
#######################################################
#                                                     #
#                        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  210 ( 1650),  selected  209 , name one
# Molecule2: number of CA atoms  230 ( 1795),  selected  209 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:B  -ch2:B  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   132      32_B - 163_B       4.98     9.14
  LONGEST_CONTINUOUS_SEGMENT:   132      33_B - 164_B       4.92     9.10
  LONGEST_CONTINUOUS_SEGMENT:   132      34_B - 165_B       4.86     9.06
  LONGEST_CONTINUOUS_SEGMENT:   132      35_B - 166_B       4.93     9.05
  LCS_AVERAGE:     42.13

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    63      57_B - 119_B       1.98     8.95
  LCS_AVERAGE:     12.30

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    27      74_B - 100_B       0.94     8.98
  LONGEST_CONTINUOUS_SEGMENT:    27      75_B - 101_B       0.94     8.98
  LCS_AVERAGE:      4.68

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  209
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     A    15_B     A    15_B      6    7   18      5    6    7    7    8    9   14   17   21   26   31   35   38   44   59   68   85  103  112  120 
LCS_GDT     F    16_B     F    16_B      6    7   18      5    6    7    7   10   11   25   28   36   39   48   52   62   81   93  105  117  128  141  149 
LCS_GDT     Y    17_B     Y    17_B      6    7   18      5    6    7    7   10   11   19   29   39   48   58   67   82   97  112  129  136  140  148  154 
LCS_GDT     E    18_B     E    18_B      6    7   18      5    6    7    7    8    9   12   19   22   27   34   40   50   62   80   95  109  121  132  146 
LCS_GDT     L    19_B     L    19_B      6    7   18      5    6    7    7   10   11   12   19   22   27   34   50   60   79   90  105  117  128  141  149 
LCS_GDT     E    20_B     E    20_B      6    7   18      3    3    7    7    8    9   14   19   22   33   40   46   63   76   81   92  112  125  141  149 
LCS_GDT     F    21_B     F    21_B      3    7   18      3    3    7   10   12   17   23   31   40   47   65   71   87  109  119  129  136  142  151  157 
LCS_GDT     G    22_B     G    22_B      4    5   18      4    4    4    4    5    7   10   15   15   17   27   35   46   79   82   95  109  128  139  149 
LCS_GDT     P    23_B     P    23_B      4    5   18      4    4    4    5    5    7    9   11   12   17   44   52   63   81   96  108  121  139  143  150 
LCS_GDT     R    24_B     R    24_B      4    5   18      4    4    4   13   19   21   25   29   52   58   70   80   87  112  123  133  136  143  152  159 
LCS_GDT     T    25_B     T    25_B      4    6   18      4    5    9   13   19   21   25   32   52   67   90  110  120  128  133  139  146  151  157  163 
LCS_GDT     I    26_B     I    26_B      4    6   18      3    5    9   13   19   21   33   44   70   86  101  118  125  130  139  144  148  156  159  163 
LCS_GDT     M    27_B     M    27_B      4    6   18      3   20   43   66   83  103  113  120  123  126  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     T    28_B     T    28_B      4    6   18      3    4    7    8   10   24   44   69   83  105  119  127  131  138  144  148  154  160  162  165 
LCS_GDT     L    29_B     L    29_B      4    6   18      3    4    5   12   18   24   30   51   53   86  111  123  130  138  144  148  154  160  162  165 
LCS_GDT     A    30_B     A    30_B      4    6   90      3    3    5    5    6    8   12   22   29   40   87   94  113  124  132  138  147  152  156  162 
LCS_GDT     N    31_B     N    31_B      4    5   92      3    3    4    5    5    7    8   10   15   28   29   35   69   78   89  101  133  140  147  157 
LCS_GDT     F    32_B     F    32_B      4    5  132      3    3    4    5    6   19   23   31   40   56   84   92  111  117  123  136  146  152  155  162 
LCS_GDT     P    33_B     P    33_B      4    5  132      3    3    4    5    5   10   11   16   22   37   44   48   69   91  101  126  136  142  150  157 
LCS_GDT     D    34_B     D    34_B      4    5  132      4    4    4    5    6    6   22   53   64   90   97  104  116  122  132  139  146  152  158  162 
LCS_GDT     D    35_B     D    35_B      4    5  132      4    4    4    7   20   35   46   57   77   94  110  114  121  130  139  144  150  156  159  163 
LCS_GDT     V    36_B     V    36_B      4    5  132      4    4    4    5    6    8   10   14   16   28   32   53   68   91  113  128  136  142  151  160 
LCS_GDT     L    37_B     L    37_B      4   10  132      4    4    4    6   10   13   36   52   65   84   97  114  123  131  140  145  150  156  159  164 
LCS_GDT     P    38_B     P    38_B      9   12  132      8    9   12   14   21   28   47   55   68   85   97  113  124  136  142  146  149  156  158  163 
LCS_GDT     L    39_B     L    39_B      9   12  132      8    9   12   14   21   28   34   43   63   77   88  101  118  129  138  145  149  151  155  160 
LCS_GDT     L    40_B     L    40_B      9   12  132      8    9   12   14   20   26   34   41   63   77   90  106  124  134  140  146  149  153  158  163 
LCS_GDT     Q    41_B     Q    41_B      9   12  132      8    9   12   14   28   36   55   68   83  106  115  130  135  139  144  148  152  156  159  164 
LCS_GDT     M    42_B     M    42_B      9   12  132      8    9   12   14   21   36   47   65   86  116  123  132  135  139  146  148  152  156  159  164 
LCS_GDT     E    43_B     E    43_B      9   12  132      8    9   12   14   20   28   34   43   68   89  103  130  135  138  142  148  152  156  159  164 
LCS_GDT     S    44_B     S    44_B      9   12  132      8    9   12   14   28   39   56   88  101  119  130  132  137  140  146  148  152  160  162  165 
LCS_GDT     L    45_B     L    45_B      9   12  132      8    9   12   18   52   65   86  114  122  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     M    46_B     M    46_B      9   12  132      3    9   12   14   41   65   76   89  121  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     T    47_B     T    47_B      6   12  132      3   10   23   65   93  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     F    48_B     F    48_B      6   12  132      4    5   62   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     E    49_B     E    49_B      6   12  132      5   28   65   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     A    50_B     A    50_B      6    8  132     13   28   56   85  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     M    51_B     M    51_B      6    8  132      4   12   47   79  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     A    52_B     A    52_B      6    8  132      3   12   48   79  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     Y    53_B     Y    53_B      4   48  132      3    4    9   15   21   33   57  108  115  125  129  133  137  140  146  148  154  160  162  165 
