
#######################################################
#                                                     #
#                        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  198 ( 1543),  selected  198 , name one
# Molecule2: number of CA atoms  198 ( 1543),  selected  198 , 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:    71      53_A - 123_A       4.90    12.77
  LONGEST_CONTINUOUS_SEGMENT:    71      54_A - 124_A       4.80    12.77
  LONGEST_CONTINUOUS_SEGMENT:    71      55_A - 125_A       4.88    12.79
  LCS_AVERAGE:     20.45

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    46      77_A - 122_A       1.94    13.06
  LCS_AVERAGE:      9.03

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    13      80_A - 92_A        0.98    13.18
  LONGEST_CONTINUOUS_SEGMENT:    13      81_A - 93_A        0.99    12.94
  LCS_AVERAGE:      3.10

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  198
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     S     1_A     S     1_A      3    5   19      0    4    5    6    6    6    9   11   11   14   16   18   22   24   25   31   37   39   46   50 
LCS_GDT     E     2_A     E     2_A      4    5   25      3    4    5    6    6    8    9   11   11   13   15   16   27   40   43   46   62   67   74   81 
LCS_GDT     E     3_A     E     3_A      4    5   25      3    4    5    6    6    8    9   14   17   21   29   31   41   63   68   79   89  106  116  118 
LCS_GDT     V     4_A     V     4_A      4    9   25      3    4    6    8   13   16   23   52   61   74   80   88   96  101  111  114  117  118  121  125 
LCS_GDT     K     5_A     K     5_A      5    9   25      3    4   20   46   56   65   79   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     N     6_A     N     6_A      7    9   25      6   15   29   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     A     7_A     A     7_A      7    9   25      6   16   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     D     8_A     D     8_A      7    9   25      6   16   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     L     9_A     L     9_A      7    9   25      6   16   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     Y    10_A     Y    10_A      7    9   25      6   13   22   41   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     W    11_A     W    11_A      7    9   25      6   12   19   35   54   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     G    12_A     G    12_A      7    9   25      4   16   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     F    13_A     F    13_A      4    9   25      3   16   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     S    14_A     S    14_A      6    8   25      4    6    7    7   10   11   36   62   82   94   99  105  108  112  115  117  120  122  124  126 
LCS_GDT     G    15_A     G    15_A      6    8   25      4    6    7   10   27   57   68   80   92   98  101  105  108  112  115  117  120  122  124  126 
LCS_GDT     S    16_A     S    16_A      6    8   25      4    6   11   19   36   50   69   80   88   95  100  105  107  112  115  117  120  121  124  126 
LCS_GDT     S    17_A     S    17_A      6    8   25      4    6    8   27   55   68   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     H    18_A     H    18_A      6    8   25      3    6    7   22   50   67   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     H    19_A     H    19_A      6    8   25      4    7   21   35   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     K    20_A     K    20_A      5    8   25      4    5   19   31   49   68   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     Y    21_A     Y    21_A      6    8   25      4    9   19   26   47   66   77   88   92   99  102  105  108  111  115  117  120  122  124  126 
LCS_GDT     D    22_A     D    22_A      6    8   25      4   13   29   40   54   66   78   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     H    23_A     H    23_A      6    8   25      3    5   24   37   46   56   70   80   92   99  102  104  108  112  115  117  120  122  124  126 
LCS_GDT     N    24_A     N    24_A      6    8   25      3   12   26   35   42   56   66   74   86   94  100  104  108  111  114  117  120  122  124  126 
LCS_GDT     G    25_A     G    25_A      6    8   25      3    5    7    8    8   14   32   44   62   72   82   94   99  102  108  112  116  122  124  125 
LCS_GDT     P    26_A     P    26_A      6    8   25      3    5    7    8    8    9   10   10   14   20   24   72   86   97  101  107  110  116  120  125 
LCS_GDT     K    27_A     K    27_A      4    5   25      3    4    4    4    5    6    7    8   11   12   14   18   27   32   59  106  110  113  117  123 
LCS_GDT     F    28_A     F    28_A      4    5   14      3    4    4    4    6    6    7    8    9   12   16   17   27   30   33   38   48   70   95  109 
LCS_GDT     E    29_A     E    29_A      4    6   14      3    4    4    4    6    6    6    8    9   12   20   21   27   35   40   44   52   60   85   94 
LCS_GDT     K    30_A     K    30_A      3    6   13      3    3    4    4    6    6    7   11   20   23   24   26   27   35   40   44   51   56   63   68 
LCS_GDT     A    31_A     A    31_A      3    6   16      3    3    4    4    6   11   12   16   20   23   24   26   27   35   40   44   51   56   63   75 
LCS_GDT     G    32_A     G    32_A      3    6   16      3    3    4    4    6    6    7   14   20   23   24   26   27   35   40   44   51   56   63   72 
