   155_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     V   156_A     V   156_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     I   157_A     I   157_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     I   158_A     I   158_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     G   159_A     G   159_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     N   160_A     N   160_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     P   161_A     P   161_A    126  136  155     55  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     D   162_A     D   162_A    126  136  155     77  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     G   163_A     G   163_A    126  136  155     10  110  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     F   164_A     F   164_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     A   165_A     A   165_A    126  136  155     51  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     Q   166_A     Q   166_A    126  136  155     16  110  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     H   167_A     H   167_A    126  136  155     87  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     R   168_A     R   168_A    126  136  155     16  112  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     K   169_A     K   169_A    126  136  155      8   51  115  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     L   170_A     L   170_A    126  136  155      5   24   77  119  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     K   171_A     K   171_A    126  136  155      3    8   27   56  110  126  126  129  131  133  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     A   172_A     A   172_A    126  136  155      3   99  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     H   173_A     H   173_A    126  136  155     13   60  116  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     A   174_A     A   174_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     D   175_A     D   175_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     E   176_A     E   176_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     Y   177_A     Y   177_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     V   178_A     V   178_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     A   179_A     A   179_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     K   180_A     K   180_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     P   181_A     P   181_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     V   182_A     V   182_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     D   183_A     D   183_A    126  136  155     84  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     A   184_A     A   184_A    126  136  155     92  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     D   185_A     D   185_A    126  136  155     84  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     Q   186_A     Q   186_A    126  136  155     92  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     L   187_A     L   187_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     V   188_A     V   188_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     E   189_A     E   189_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     R   190_A     R   190_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     A   191_A     A   191_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     G   192_A     G   192_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     A   193_A     A   193_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     L   194_A     L   194_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     I   195_A     I   195_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     G   196_A     G   196_A    126  136  155     73  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     