LCS_GDT     L    54_B     L    54_B      4   49  132      3    4   22   31   42   61   78   94  106  125  129  133  137  140  146  148  154  160  162  165 
LCS_GDT     R    55_B     R    55_B      4   49  132      3    9   22   31   41   61   79   94  108  125  129  133  137  140  146  148  154  160  162  165 
LCS_GDT     C    56_B     C    56_B      4   49  132      3    4    4   15   26   48   66   85  101  114  128  131  137  140  146  148  154  160  162  165 
LCS_GDT     D    57_B     D    57_B     11   63  132     16   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     A    58_B     A    58_B     11   63  132     15   41   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     L    59_B     L    59_B     11   63  132     16   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     V    60_B     V    60_B     11   63  132     18   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     E    61_B     E    61_B     11   63  132     18   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     L    62_B     L    62_B     11   63  132     18   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     G    63_B     G    63_B     11   63  132     18   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     C    64_B     C    64_B     11   63  132     18   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     Y    65_B     Y    65_B     11   63  132     13   40   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     D    66_B     D    66_B     11   63  132      5   32   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     G    67_B     G    67_B     11   63  132      8   27   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     R    68_B     R    68_B      8   63  132      3    7   31   61   93  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     A    69_B     A    69_B      6   63  132      5   35   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     L    70_B     L    70_B      7   63  132     18   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     E    71_B     E    71_B      7   63  132     18   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     I    72_B     I    72_B      7   63  132      4   24   56   76   98  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     A    73_B     A    73_B      7   63  132      4   14   26   52   86  104  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     R    74_B     R    74_B     27   63  132      4   11   26   78  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     L    75_B     L    75_B     27   63  132     18   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     L    76_B     L    76_B     27   63  132     13   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     N    77_B     N    77_B     27   63  132      7   35   65   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     A    78_B     A    78_B     27   63  132     18   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     R    79_B     R    79_B     27   63  132     18   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     Y    80_B     Y    80_B     27   63  132     18   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     L    81_B     L    81_B     27   63  132     18   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     G    82_B     G    82_B     27   63  132     18   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     V    83_B     V    83_B     27   63  132     18   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     D    84_B     D    84_B     27   63  132     18   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     L    85_B     L    85_B     27   63  132     18   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     D    86_B     D    86_B     27   63  132     13   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     Q    87_B     Q    87_B     27   63  132     12   42   66   81  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     R    88_B     R    88_B     27   63  132     12   42   66   81  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     A    89_B     A    89_B     27   63  132     13   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     I    90_B     I    90_B     27   63  132      9   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     E    91_B     E    91_B     27   63  132     13   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     T    92_B     T    92_B     27   63  132     10   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     L    93_B     L    93_B     27   63  132     10   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     R    94_B     R    94_B     27   63  132      9   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     T    95_B     T    95_B     27   63  132      9   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     R    96_B     R    96_B     27   63  132     10   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     I    97_B     I    97_B     27   63  132      9   40   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     E    98_B     E    98_B     27   63  132      8   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     R    99_B     R    99_B     27   63  132      6   41   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     E   100_B     E   100_B     27   63  132      6   41   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     G   101_B     G   101_B     27   63  132      3   24   49   87  100  107  115  120  123  127  130  133  136  140  146  148  154  160  162  165 
LCS_GDT     M   102_B     M   102_B      4   63  132      3   16   47   67   87  107  115  120  123  127  130  133  136  140  146  148  154  160  162  165 
LCS_GDT     S   103_B     S   103_B      3   63  132      3   14   24   33   45   64   84   98  118  125  129  132  135  138  142  145  152  155  159  165 
LCS_GDT     D   104_B     D   104_B      3   63  132      3    5   24   48   81  106  114  120  123  127  130  133  136  140  146  148  154  160  162  165 