LCS_GDT     K    33_A     K    33_A      3    9   16      3    3    4    5    9    9   11   11   12   13   17   19   22   23   37   44   48   53   63   72 
LCS_GDT     G    34_A     G    34_A      6    9   16      4    6    6    6    8    9   11   11   12   13   17   23   27   35   40   44   52   60   70   75 
LCS_GDT     A    35_A     A    35_A      6    9   16      4    6    6    7    9    9   11   11   13   17   28   41   53   65   91   97  105  109  117  122 
LCS_GDT     E    36_A     E    36_A      6    9   16      4    6    6    7    9   16   17   25   54   67   89   96  104  108  113  117  118  122  124  126 
LCS_GDT     L    37_A     L    37_A      6    9   16      4    6    9   15   27   33   52   69   77   90   95  102  105  109  114  117  120  122  124  126 
LCS_GDT     T    38_A     T    38_A      6    9   16      4    6    7    9   15   18   23   26   35   42   49   63   80   89   97  107  110  115  122  126 
LCS_GDT     N    39_A     N    39_A      6    9   19      3    6    6    7    9    9   11   12   20   31   38   40   48   54   58   83   96  108  112  121 
LCS_GDT     I    40_A     I    40_A      4    9   19      3    5    5    7    9    9   11   13   18   24   25   27   35   46   54   57   73   81  101  113 
LCS_GDT     D    41_A     D    41_A      4    9   19      3    5    5    7    9    9   11   11   14   16   22   22   30   33   38   46   47   50   59   90 
LCS_GDT     A    42_A     A    42_A      4    5   19      3    5    5    5    5    7   10   13   20   24   25   31   38   45   54   65   78   97  107  119 
LCS_GDT     A    43_A     A    43_A      4    5   19      3    5    5    5    6    7   23   25   31   37   46   56   63   79   90  102  107  112  118  126 
LCS_GDT     S    44_A     S    44_A      4    5   19      3    4    4    5    7   17   18   26   28   34   39   54   63   73   90  102  107  112  122  126 
LCS_GDT     A    45_A     A    45_A      4    5   23      3    4    4    9   15   18   19   26   28   34   46   52   63   75   90  102  109  114  122  126 
LCS_GDT     Y    46_A     Y    46_A      3    5   23      3    5    5    9   15   18   19   23   27   34   46   52   63   73   90  102  110  114  122  126 
LCS_GDT     A    47_A     A    47_A      3    5   23      3    5    5    9   15   18   19   23   28   34   38   52   63   73   90  102  107  114  122  126 
LCS_GDT     E    48_A     E    48_A      3    6   23      3    4    6    7   10   11   19   23   26   28   31   35   41   59   63   70   81   87  108  117 
LCS_GDT     T    49_A     T    49_A      3    9   23      3    4    4    6    8   10   15   17   19   23   28   30   41   46   52   70   79   87   92   97 
LCS_GDT     F    50_A     F    50_A      4    9   23      3    5    6    9   15   18   19   23   35   42   46   67   80   85   90  107  110  114  122  126 
LCS_GDT     K    51_A     K    51_A      4    9   23      3    5    6    7   10   18   19   27   35   42   53   71   80   85   94  107  110  114  122  126 
LCS_GDT     K    52_A     K    52_A      4    9   23      3    5    6    7   10   11   15   18   23   26   29   35   42   54   58   83   87  102  108  117 
LCS_GDT     G    53_A     G    53_A      4    9   71      3    4    6    7   10   11   13   18   23   26   39   47   61   71   79   91   96  108  117  123 
LCS_GDT     V    54_A     V    54_A      4    9   71      2    5    6    7    9   11   15   18   23   26   29   30   33   36   49   83   89  102  107  121 
LCS_GDT     F    55_A     F    55_A      4    9   71      3    3    5    7    8   10   14   17   20   23   28   30   33   38   62   91   95  108  117  123 
LCS_GDT     P    56_A     P    56_A      3    9   71      3    5    6    7    9   10   15   17   26   40   55   78   86   96  102  109  116  122  124  126 
LCS_GDT     N    57_A     N    57_A      3    9   71      3    3    4    6    9   11   15   17   23   28   38   62   72   87   95  104  110  117  120  125 
LCS_GDT     N    58_A     N    58_A      3    8   71      3    3    4    6    9   10   14   16   25   30   38   50   65   75   90   97  103  114  119  123 
LCS_GDT     K    59_A     K    59_A      4    9   71      4    5    7   11   23   30   39   46   54   69   81   90  101  109  114  117  120  122  124  125 
LCS_GDT     R    60_A     R    60_A      4    9   71      4    5    7    8    9   15   23   45   64   83   95  102  108  112  115  117  120  122  124  125 
LCS_GDT     E    61_A     E    61_A      4   10   71      4    5    7   21   40   53   73   85   92   99  102  105  108  112  115  117  120  122  124  125 
LCS_GDT     K    62_A     K    62_A      4   15   71      4    8   19   39   55   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     S    63_A     S    63_A      4   15   71      3    3   18   41   58   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     D    64_A     D    64_A      6   15   71      3    5   14   29   55   68   80   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     I    65_A     I    65_A      6   15   71      3   16   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     L    66_A     L    66_A      6   15   71      4   16   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     V    67_A     V    67_A      6   15   71      7   21   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     F    68_A     F    68_A      6   15   71      6   21   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     H    69_A     H    69_A      6   15   71      7   21   