F   197_A     F   197_A    126  136  155     98  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     P   198_A     P   198_A    126  136  155     94  113  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     E   199_A     E   199_A    126  136  155     23  108  118  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     G   200_A     G   200_A    126  136  155      3    4   72  119  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     N   201_A     N   201_A    126  136  155      3   58  115  120  124  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     S   202_A     S   202_A    126  136  155      3   38   89  120  124  126  126  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     M   203_A     M   203_A      5  136  155      3    4    6    7    8   32  120  127  130  130  132  134  135  140  140  142  145  145  147  148 
LCS_GDT     M   204_A     M   204_A      5  136  155      3    4    6    7   14   51   65   82  129  132  133  134  138  140  142  144  145  145  147  148 
LCS_GDT     I   205_A     I   205_A      5  136  155      3   48  110  120  123  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     A   206_A     A   206_A      4  136  155      3    3   78  120  123  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     L   207_A     L   207_A      4  136  155      3   64  112  120  123  126  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     G   208_A     G   208_A      3  136  155      3    3    4    5    7   11   21   28   35  131  133  137  139  141  142  144  145  145  147  148 
LCS_GDT     V   209_A     V   209_A      3  136  155      3    3    4    4    6    9   12   18   23  127  134  136  137  141  142  144  145  145  147  148 
LCS_GDT     A   210_A     A   210_A      3  136  155      3    3    4    5    6   20   50  127  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     C   211_A     C   211_A      3  136  155      3    3    4   13  114  120  126  127  130  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     A   212_A     A   212_A      3  136  155      3    4    5   13   16   32   50   73  110  131  132  137  139  141  142  144  145  145  147  147 
LCS_GDT     I   213_A     I   213_A      3  136  155      3    3    4   10   70  115  126  128  130  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     A   214_A     A   214_A      3    5  155      3    4    4    4    4    5    7   58   93  132  133  135  138  140  141  144  145  145  147  148 
LCS_GDT     L   215_A     L   215_A      3    5  155      3    4   15   41  101  122  126  128  130  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     A   216_A     A   216_A      3    5  155      3    4    4    5  121  123  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     I   217_A     I   217_A      3    6  155      3    3   37  119  121  123  127  129  131  134  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     A   218_A     A   218_A      4    6  155      4    4   37   60  120  123  127  129  131  133  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     A   219_A     A   219_A      4    6  155      4    4    6    6    8   13   21   28   35   38   53   69  135  139  140  143  144  145  147  147 
LCS_GDT     V   220_A     V   220_A      4    6  155      4    4    6    6    8   13   17   20   24   27   36   48   57  139  139  139  140  143  145  147 
LCS_GDT     Y   221_A     Y   221_A      4    6  155      4    4   37   60   84  101  116  125  131  133  136  137  139  141  142  144  145  145  147  148 
LCS_GDT     F   222_A     F   222_A      4    6  155      3    4    7   13   19   24   58  100  130  132  136  137  139  141  142  144  145  145  147  147 
LCS_AVERAGE  LCS_A:  44.34  (  35.13   42.51   55.36 )

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     98    113    118    120    124    126    127    129    131    134    136    137    139    141    142    144    145    145    147    148 