LCS_GDT     R   105_B     R   105_B     12   63  132     11   37   56   78   99  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     A   106_B     A   106_B     12   63  132     16   38   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     D   107_B     D   107_B     12   63  132     18   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     T   108_B     T   108_B     12   63  132     15   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     V   109_B     V   109_B     12   63  132     15   41   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     V   110_B     V   110_B     12   63  132     18   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     D   111_B     D   111_B     12   63  132      5   36   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     D   112_B     D   112_B     12   63  132      8   34   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     I   113_B     I   113_B     12   63  132      9   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     L   114_B     L   114_B     12   63  132      7   32   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     N   115_B     N   115_B     12   63  132     10   36   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     H   116_B     H   116_B     12   63  132     10   40   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     T   117_B     T   117_B     12   63  132     15   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     R   118_B     R   118_B      8   63  132      6   32   58   78  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     R   119_B     R   119_B      3   63  132      3    3    7   16   35   48   61   83  116  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     G   120_B     G   120_B      4    5  132      3    4    4    7   10   27   31   50   60   87  114  129  132  139  146  148  154  160  162  165 
LCS_GDT     A   121_B     A   121_B      4    5  132      3    4    4    8   14   22   33   56   77   94  111  123  132  138  146  148  154  160  162  165 
LCS_GDT     S   122_B     S   122_B      4    5  132      3    4   12   17   19   20   41   56   80   89   99  122  125  131  139  143  150  160  162  165 
LCS_GDT     V   123_B     V   123_B      4    5  132      3    4    4   17   19   21   33   48   63   82   94  105  125  130  139  144  150  160  162  165 
LCS_GDT     G   124_B     G   124_B      3    6  132      3    3    3    6    6   10   18   25   32   41   58   76   87  110  121  128  138  142  154  159 
LCS_GDT     S   125_B     S   125_B      5    6  132      4    6    7    7   12   14   24   33   60   77   86  107  125  130  134  143  150  160  162  165 
LCS_GDT     R   126_B     R   126_B      5    6  132      4    8   12   17   26   40   62   82  107  117  122  125  130  138  144  148  154  160  162  165 
LCS_GDT     A   127_B     A   127_B      5   20  132      4    8   36   69   92  106  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     L   128_B     L   128_B      5   20  132      4    5   24   49   64   78  102  118  123  126  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     Y   129_B     Y   129_B      5   20  132      4    5    8   32   44   76  110  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     L   130_B     L   130_B      5   20  132      4   16   32   54   75   98  114  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     L   131_B     L   131_B      5   20  132      4    5   16   26   37   64   85  116  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     P   132_B     P   132_B      8   20  132      4   11   22   61   84  106  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     F   133_B     F   133_B      8   20  132      3    6   24   41   74   98  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     N   134_B     N   134_B      9   20  132      3   13   33   54   87  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     L   135_B     L   135_B      9   20  132      7   21   53   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     L   136_B     L   136_B      9   20  132      7   20   53   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     G   137_B     G   137_B      9   20  132      7   17   44   70   98  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     N   138_B     N   138_B      9   20  132      7   20   50   85  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     F   139_B     F   139_B      9   20  132      5   20   53   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     R   140_B     R   140_B      9   20  132      5   18   53   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     E   141_B     E   141_B      9   20  132      3   16   53   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     P   142_B     P   142_B      9   20  132     18   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     K   143_B     K   143_B      9   20  132     13   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     R   144_B     R   144_B      9   20  132     12   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     L   145_B     L   145_B      9   20  132     18   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     L   146_B     L   146_B      9   20  132     18   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     D   147_B     D   147_B      6   20  132      3   18   34   59   93  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     S   148_B     S   148_B      4   17  132      3    5   12   20   30   50   79   87  103  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     L   149_B     L   149_B      4   16  132      3    6   16   23   55   68  106  118  122  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     A   150_B     A   150_B      4   16  132      3    4   13   23   43   68   79   97  120  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     E   151_B     E   151_B      4   16  132      3    6   12   23   32   57   79   88  103  118  127  132  137  140  146  148  154  160  162  165 
LCS_GDT     R   152_B     R   152_B      4   16  132      3    6   16   23   32   40   68   82  100  114  124  131  134  139  146  148  152  156  161  165 
LCS_GDT     S   153_B     S   153_B      4   16  132      3    4    4   23   29   39   58   82  102  114  126  131  134  139  146  148  152  160  162  165 