GDT PERCENT_AT  44.14  50.90  53.15  54.05  55.86  56.76  57.21  58.11  59.01  60.36  61.26  61.71  62.61  63.51  63.96  64.86  65.32  65.32  66.22  66.67
GDT RMS_LOCAL    0.24   0.38   0.50   0.57   0.83   0.90   0.96   1.09   1.23   1.52   1.63   1.76   1.91   2.09   2.18   2.37   2.48   2.48   2.74   3.13
GDT RMS_ALL_AT  19.16  19.05  18.93  18.93  18.64  18.98  18.91  18.90  19.11  19.44  19.43  19.66  19.82  19.98  19.93  19.83  19.72  19.72  19.80  18.42

# Checking swapping
#   possible swapping detected:  E     5_A      E     5_A
#   possible swapping detected:  E     8_A      E     8_A
#   possible swapping detected:  E    18_A      E    18_A
#   possible swapping detected:  D    26_A      D    26_A
#   possible swapping detected:  D    31_A      D    31_A
#   possible swapping detected:  D    35_A      D    35_A
#   possible swapping detected:  E    46_A      E    46_A
#   possible swapping detected:  F    55_A      F    55_A
#   possible swapping detected:  F   102_A      F   102_A
#   possible swapping detected:  D   105_A      D   105_A
#   possible swapping detected:  E   106_A      E   106_A
#   possible swapping detected:  D   123_A      D   123_A
#   possible swapping detected:  D   148_A      D   148_A
#   possible swapping detected:  D   149_A      D   149_A
#   possible swapping detected:  D   162_A      D   162_A
#   possible swapping detected:  D   175_A      D   175_A
#   possible swapping detected:  D   183_A      D   183_A
#   possible swapping detected:  D   185_A      D   185_A
#   possible swapping detected:  E   189_A      E   189_A
#   possible swapping detected:  E   199_A      E   199_A
#   possible swapping detected:  Y   221_A      Y   221_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    27.693     0    0.580   0.580    29.623    0.000    0.000
LGA    P     2_A      P     2_A    27.593     0    0.039   0.445    28.459    0.000    0.000
LGA    H     3_A      H     3_A    27.693     0    0.140   1.113    28.479    0.000    0.000
LGA    M     4_A      M     4_A    27.471     0    0.302   0.480    29.234    0.000    0.000
LGA    E     5_A      E     5_A    29.993     0    0.035   1.395    31.462    0.000    0.000
LGA    Q     6_A      Q     6_A    30.835     0    0.018   0.844    32.984    0.000    0.000
LGA    L     7_A      L     7_A    30.294     0    0.031   0.143    31.767    0.000    0.000
LGA    E     8_A      E     8_A    32.039     0    0.031   0.188    34.240    0.000    0.000
LGA    G     9_A      G     9_A    34.340     0    0.035   0.035    36.087    0.000    0.000
LGA    I    10_A      I    10_A    34.488     0    0.013   0.055    36.285    0.000    0.000
LGA    M    11_A      M    11_A    34.576     0    0.047   0.806    37.028    0.000    0.000
LGA    L    12_A      L    12_A    38.495     0    0.084   0.132    41.651    0.000    0.000
LGA    S    13_A      S    13_A    41.094     0    0.063   0.595    42.157    0.000    0.000
LGA    P    14_A      P    14_A    44.993     0    0.035   0.092    46.916    0.000    0.000
LGA    A    15_A      A    15_A    43.700     0    0.017   0.024    44.047    0.000    0.000
LGA    F    16_A      F    16_A    39.018     0    0.019   1.358    40.633    0.000    0.000
LGA    Q    17_A      Q    17_A    40.814     0    0.021   0.798    42.891    0.000    0.000
LGA    E    18_A      E    18_A    44.291     0    0.032   0.274    49.784    0.000    0.000
LGA    Q    19_A      Q    19_A    41.325     0    0.013   0.118    42.240    0.000    0.000
LGA    M    20_A      M    20_A    37.742     0    0.049   1.107    38.993    0.000    0.000
LGA    N    21_A      N    21_A    41.935     0    0.015   0.127    44.816    0.000    0.000
LGA    A    22_A      A    22_A    43.587     0    0.024   0.023    44.289    0.000    0.000
LGA    L    23_A      L    23_A    39.136     0    0.035   1.407    40.581    0.000    0.000