LCS_GDT     V   154_B     V   154_B     10   16  132      6   28   59   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     A   155_B     A   155_B     10   16  132     13   29   59   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     A   156_B     A   156_B     10   16  132     13   41   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     V   157_B     V   157_B     10   16  132     11   39   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     V   158_B     V   158_B     10   16  132      9   38   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     S   159_B     S   159_B     10   16  132      9   37   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     V   160_B     V   160_B     10   16  132      8   25   56   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     F   161_B     F   161_B     10   16  132      7   29   64   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     G   162_B     G   162_B     10   16  132      4   27   42   80  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     D   163_B     D   163_B     10   16  132      3   29   60   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     S   164_B     S   164_B      4   11  132      3    4   11   27   60   99  110  119  122  125  129  133  137  140  144  148  154  160  162  165 
LCS_GDT     A   165_B     A   165_B      6    7  132      5    5    6   11   17   22   35   63   79   98  121  127  133  138  144  148  154  160  162  165 
LCS_GDT     E   166_B     E   166_B      6    6  132      5    5    6    6    9   13   20   29   36   42   51   71   99  127  135  138  147  154  162  165 
LCS_GDT     A   167_B     A   167_B      6    6  131      5    5    6    6    6    8    8   10   22   28   30   54   62   79   98  123  139  150  157  164 
LCS_GDT     T   168_B     T   168_B      6    6  131      5    5    6    6    6    8    8   10   32   43   77  103  124  138  143  148  154  160  162  165 
LCS_GDT     R   169_B     R   169_B      6    6  131      5    5    6    6    6   17   26   37   53   81  101  117  129  138  144  148  154  160  162  165 
LCS_GDT     V   170_B     V   170_B      6    6  130      3    3    6    6    6    8    8   11   12   17   25   54   58   72   85  106  131  150  157  164 
LCS_GDT     R   171_B     R   171_B      3    5  127      3    3    4    4    6    8    8    9   11   12   13   16   18   25   31   39   42   45   68   75 
LCS_GDT     Q   172_B     Q   172_B      3    5   20      3    3    4    4    6    8    8   11   12   17   25   39   58   68   85  145  152  158  162  165 
LCS_GDT     S   173_B     S   173_B      3    7   20      0    3    3    5    6   12   17   28   35   41   46   54   74   96  130  145  152  158  162  164 
LCS_GDT     Y   174_B     Y   174_B      6    7   20      6    6    6    6    6    7    7   11   14   20   25   34   44   55   67   72   87  113  136  147 
LCS_GDT     Y   175_B     Y   175_B      6    7   20      6    6    6    6    6    7    7    8   13   16   20   34   42   50   59   72   75   81  104  136 
LCS_GDT     R   176_B     R   176_B      6    7   20      6    6    6    6    9   12   17   22   34   41   46   54   98  127  142  148  154  160  162  165 
LCS_GDT     R   177_B     R   177_B      6    7   20      6    6    6    6    7   20   26   31   35   42   53   90  113  129  142  148  154  160  162  165 
LCS_GDT     C   178_B     C   178_B      6    7   20      6    6    6    6    8    9   10   11   13   15   21   41   50   64   85   96  125  140  157  164 
LCS_GDT     G   179_B     G   179_B      6    7   20      6    6    6    7    8   10   25   31   35   41   48   92  115  129  142  148  154  160  162  165 
LCS_GDT     V   180_B     V   180_B      4    4   20      3    4    4    7    8   16   26   31   35   55  102  113  128  138  143  148  154  160  162  165 
LCS_GDT     Q   181_B     Q   181_B      4    4   20      3    4    4    5   16   26   57   69   86   97  104  121  132  138  144  148  154  160  162  165 
LCS_GDT     G   182_B     G   182_B      4    4   20      3   10   42   63   75   86  101  111  121  125  129  132  137  140  146  148  154  160  162  165 
LCS_GDT     L   183_B     L   183_B      4    4   20      3   10   31   76   94  106  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     E   184_B     E   184_B      3    5   20      2    9   17   49   75   98  114  120  123  127  130  133  136  140  146  148  152  156  159  165 
LCS_GDT     L   185_B     L   185_B      4    5   19      3    5   30   51   72   92  114  118  122  126  129  132  136  140  146  148  152  155  159  163 
LCS_GDT     H   186_B     H   186_B      4    5   19      3    6    9   14   22   28   60   68   77  104  117  127  132  137  142  145  149  151  154  157 
LCS_GDT     T   187_B     T   187_B      4    7   19      3    4    5    6    8   13   14   19   22   28   69   74   78   88  104  115  132  138  144  150 
LCS_GDT     R   188_B     R   188_B      5    7   19      4    4    6    6    8    9    9   10   12   17   28   35   42   48   70   88   91   93  122  127 
LCS_GDT     D   189_B     D   189_B      5    7   19      4    4    6    6    7    9    9   10   12   15   17   19   21   34   45   48   69   78   83   90 
LCS_GDT     D   190_B     D   190_B      5    7   19      4    4    6    6    6    7    9   11   12   13   15   29   35   41   49   57   69   78   83   92 
LCS_GDT     G   191_B     G   191_B      5    7   19      4    4    6    6    7    8   10   20   21   26   28   35   42   48   70   88   91   93  101  106 
LCS_GDT     T   192_B     T   192_B      5    8   19      0    6    7   10   13   18   21   33   45   55   75   82   90   97  119  131  140  146  147  152 
LCS_GDT     V   193_B     V   193_B      5    8   19      3    6    7   14   22   34   60   68   77  104  117  127  132  138  142  145  149  151  154  159 
LCS_GDT     F   194_B     F   194_B      5    8   30      3    6    8   12   23   58   77   95  102  122  129  132  135  139  143  146  150  155  156  163 
LCS_GDT     T   195_B     T   195_B      5    8   30      3    6    8   35   55   88  114  119  123  127  130  133  137  140  146  148  152  160  161  165 
LCS_GDT     G   196_B     G   196_B      5    8   30      4    6    7    8   20   43   73   86  100  119  126  131  137  140  146  148  154  160  162  165 
LCS_GDT     S   197_B     S   197_B      5    8   30      4    5    7    8    9   43   58   76   95  108  125  131  137  140  146  148  154  160  162  165 
LCS_GDT     D   198_B     D   198_B      5    8   30      4    5    7    8    9   16   26   33   42   53   81   88  110  130  136  145  154  160  162  165 