LGA    M    24_A      M    24_A    37.876     0    0.111   0.625    39.677    0.000    0.000
LGA    L    25_A      L    25_A    43.090     0    0.237   1.387    45.843    0.000    0.000
LGA    D    26_A      D    26_A    42.323     0    0.037   0.323    44.026    0.000    0.000
LGA    P    27_A      P    27_A    39.678     0    0.172   0.419    41.940    0.000    0.000
LGA    R    28_A      R    28_A    39.608     0    0.010   1.251    48.896    0.000    0.000
LGA    M    29_A      M    29_A    36.879     0    0.069   0.920    38.438    0.000    0.000
LGA    L    30_A      L    30_A    33.265     0    0.070   1.332    34.926    0.000    0.000
LGA    D    31_A      D    31_A    32.816     0    0.091   1.106    36.101    0.000    0.000
LGA    M    32_A      M    32_A    32.174     0    0.048   1.081    37.245    0.000    0.000
LGA    M    33_A      M    33_A    28.048     0    0.036   0.769    29.877    0.000    0.000
LGA    I    34_A      I    34_A    25.854     0    0.026   0.063    28.570    0.000    0.000
LGA    D    35_A      D    35_A    26.473     0    0.149   1.080    30.341    0.000    0.000
LGA    Q    36_A      Q    36_A    24.439     0    0.033   1.385    30.681    0.000    0.000
LGA    N    37_A      N    37_A    18.400     0    0.243   0.256    21.339    0.000    0.000
LGA    P    38_A      P    38_A    15.862     0    0.081   0.289    17.749    0.000    0.000
LGA    Q    39_A      Q    39_A    12.284     0    0.042   0.699    13.671    0.000    0.000
LGA    L    40_A      L    40_A    14.268     0    0.167   1.181    17.576    0.000    0.000
LGA    R    41_A      R    41_A    15.481     0    0.068   1.178    20.925    0.000    0.000
LGA    N    42_A      N    42_A    11.462     0    0.029   1.078    12.636    0.000    0.000
LGA    M    43_A      M    43_A    12.054     0    0.168   1.115    16.703    0.000    0.000
LGA    G    44_A      G    44_A    12.508     0    0.056   0.056    16.102    0.000    0.000
LGA    P    45_A      P    45_A    18.073     0    0.088   0.085    21.369    0.000    0.000
LGA    E    46_A      E    46_A    20.805     0    0.023   1.174    22.591    0.000    0.000
LGA    A    47_A      A    47_A    18.870     0    0.069   0.078    21.768    0.000    0.000
LGA    R    48_A      R    48_A    21.793     0    0.034   1.240    25.869    0.000    0.000
LGA    Q    49_A      Q    49_A    26.598     0    0.043   1.104    30.529    0.000    0.000
LGA    M    50_A      M    50_A    26.891     0    0.146   0.749    28.383    0.000    0.000
LGA    L    51_A      L    51_A    27.252     0    0.075   0.230    31.077    0.000    0.000
LGA    R    52_A      R    52_A    34.026     0    0.070   0.715    37.034    0.000    0.000
LGA    P    53_A      P    53_A    35.934     0    0.068   0.084    37.280    0.000    0.000
LGA    M    54_A      M    54_A    32.595     0    0.091   1.207    34.790    0.000    0.000
LGA    F    55_A      F    55_A    36.079     0    0.068   0.215    42.152    0.000    0.000
LGA    R    56_A      R    56_A    42.008     0    0.032   1.782    48.205    0.000    0.000
LGA    E    57_A      E    57_A    41.009     0    0.034   0.900    43.190    0.000    0.000
LGA    M    58_A      M    58_A    37.658     0    0.146   0.709    39.531    0.000    0.000
LGA    M    59_A      M    59_A    42.495     0    0.014   0.939    46.685    0.000    0.000
LGA    S    60_A      S    60_A    48.749     0    0.075   0.214    50.851    0.000    0.000
LGA    N    61_A      N    61_A    46.226     0    0.037   0.968    47.177    0.000    0.000
LGA    P    62_A      P    62_A    40.984     0    0.351   0.576    45.348    0.000    0.000
LGA    E    63_A      E    63_A    39.854     0    0.071   1.363    45.327    0.000    0.000
LGA    S    64_A      S    64_A    34.169     0    0.060   0.614    36.651    0.000    0.000
LGA    M    65_A      M    65_A    31.122     0    0.028   0.879    35.096    0.000    0.000
LGA    R    66_A      R    66_A    32.480     0    0.023   1.020    43.774    0.000    0.000
LGA    S    67_A      S    67_A    30.175     0    0.035   0.145    33.831    0.000    0.000
LGA    M    68_A      M    68_A    23.983     0    0.025   1.162    26.554    0.000    0.000
LGA    M    69_A      M    69_A    23.334     0    0.081   0.742    26.657    0.000    0.000
LGA    N    70_A      N    70_A    23.521     0    0.128   1.137    29.404    0.000    0.000
LGA    M    71_A      M    71_A    18.499     0    0.222   1.004    21.283    0.000    0.000
LGA    G    72_A      G    72_A    13.703     0    0.158   0.158    15.575    0.000    0.000
LGA    R    73_A      R    73_A    15.957     0    0.600   1.330    28.556    0.000    0.000
LGA    A    74_A      A    74_A    11.989     0    0.624   0.579    13.238    0.000    0.000
LGA    W    75_A      W    75_A     9.740     0    0.095   0.253    16.929    2.024    0.612
LGA    G    76_A      G    76_A     7.465     0    0.679   0.679     7.976   15.000   15.000
LGA    S    77_A      S    77_A     4.053     0    0.521   0.865     5.362   54.405   47.698
LGA    K    78_A      K    78_A     0.523     0    0.507   0.808     3.311   90.833   72.222
LGA    K    79_A      K    79_A     0.290     0    0.023   0.721     4.535  100.000   77.354
LGA    I    80_A      I    80_A     0.242     0    0.018   0.112     0.282  100.000  100.000
LGA    L    81_A      L    81_A     0.161     0    0.023   0.085     0.308  100.000  100.000
LGA    I    82_A      I    82_A     0.106     0    0.012   0.054     0.209  100.000  100.000
LGA    V    83_A      V    83_A     0.099     0    0.018   0.045     0.228  100.000  100.000
LGA    E    84_A      E    84_A     0.113     0    0.038   0.105     0.340  100.000  100.000
LGA    S    85_A      S    85_A     0.232     0    0.014   0.623     2.186  100.000   94.127
LGA    D    86_A      D    86_A     0.113     0    0.024   0.079     0.202  100.000  100.000
LGA    T    87_A      T    87_A     0.098     0    0.017   0.160     0.533  100.000   98.639
LGA    A    88_A      A    88_A     0.043     0    0.027   0.030     0.104  100.000  100.000
LGA    L    89_A      L    89_A     0.181     0    0.039   0.130     0.387  100.000  100.000
LGA    S    90_A      S    90_A     0.150     0    0.058   0.131     0.458  100.000  100.000
LGA    A    91_A      A    91_A     0.165     0    0.026   0.025     0.234  100.000  100.000
LGA    T    92_A      T    92_A     0.272     0    0.021   0.063     0.553  100.000   98.639
LGA    L    93_A      L    93_A     0.150     0    0.019   0.059     0.203  100.000  100.000
LGA    R    94_A      R    94_A     0.176     0    0.059   0.123     0.368  100.000  100.000
LGA    S    95_A      S    95_A     0.420     0    0.028   0.120     0.849  100.000   96.825
LGA    A    96_A      A    96_A     0.472     0    0.040   0.046     0.742   95.238   96.190
LGA    L    97_A      L    97_A     0.272     0    0.034   0.064     0.436  100.000  100.000
LGA    E    98_A      E    98_A     0.368     0    0.023   0.086     0.395  100.000  100.000
LGA    G    99_A      G    99_A     0.524     0    0.046   0.046     0.533   95.238   95.238
LGA    R   100_A      R   100_A     0.626     0    0.111   1.699     7.423   92.857   62.597
LGA    G   101_A      G   101_A     0.518     0    0.017   0.017     0.518   97.619   97.619
LGA    F   102_A      F   102_A     0.093     0    0.066   0.108     0.215  100.000  100.000
LGA    T   103_A      T   103_A     0.280     0    0.050   0.162     0.707  100.000   98.639
LGA    V   104_A      V   104_A     0.246     0    0.009   0.044     0.319  100.000  100.000
LGA    D   105_A      D   105_A     0.253     0    0.019   0.220     0.933  100.000   96.429
LGA    E   106_A      E   106_A     0.206     0    0.020   0.108     0.374  100.000  100.000