LCS_GDT     G   199_B     G   199_B      5    8   30      4    4    7   12   47   59   75   88  103  112  124  131  137  140  146  148  154  160  162  165 
LCS_GDT     F   200_B     F   200_B      3    3   30      3    4    4    6    6   20   28   43   73   92  105  120  132  139  144  148  154  160  162  165 
LCS_GDT     Y   201_B     Y   201_B      3    4   30      3    4    4    4    5    7   24   39   62   87  104  120  132  139  144  148  154  160  162  165 
LCS_GDT     S   202_B     S   202_B      3   22   30      3    4    4    4   17   27   66   88  101  117  125  131  137  140  146  148  154  160  162  165 
LCS_GDT     R   203_B     R   203_B     15   22   30      3    8   33   66   96  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     S   204_B     S   204_B     20   22   30      3   15   44   82  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     Y   205_B     Y   205_B     20   22   30      5   27   42   79  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     S   206_B     S   206_B     20   22   30     13   27   53   82  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     R   207_B     R   207_B     20   22   30      9   27   53   82  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     A   208_B     A   208_B     20   22   30     11   27   53   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     C   209_B     C   209_B     20   22   30     11   27   53   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     L   210_B     L   210_B     20   22   30     11   27   62   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     H   211_B     H   211_B     20   22   30     13   29   64   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     A   212_B     A   212_B     20   22   30     13   27   62   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     L   213_B     L   213_B     20   22   30     13   27   62   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     L   214_B     L   214_B     20   22   30     13   33   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     A   215_B     A   215_B     20   22   30     13   34   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     E   216_B     E   216_B     20   22   30     13   33   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     C   217_B     C   217_B     20   22   30     13   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     G   218_B     G   218_B     20   22   30     18   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     L   219_B     L   219_B     20   22   30     18   42   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     T   220_B     T   220_B     20   22   30     13   35   66   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     V   221_B     V   221_B     20   22   30      9   29   64   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     V   222_B     V   222_B     20   22   30      9   28   60   87  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_GDT     R   223_B     R   223_B     20   22   30      9   28   54   82  100  107  115  120  123  127  130  133  137  140  146  148  154  160  162  165 
LCS_AVERAGE  LCS_A:  19.71  (   4.68   12.30   42.13 )

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     18     42     66     87    100    107    115    120    123    127    130    133    137    140    146    148    154    160    162    165 
GDT PERCENT_AT   7.83  18.26  28.70  37.83  43.48  46.52  50.00  52.17  53.48  55.22  56.52  57.83  59.57  60.87  63.48  64.35  66.96  69.57  70.43  71.74
GDT RMS_LOCAL    0.29   0.69   0.97   1.36   1.52   1.65   1.83   2.00   2.11   2.40   2.51   2.67   3.14   3.05   3.51   3.66   4.42   4.66   4.90   4.93
GDT RMS_ALL_AT   8.89   8.94   8.93   9.00   9.07   9.06   9.03   9.00   9.00   9.12   9.10   9.09   9.13   9.12   9.16   9.13   9.10   9.09   9.15   9.09

# Checking swapping
#   possible swapping detected:  F    16_B      F    16_B
#   possible swapping detected:  F    21_B      F    21_B
#   possible swapping detected:  D    34_B      D    34_B
#   possible swapping detected:  D    35_B      D    35_B
#   possible swapping detected:  E    43_B      E    43_B
#   possible swapping detected:  F    48_B      F    48_B
#   possible swapping detected:  E    49_B      E    49_B
#   possible swapping detected:  Y    53_B      Y    53_B
#   possible swapping detected:  D    57_B      D    57_B
#   possible swapping detected:  E    61_B      E    61_B
#   possible swapping detected:  Y    65_B      Y    65_B
#   possible swapping detected:  E    71_B      E    71_B
#   possible swapping detected:  E    98_B      E    98_B
#   possible swapping detected:  D   104_B      D   104_B
#   possible swapping detected:  D   112_B      D   112_B
#   possible swapping detected:  E   141_B      E   141_B
#   possible swapping detected:  D   147_B      D   147_B
#   possible swapping detected:  E   151_B      E   151_B
#   possible swapping detected:  Y   174_B      Y   174_B
#   possible swapping detected:  E   184_B      E   184_B
#   possible swapping detected:  D   189_B      D   189_B
#   possible swapping detected:  F   194_B      F   194_B
#   possible swapping detected:  D   198_B      D   198_B
#   possible swapping detected:  F   200_B      F   200_B
#   possible swapping detected:  E   216_B      E   216_B

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    A    15_B      A    15_B    23.773     0    0.066   0.060    25.510    0.000    0.000
LGA    F    16_B      F    16_B    19.232     0    0.036   0.257    20.789    0.000    0.000
LGA    Y    17_B      Y    17_B    16.331     0    0.165   0.268    18.062    0.000    0.040
LGA    E    18_B      E    18_B    21.658     0    0.026   0.181    26.563    0.000    0.000
LGA    L    19_B      L    19_B    21.704     0    0.697   0.602    24.002    0.000    0.000
LGA    E    20_B      E    20_B    20.385     0    0.137   0.893    21.536    0.000    0.000
LGA    F    21_B      F    21_B    16.309     0    0.510   0.405    17.377    0.000    0.000
LGA    G    22_B      G    22_B    19.572     0    0.528   0.528    19.572    0.000    0.000
LGA    P    23_B      P    23_B    17.424     0    0.126   0.168    21.209    0.000    0.000
LGA    R    24_B      R    24_B    14.147     0    0.216   1.093    22.366    0.000    0.000
LGA    T    25_B      T    25_B    11.817     0    0.355   0.741    14.410    0.119    0.068