LGA    T   107_A      T   107_A     0.142     0    0.035   0.081     0.474  100.000  100.000
LGA    T   108_A      T   108_A     0.414     0    0.044   0.259     1.132  100.000   93.333
LGA    D   109_A      D   109_A     0.107     0    0.047   0.278     0.960  100.000   98.810
LGA    G   110_A      G   110_A     0.112     0    0.071   0.071     0.294  100.000  100.000
LGA    K   111_A      K   111_A     0.156     0    0.025   0.310     0.875  100.000   96.825
LGA    G   112_A      G   112_A     0.283     0    0.007   0.007     0.283  100.000  100.000
LGA    S   113_A      S   113_A     0.171     0    0.041   0.081     0.374  100.000  100.000
LGA    V   114_A      V   114_A     0.309     0    0.010   0.109     0.354  100.000  100.000
LGA    E   115_A      E   115_A     0.312     0    0.034   0.092     0.690  100.000   96.825
LGA    Q   116_A      Q   116_A     0.314     0    0.025   0.055     0.338  100.000  100.000
LGA    I   117_A      I   117_A     0.294     0    0.012   0.066     0.334  100.000  100.000
LGA    R   118_A      R   118_A     0.346     0    0.048   0.109     0.346  100.000  100.000
LGA    R   119_A      R   119_A     0.482     0    0.035   0.116     0.598   95.238   98.268
LGA    D   120_A      D   120_A     0.675     0    0.031   0.100     0.771   90.476   90.476
LGA    R   121_A      R   121_A     0.715     0    0.020   0.420     1.883   90.476   86.450
LGA    P   122_A      P   122_A     0.314     0    0.026   0.105     0.436  100.000  100.000
LGA    D   123_A      D   123_A     0.246     0    0.026   0.576     2.189  100.000   93.214
LGA    L   124_A      L   124_A     0.173     0    0.010   0.064     0.422  100.000  100.000
LGA    V   125_A      V   125_A     0.164     0    0.021   0.077     0.344  100.000  100.000
LGA    V   126_A      V   126_A     0.191     0    0.041   0.038     0.248  100.000  100.000
LGA    L   127_A      L   127_A     0.240     0    0.033   0.063     0.546  100.000   98.810
LGA    A   128_A      A   128_A     0.303     0    0.022   0.022     0.322  100.000  100.000
LGA    V   129_A      V   129_A     0.243     0    0.030   0.072     0.453  100.000  100.000
LGA    D   130_A      D   130_A     0.343     0    0.055   0.775     3.147  100.000   83.988
LGA    L   131_A      L   131_A     0.239     0    0.025   0.164     0.488  100.000  100.000
LGA    S   132_A      S   132_A     0.088     0    0.038   0.071     0.358  100.000  100.000
LGA    A   133_A      A   133_A     0.104     0    0.040   0.040     0.104  100.000  100.000
LGA    G   134_A      G   134_A     0.270     0    0.084   0.084     0.284  100.000  100.000
LGA    Q   135_A      Q   135_A     0.275     0    0.036   0.260     0.780  100.000   97.884
LGA    N   136_A      N   136_A     0.500     0    0.044   0.513     2.628  100.000   91.131
LGA    G   137_A      G   137_A     0.410     0    0.016   0.016     0.430  100.000  100.000
LGA    Y   138_A      Y   138_A     0.449     0    0.032   0.069     1.112   95.238   92.103
LGA    L   139_A      L   139_A     0.593     0    0.022   0.095     0.995   92.857   91.667
LGA    I   140_A      I   140_A     0.444     0    0.011   0.057     0.531   97.619   96.429
LGA    C   141_A      C   141_A     0.503     0    0.044   0.083     0.522   95.238   96.825
LGA    G   142_A      G   142_A     0.391     0    0.026   0.026     0.473  100.000  100.000
LGA    K   143_A      K   143_A     0.361     0    0.020   0.834     2.969  100.000   90.476
LGA    L   144_A      L   144_A     0.357     0    0.022   0.077     0.447  100.000  100.000
LGA    K   145_A      K   145_A     0.447     0    0.036   0.118     0.602   97.619   98.942
LGA    K   146_A      K   146_A     0.490     0    0.095   0.639     3.254   97.619   80.794
LGA    D   147_A      D   147_A     0.477     0    0.015   0.095     0.507   97.619   97.619
LGA    D   148_A      D   148_A     0.520     0    0.060   0.826     2.920   95.238   83.512