LGA    I    26_B      I    26_B    10.284     0    0.637   0.627    14.475    4.286    2.143
LGA    M    27_B      M    27_B     4.313     0    0.207   1.150     6.296   26.667   31.310
LGA    T    28_B      T    28_B     9.271     0    0.162   1.058    12.464    3.929    2.245
LGA    L    29_B      L    29_B    10.234     0    0.614   0.732    14.173    0.000    0.000
LGA    A    30_B      A    30_B    13.633     0    0.634   0.622    15.320    0.000    0.000
LGA    N    31_B      N    31_B    17.139     0    0.632   0.825    22.790    0.000    0.000
LGA    F    32_B      F    32_B    14.895     0    0.197   0.586    16.303    0.000    0.000
LGA    P    33_B      P    33_B    17.653     0    0.646   0.654    18.929    0.000    0.000
LGA    D    34_B      D    34_B    14.818     0    0.683   1.204    18.332    0.000    0.000
LGA    D    35_B      D    35_B    12.850     0    0.091   1.057    14.412    0.000    0.000
LGA    V    36_B      V    36_B    16.008     0    0.214   1.251    20.277    0.000    0.000
LGA    L    37_B      L    37_B    10.626     0    0.610   1.451    12.244    0.119    1.310
LGA    P    38_B      P    38_B    11.282     0    0.593   0.646    13.241    0.000    0.000
LGA    L    39_B      L    39_B    11.987     0    0.064   0.948    13.253    0.000    0.000
LGA    L    40_B      L    40_B    10.816     0    0.050   1.430    14.216    0.476    0.298
LGA    Q    41_B      Q    41_B     8.720     0    0.049   1.186     9.698    3.810    2.646
LGA    M    42_B      M    42_B     8.991     0    0.121   0.653    13.139    2.976    1.548
LGA    E    43_B      E    43_B     9.366     0    0.055   0.686    11.602    3.095    1.376
LGA    S    44_B      S    44_B     7.086     0    0.082   0.608     8.053   12.262   11.587
LGA    L    45_B      L    45_B     5.774     0    0.313   1.104     6.276   19.286   22.381
LGA    M    46_B      M    46_B     6.316     0    0.607   0.735     7.796   15.714   14.167
LGA    T    47_B      T    47_B     3.472     0    0.175   0.748     5.539   50.119   45.986
LGA    F    48_B      F    48_B     1.828     0    0.099   0.989     3.892   70.833   64.719
LGA    E    49_B      E    49_B     1.578     0    0.037   1.283     7.467   79.286   54.762
LGA    A    50_B      A    50_B     2.274     0    0.207   0.210     3.149   63.095   61.905
LGA    M    51_B      M    51_B     2.647     0    0.188   0.988     8.515   61.071   45.595
LGA    A    52_B      A    52_B     2.391     0    0.455   0.441     4.665   62.857   56.571
LGA    Y    53_B      Y    53_B     6.315     0    0.600   1.403    15.416   22.738    7.976
LGA    L    54_B      L    54_B     7.466     0    0.699   0.602     9.736   11.071    6.964
LGA    R    55_B      R    55_B     7.413     0    0.387   1.269    15.586   12.619    5.022
LGA    C    56_B      C    56_B     7.751     0    0.649   0.606    12.908   12.262    8.254
LGA    D    57_B      D    57_B     1.581     0    0.666   1.199     3.619   73.690   64.762
LGA    A    58_B      A    58_B     1.851     0    0.075   0.089     2.117   68.810   69.619
LGA    L    59_B      L    59_B     1.374     0    0.032   0.134     1.443   81.429   81.429
LGA    V    60_B      V    60_B     0.379     0    0.132   0.207     1.273   90.595   90.612
LGA    E    61_B      E    61_B     0.539     0    0.031   0.854     3.115   95.238   83.280
LGA    L    62_B      L    62_B     0.836     0    0.082   0.094     0.908   90.476   90.476
LGA    G    63_B      G    63_B     0.848     0    0.057   0.057     0.916   90.476   90.476
LGA    C    64_B      C    64_B     0.398     0    0.102   0.140     0.735   95.238   96.825
LGA    Y    65_B      Y    65_B     1.778     0    0.184   1.380     9.855   75.000   41.548
LGA    D    66_B      D    66_B     1.829     0    0.056   0.998     4.152   72.857   62.560
LGA    G    67_B      G    67_B     1.382     0    0.320   0.320     1.660   79.286   79.286
LGA    R    68_B      R    68_B     3.055     0    0.135   1.662    11.819   55.476   28.571
LGA    A    69_B      A    69_B     1.199     0    0.187   0.193     1.718   83.810   81.619
LGA    L    70_B      L    70_B     0.186     0    0.297   1.398     5.435   92.976   72.440
LGA    E    71_B      E    71_B     0.578     0    0.103   0.282     1.901   90.595   84.603
LGA    I    72_B      I    72_B     2.659     0    0.036   1.145     5.750   61.071   45.179
LGA    A    73_B      A    73_B     3.644     0    0.045   0.061     4.449   48.333   46.095
LGA    R    74_B      R    74_B     2.315     0    0.062   1.542     5.822   66.786   54.848
LGA    L    75_B      L    75_B     0.270     0    0.025   0.202     1.271   95.238   90.595
LGA    L    76_B      L    76_B     1.170     0    0.688   0.615     3.432   75.833   78.631
LGA    N    77_B      N    77_B     1.546     0    0.225   0.810     4.916   75.000   60.595
LGA    A    78_B      A    78_B     1.220     0    0.098   0.138     1.346   81.429   81.429
LGA    R    79_B      R    79_B     1.063     0    0.066   0.894     3.605   81.429   76.407
LGA    Y    80_B      Y    80_B     0.847     0    0.041   1.173     7.319   92.857   62.698
LGA    L    81_B      L    81_B     0.454     0    0.072   0.188     1.361   95.238   92.917
LGA    G    82_B      G    82_B     0.646     0    0.069   0.069     0.646   97.619   97.619
LGA    V    83_B      V    83_B     0.402     0    0.094   1.008     2.290   97.619   89.728
LGA    D    84_B      D    84_B     0.793     0    0.038   0.423     1.635   85.952   86.071
LGA    L    85_B      L    85_B     1.772     0    0.101   0.256     2.693   69.048   66.905
LGA    D    86_B      D    86_B     1.894     0    0.042   0.369     2.516   72.857   70.893
LGA    Q    87_B      Q    87_B     2.235     0    0.062   1.289     4.086   64.762   63.492
LGA    R    88_B      R    88_B     2.381     0    0.040   1.464    10.667   64.762   37.056
LGA    A    89_B      A    89_B     1.683     0    0.022   0.023     1.988   75.000   74.571
LGA    I    90_B      I    90_B     1.727     0    0.103   0.128     2.135   72.857   71.845
LGA    E    91_B      E    91_B     1.750     0    0.081   0.365     3.011   72.857   67.619
LGA    T    92_B      T    92_B     1.852     0    0.033   0.117     1.992   72.857   72.857
LGA    L    93_B      L    93_B     1.819     0    0.053   1.142     3.328   72.857   71.071
LGA    R    94_B      R    94_B     1.894     0    0.026   1.048     4.990   72.857   70.996
LGA    T    95_B      T    95_B     1.824     0    0.031   1.044     3.935   72.857   66.395