LGA    D   149_A      D   149_A     0.376     0    0.010   0.275     1.444  100.000   95.298
LGA    L   150_A      L   150_A     0.160     0    0.017   1.114     2.369  100.000   90.000
LGA    K   151_A      K   151_A     0.225     0    0.034   0.270     1.027  100.000   93.757
LGA    N   152_A      N   152_A     0.191     0    0.022   0.137     1.027  100.000   95.298
LGA    V   153_A      V   153_A     0.166     0    0.036   0.091     0.435  100.000  100.000
LGA    P   154_A      P   154_A     0.313     0    0.042   0.212     0.564  100.000   98.639
LGA    I   155_A      I   155_A     0.228     0    0.039   0.631     1.562  100.000   93.095
LGA    V   156_A      V   156_A     0.298     0    0.024   0.085     0.632  100.000   98.639
LGA    I   157_A      I   157_A     0.276     0    0.027   0.534     1.502  100.000   95.417
LGA    I   158_A      I   158_A     0.303     0    0.072   0.137     0.441  100.000  100.000
LGA    G   159_A      G   159_A     0.519     0    0.028   0.028     0.519   97.619   97.619
LGA    N   160_A      N   160_A     0.565     0    0.046   0.273     1.850   92.857   87.202
LGA    P   161_A      P   161_A     0.922     0    0.120   0.305     1.117   90.476   89.184
LGA    D   162_A      D   162_A     0.795     0    0.099   0.746     3.662   90.476   73.393
LGA    G   163_A      G   163_A     1.284     0    0.050   0.050     1.284   85.952   85.952
LGA    F   164_A      F   164_A     0.355     0    0.068   0.098     0.684   97.619   96.537
LGA    A   165_A      A   165_A     1.192     0    0.027   0.024     1.508   81.548   81.524
LGA    Q   166_A      Q   166_A     1.622     0    0.028   1.353     6.784   79.286   57.249
LGA    H   167_A      H   167_A     0.636     0    0.079   0.211     1.034   88.214   91.476
LGA    R   168_A      R   168_A     1.284     0    0.025   0.817     2.898   77.381   73.939
LGA    K   169_A      K   169_A     2.753     0    0.144   0.569     5.033   57.262   52.963
LGA    L   170_A      L   170_A     3.494     0    0.696   0.581     5.402   42.381   38.393
LGA    K   171_A      K   171_A     4.703     0    0.608   0.841    11.357   40.476   20.106
LGA    A   172_A      A   172_A     1.649     0    0.187   0.208     2.010   72.857   71.238
LGA    H   173_A      H   173_A     1.764     0    0.136   1.079     4.207   77.143   64.238
LGA    A   174_A      A   174_A     0.381     0    0.062   0.092     0.728   95.238   96.190
LGA    D   175_A      D   175_A     0.448     0    0.036   0.106     0.564   97.619   97.619
LGA    E   176_A      E   176_A     0.500     0    0.032   0.357     1.355   97.619   94.762
LGA    Y   177_A      Y   177_A     0.395     0    0.045   0.075     0.778  100.000   95.238
LGA    V   178_A      V   178_A     0.551     0    0.038   0.077     0.551   92.857   93.197
LGA    A   179_A      A   179_A     0.629     0    0.052   0.049     0.809   92.857   92.381
LGA    K   180_A      K   180_A     0.224     0    0.015   0.423     1.097  100.000   95.873
LGA    P   181_A      P   181_A     0.125     0    0.028   0.370     1.379  100.000   97.347
LGA    V   182_A      V   182_A     0.299     0    0.085   1.107     2.463   97.619   87.211
LGA    D   183_A      D   183_A     0.975     0    0.031   0.600     3.709   90.476   72.321
LGA    A   184_A      A   184_A     0.619     0    0.039   0.043     0.815   92.857   92.381
LGA    D   185_A      D   185_A     0.786     0    0.075   0.259     1.575   92.857   86.071
LGA    Q   186_A      Q   186_A     0.641     0    0.021   1.260     5.164   90.476   75.926
LGA    L   187_A      L   187_A     0.221     0    0.026   0.057     0.465  100.000  100.000
LGA    V   188_A      V   188_A     0.105     0    0.033   0.171     0.506  100.000   98.639
LGA    E   189_A      E   189_A     0.311     0    0.033   1.073     4.933  100.000   76.455
LGA    R   190_A      R   190_A     0.088     0    0.034   0.279     0.930  100.000   98.268