LGA    R    96_B      R    96_B     1.819     0    0.029   0.401     3.454   72.857   67.186
LGA    I    97_B      I    97_B     1.897     0    0.111   1.350     4.980   72.857   68.869
LGA    E    98_B      E    98_B     1.901     0    0.127   0.863     4.583   72.857   60.106
LGA    R    99_B      R    99_B     1.245     0    0.175   0.387     1.388   81.429   83.896
LGA    E   100_B      E   100_B     1.175     0    0.610   0.799     2.640   77.619   78.836
LGA    G   101_B      G   101_B     1.849     0    0.373   0.373     2.443   68.810   68.810
LGA    M   102_B      M   102_B     3.231     0    0.646   1.248     5.440   41.190   41.726
LGA    S   103_B      S   103_B     7.564     0    0.204   0.652    11.480   11.190    7.540
LGA    D   104_B      D   104_B     4.078     0    0.646   1.032     6.425   51.548   35.952
LGA    R   105_B      R   105_B     2.521     0    0.596   1.358    12.094   73.690   30.346
LGA    A   106_B      A   106_B     1.569     0    0.138   0.243     2.125   72.976   71.333
LGA    D   107_B      D   107_B     1.170     0    0.124   0.833     2.415   85.952   77.381
LGA    T   108_B      T   108_B     0.999     0    0.093   1.052     3.145   81.786   74.762
LGA    V   109_B      V   109_B     1.155     0    0.076   1.041     2.748   83.690   76.871
LGA    V   110_B      V   110_B     0.986     0    0.056   0.204     1.525   85.952   82.789
LGA    D   111_B      D   111_B     1.324     0    0.065   0.408     2.840   81.429   73.155
LGA    D   112_B      D   112_B     1.543     0    0.089   0.259     2.317   81.548   75.179
LGA    I   113_B      I   113_B     1.549     0    0.041   0.095     2.595   79.286   71.131
LGA    L   114_B      L   114_B     1.050     0    0.131   0.378     1.561   83.810   83.750
LGA    N   115_B      N   115_B     0.697     0    0.128   0.773     3.788   90.476   74.524
LGA    H   116_B      H   116_B     1.386     0    0.252   1.118     2.810   77.262   75.714
LGA    T   117_B      T   117_B     1.356     0    0.028   0.896     2.302   75.119   76.667
LGA    R   118_B      R   118_B     2.644     0    0.587   0.638     3.496   59.167   71.126
LGA    R   119_B      R   119_B     7.221     0    0.238   0.997    14.616   10.833    4.026
LGA    G   120_B      G   120_B     9.170     0    0.675   0.675     9.170    4.524    4.524
LGA    A   121_B      A   121_B     8.936     0    0.082   0.082     9.952    3.333    2.762
LGA    S   122_B      S   122_B    10.373     0    0.678   0.733    12.302    0.476    0.317
LGA    V   123_B      V   123_B    10.767     0    0.529   0.540    11.184    0.000    0.000
LGA    G   124_B      G   124_B    12.807     0    0.470   0.470    12.807    0.119    0.119
LGA    S   125_B      S   125_B    10.695     0    0.592   0.841    12.098    1.071    0.714
LGA    R   126_B      R   126_B     8.009     0    0.107   1.346    13.271    7.381    3.333
LGA    A   127_B      A   127_B     3.290     0    0.158   0.194     4.676   45.357   49.238
LGA    L   128_B      L   128_B     4.691     0    0.639   1.440    10.850   33.333   19.762
LGA    Y   129_B      Y   129_B     4.616     0    0.194   0.640    13.543   32.976   12.976
LGA    L   130_B      L   130_B     3.780     0    0.034   1.186     9.402   37.500   23.274
LGA    L   131_B      L   131_B     5.087     0    0.243   0.923    11.286   30.476   17.976
LGA    P   132_B      P   132_B     3.178     0    0.163   0.185     5.545   46.786   38.776
LGA    F   133_B      F   133_B     3.639     0    0.322   0.461     7.705   45.119   30.996
LGA    N   134_B      N   134_B     3.201     0    0.221   0.183     7.023   53.571   37.321
LGA    L   135_B      L   135_B     1.886     0    0.058   0.165     2.219   70.833   71.845
LGA    L   136_B      L   136_B     1.952     0    0.031   0.239     2.308   68.810   67.798
LGA    G   137_B      G   137_B     2.576     0    0.117   0.117     3.206   57.262   57.262
LGA    N   138_B      N   138_B     2.075     0    0.124   0.626     4.031   70.952   67.500
LGA    F   139_B      F   139_B     1.887     0    0.080   0.787     3.805   68.810   63.117
LGA    R   140_B      R   140_B     1.876     0    0.061   1.369     7.794   68.810   51.039
LGA    E   141_B      E   141_B     1.867     0    0.197   0.254     3.041   70.952   63.333
LGA    P   142_B      P   142_B     0.832     0    0.085   0.085     1.493   88.214   86.599
LGA    K   143_B      K   143_B     0.661     0    0.029   0.141     1.856   90.476   86.508
LGA    R   144_B      R   144_B     1.195     0    0.152   1.290     6.647   88.214   64.545
LGA    L   145_B      L   145_B     0.922     0    0.061   0.177     2.235   88.214   79.583
LGA    L   146_B      L   146_B     0.750     0    0.626   1.218     2.899   86.071   80.774
LGA    D   147_B      D   147_B     3.263     0    0.641   1.239     7.179   43.929   30.774
LGA    S   148_B      S   148_B     7.335     0    0.621   0.842    11.419   17.619   11.825
LGA    L   149_B      L   149_B     5.399     0    0.177   0.155     6.130   25.000   25.119
LGA    A   150_B      A   150_B     6.398     0    0.188   0.207     7.552   14.643   13.143
LGA    E   151_B      E   151_B     8.242     0    0.327   1.006    10.536    5.952    3.228
LGA    R   152_B      R   152_B     9.015     0    0.123   0.736    10.801    2.500    1.212
LGA    S   153_B      S   153_B     8.385     0    0.619   0.847    11.200    8.690    5.794
LGA    V   154_B      V   154_B     1.866     0    0.648   1.093     4.804   65.476   60.408
LGA    A   155_B      A   155_B     1.883     0    0.075   0.094     2.108   70.833   71.238
LGA    A   156_B      A   156_B     1.003     0    0.062   0.090     1.157   85.952   86.857
LGA    V   157_B      V   157_B     1.104     0    0.196   0.272     1.891   79.286   80.204
LGA    V   158_B      V   158_B     0.896     0    0.080   0.107     1.205   90.476   87.891
LGA    S   159_B      S   159_B     0.819     0    0.107   0.561     2.694   83.810   78.968
LGA    V   160_B      V   160_B     1.484     0    0.075   0.155     2.840   83.690   76.803
LGA    F   161_B      F   161_B     1.190     0    0.037   0.171     2.129   75.119   81.602
LGA    G   162_B      G   162_B     2.603     0    0.056   0.056     2.603   73.333   73.333
LGA    D   163_B      D   163_B     1.744     0    0.680   1.081     4.145   56.071   51.429
LGA    S   164_B      S   164_B     5.212     0    0.037   0.053     6.893   24.048   23.254