LGA    A   191_A      A   191_A     0.266     0    0.033   0.038     0.360  100.000  100.000
LGA    G   192_A      G   192_A     0.248     0    0.036   0.036     0.293  100.000  100.000
LGA    A   193_A      A   193_A     0.348     0    0.051   0.055     0.441  100.000  100.000
LGA    L   194_A      L   194_A     0.342     0    0.031   0.047     0.437  100.000  100.000
LGA    I   195_A      I   195_A     0.280     0    0.722   0.630     3.127   85.119   92.560
LGA    G   196_A      G   196_A     0.942     0    0.096   0.096     1.291   90.595   90.595
LGA    F   197_A      F   197_A     0.602     0    0.097   0.217     1.294   90.595   90.519
LGA    P   198_A      P   198_A     0.693     0    0.053   0.111     1.022   88.214   87.891
LGA    E   199_A      E   199_A     1.863     0    0.040   1.006     3.077   70.952   68.624
LGA    G   200_A      G   200_A     3.330     0    0.228   0.228     4.378   48.571   48.571
LGA    N   201_A      N   201_A     2.451     0    0.441   0.494     4.330   68.810   57.024
LGA    S   202_A      S   202_A     4.025     0    0.194   0.652     7.692   37.500   29.762
LGA    M   203_A      M   203_A     7.861     0    0.017   1.020    13.641   11.071    5.536
LGA    M   204_A      M   204_A     7.130     0    0.119   1.058    13.842   14.524    8.214
LGA    I   205_A      I   205_A     3.513     0    0.606   1.515     4.234   48.452   46.786
LGA    A   206_A      A   206_A     2.809     0    0.338   0.337     3.829   53.690   52.952
LGA    L   207_A      L   207_A     3.412     0    0.609   0.519     8.582   37.143   28.155
LGA    G   208_A      G   208_A     7.874     0    0.426   0.426     7.874   12.619   12.619
LGA    V   209_A      V   209_A     8.331     0    0.156   0.165     9.402    6.071    4.898
LGA    A   210_A      A   210_A     5.884     0    0.283   0.300     6.391   20.357   19.714
LGA    C   211_A      C   211_A     6.495     0    0.591   0.607     9.220   11.786   13.651
LGA    A   212_A      A   212_A     8.981     0    0.638   0.609    10.186    8.333    6.667
LGA    I   213_A      I   213_A     6.382     0    0.382   0.743     7.807   12.738   14.583
LGA    A   214_A      A   214_A     7.927     0    0.366   0.355     9.864    9.286    7.524
LGA    L   215_A      L   215_A     6.696     0    0.619   1.342    11.729   13.810    7.738
LGA    A   216_A      A   216_A     4.997     0    0.620   0.598     5.589   34.405   31.810
LGA    I   217_A      I   217_A     4.273     0    0.604   0.570     7.564   26.905   40.357
LGA    A   218_A      A   218_A     4.919     0    0.580   0.577     7.251   22.143   27.714
LGA    A   219_A      A   219_A    11.585     0    0.089   0.091    14.058    0.357    0.286
LGA    V   220_A      V   220_A    13.149     0    0.087   1.306    16.187    0.000    0.000
LGA    Y   221_A      Y   221_A     7.367     0    0.036   1.396     9.043    9.643   18.690
LGA    F   222_A      F   222_A     9.006     0    0.103   1.205    11.687    1.548    0.649

# 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):    11.981         11.987                 12.348           55.116   53.186

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  222  222    4.0    129    1.09    56.982    53.819    10.814

LGA_LOCAL      RMSD:   1.093  Number of atoms:  129  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  18.895  Number of assigned atoms:  222 
Std_ASGN_ATOMS RMSD:  11.981  Standard rmsd on all 222 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.962468 * X  +   0.214146 * Y  +   0.166723 * Z  +  21.682491
  Y_new =   0.257031 * X  +   0.522046 * Y  +   0.813267 * Z  +  18.073713
  Z_new =   0.087121 * X  +   0.825596 * Y  +  -0.557495 * Z  +  16.318024 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  2.880629 -0.087232  2.164727   [DEG:  165.0479   -4.9980  124.0297 ]
ZXZ:  2.939391  2.162162  0.105136   [DEG:  168.4147  123.8827    6.0238 ]
 
# END of job