LGA    A   165_B      A   165_B    10.196     0    0.613   0.606    11.972    0.714    0.571
LGA    E   166_B      E   166_B    13.978     0    0.031   1.110    18.341    0.000    0.000
LGA    A   167_B      A   167_B    16.220     0    0.102   0.103    17.425    0.000    0.000
LGA    T   168_B      T   168_B    13.643     0    0.037   0.097    15.171    0.000    0.000
LGA    R   169_B      R   169_B    13.341     0    0.574   0.915    17.397    0.000    1.558
LGA    V   170_B      V   170_B    17.927     0    0.624   0.638    20.945    0.000    0.000
LGA    R   171_B      R   171_B    19.317     0    0.385   1.107    27.260    0.000    0.000
LGA    Q   172_B      Q   172_B    15.159     0    0.603   1.294    16.839    0.000    0.000
LGA    S   173_B      S   173_B    16.451     0    0.625   0.574    19.303    0.000    0.000
LGA    Y   174_B      Y   174_B    18.201     0    0.612   1.477    25.041    0.000    0.000
LGA    Y   175_B      Y   175_B    17.913     0    0.019   0.338    24.142    0.000    0.000
LGA    R   176_B      R   176_B    13.591     0    0.026   1.225    15.121    0.000    1.472
LGA    R   177_B      R   177_B    15.673     0    0.029   0.891    17.609    0.000    0.000
LGA    C   178_B      C   178_B    18.484     0    0.040   0.056    20.753    0.000    0.000
LGA    G   179_B      G   179_B    15.099     0    0.451   0.451    16.243    0.000    0.000
LGA    V   180_B      V   180_B    11.554     0    0.629   0.622    12.732    1.190    0.680
LGA    Q   181_B      Q   181_B    12.270     0    0.629   0.942    20.407    0.714    0.317
LGA    G   182_B      G   182_B     7.182     0    0.454   0.454     9.357   21.548   21.548
LGA    L   183_B      L   183_B     3.178     0    0.634   1.359     7.828   52.262   37.857
LGA    E   184_B      E   184_B     4.397     0    0.603   0.844    11.685   41.905   21.058
LGA    L   185_B      L   185_B     5.388     0    0.632   0.830     8.549   20.595   17.083
LGA    H   186_B      H   186_B    11.156     0    0.177   0.442    12.967    0.714    0.381
LGA    T   187_B      T   187_B    17.048     0    0.156   0.983    19.456    0.000    0.000
LGA    R   188_B      R   188_B    21.948     0    0.713   1.423    25.244    0.000    0.000
LGA    D   189_B      D   189_B    28.188     0    0.031   0.339    30.513    0.000    0.000
LGA    D   190_B      D   190_B    26.988     0    0.269   1.128    28.231    0.000    0.000
LGA    G   191_B      G   191_B    22.985     0    0.496   0.496    24.192    0.000    0.000
LGA    T   192_B      T   192_B    15.980     0    0.171   0.895    18.355    0.000    0.000
LGA    V   193_B      V   193_B    10.332     0    0.073   0.099    12.183    1.905    1.293
LGA    F   194_B      F   194_B     7.843     0    0.042   1.286    16.325   16.190    6.017
LGA    T   195_B      T   195_B     4.649     0    0.047   1.050     6.959   21.905   28.435
LGA    G   196_B      G   196_B     8.415     0    0.106   0.106     8.415   10.000   10.000
LGA    S   197_B      S   197_B    10.435     0    0.099   0.601    13.306    0.119    0.079
LGA    D   198_B      D   198_B    14.309     0    0.051   1.214    17.167    0.000    0.000
LGA    G   199_B      G   199_B     9.379     0    0.271   0.271    10.306    0.476    0.476
LGA    F   200_B      F   200_B    10.778     0    0.612   0.568    15.624    0.119    0.043
LGA    Y   201_B      Y   201_B    10.441     0    0.583   0.716    11.930    0.000    0.159
LGA    S   202_B      S   202_B     8.067     0    0.405   0.700    11.459   15.476   10.397
LGA    R   203_B      R   203_B     3.070     0    0.617   1.509    10.891   47.143   22.771
LGA    S   204_B      S   204_B     2.535     0    0.081   0.637     2.539   60.952   63.571
LGA    Y   205_B      Y   205_B     2.682     0    0.051   0.268     2.955   57.143   60.317
LGA    S   206_B      S   206_B     2.397     0    0.073   0.153     2.443   64.762   67.540
LGA    R   207_B      R   207_B     2.375     0    0.071   1.554     5.681   66.786   53.983
LGA    A   208_B      A   208_B     1.933     0    0.057   0.057     2.057   70.833   69.619
LGA    C   209_B      C   209_B     2.012     0    0.022   0.785     2.362   68.810   71.746
LGA    L   210_B      L   210_B     1.396     0    0.036   1.390     3.912   81.548   74.583
LGA    H   211_B      H   211_B     0.914     0    0.041   1.534     6.680   90.476   60.476
LGA    A   212_B      A   212_B     1.376     0    0.063   0.068     1.818   81.429   79.714
LGA    L   213_B      L   213_B     1.500     0    0.021   1.444     3.322   81.429   74.345
LGA    L   214_B      L   214_B     0.873     0    0.060   0.116     1.053   88.214   89.345
LGA    A   215_B      A   215_B     0.904     0    0.038   0.034     0.959   90.476   90.476
LGA    E   216_B      E   216_B     1.297     0    0.034   0.259     2.199   81.429   78.624
LGA    C   217_B      C   217_B     1.606     0    0.100   0.095     2.083   75.000   72.937
LGA    G   218_B      G   218_B     1.223     0    0.242   0.242     2.266   77.262   77.262
LGA    L   219_B      L   219_B     1.021     0    0.154   0.195     1.754   83.810   80.476
LGA    T   220_B      T   220_B     0.797     0    0.071   0.150     1.804   88.214   82.857
LGA    V   221_B      V   221_B     1.153     0    0.114   0.130     2.153   77.381   77.891
LGA    V   222_B      V   222_B     1.732     0    0.110   0.123     2.267   72.976   71.769
LGA    R   223_B      R   223_B     2.282     0    0.123   1.153     2.814   64.762   70.216

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      209     836    836  100.00    1644   1644  100.00               230
SUMMARY(RMSD_GDC):     8.695          8.598                  9.329           40.125   36.479

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  210  230    4.0    120    2.00    43.152    37.640     5.720

LGA_LOCAL      RMSD:   1.998  Number of atoms:  120  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   8.995  Number of assigned atoms:  209 
Std_ASGN_ATOMS RMSD:   8.695  Standard rmsd on all 209 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.137980 * X  +   0.804724 * Y  +  -0.577392 * Z  + -13.506374
  Y_new =   0.880168 * X  +   0.167693 * Y  +   0.444053 * Z  +  -7.163207
  Z_new =   0.454164 * X  +  -0.569472 * Y  +  -0.685154 * Z  + -22.263515 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  1.415296 -0.471434 -2.448138   [DEG:   81.0905  -27.0112 -140.2680 ]
ZXZ: -2.226389  2.325612  2.468367   [DEG: -127.5627  133.2477  141.4270 ]
 
# END of job