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     N    70_A     N    70_A      6   15   71      3   15   27   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     G    71_A     G    71_A      6   15   71      3    4    7    8   18   29   58   71   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     E    72_A     E    72_A      6   24   71      3    5   17   29   56   68   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     V    73_A     V    73_A      6   24   71      3    8   33   45   58   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     K    74_A     K    74_A      6   24   71      4    8   33   45   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     T    75_A     T    75_A      6   24   71      3   12   27   43   58   68   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     E    76_A     E    76_A      6   24   71      3    7   17   27   47   56   78   85   91   99  102  105  108  111  115  117  120  122  124  126 
LCS_GDT     T    77_A     T    77_A      4   46   71      4    4    9   27   53   61   78   87   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     N    78_A     N    78_A      7   46   71      5   16   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     H    79_A     H    79_A      7   46   71      4   10   21   41   55   66   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     S    80_A     S    80_A     13   46   71      4   13   30   46   56   66   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     S    81_A     S    81_A     13   46   71      3   17   33   45   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     Y    82_A     Y    82_A     13   46   71      5   21   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     Q    83_A     Q    83_A     13   46   71      7   21   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     I    84_A     I    84_A     13   46   71      6   21   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     N    85_A     N    85_A     13   46   71      4   21   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     W    86_A     W    86_A     13   46   71      4   19   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     P    87_A     P    87_A     13   46   71      7   21   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     G    88_A     G    88_A     13   46   71      5   17   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     E    89_A     E    89_A     13   46   71      4   17   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     V    90_A     V    90_A     13   46   71      7   21   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     T    91_A     T    91_A     13   46   71      4   17   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     M    92_A     M    92_A     13   46   71      4   16   33   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     K    93_A     K    93_A     13   46   71      5   19   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     L    94_A     L    94_A      8   46   71      3    8   20   46   56   67   80   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     G    95_A     G    95_A      4   46   71      3    5   27   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     Y    96_A     Y    96_A      4   46   71      3    4   22   43   58   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     G    97_A     G    97_A      4   46   71      3   10   18   27   53   62   76   85   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     D    98_A     D    98_A      4   46   71      3    3    5   12   31   63   80   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     G    99_A     G    99_A      8   46   71      3   16   26   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     L   100_A     L   100_A      9   46   71      3   15   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     V   101_A     V   101_A     10   46   71      6   21   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     I   102_A     I   102_A     10   46   71      7   21   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     K   103_A     K   103_A     10   46   71      7   21   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     D   104_A     D   104_A     10   46   71      7   21   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     L   105_A     L   105_A     10   46   71      4   15   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     N   106_A     N   106_A     10   46   71      7   21   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     L   107_A     L   107_A     10   46   71      7   21   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     M   108_A     M   108_A     10   46   71      4   17   33   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     L   109_A     L   109_A     10   46   71      5   17   33   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     K   110_A     K   110_A     10   46   71      3   11   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     N   111_A     N   111_A      6   46   71      3   14   27   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     G   112_A     G   112_A      6   46   71      7   13   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     N   113_A     N   113_A     10   46   71      5   17   33   46   56   67   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     M   114_A     M   114_A     10   46   71      5   14   33   46   56   66   82   88   92   99  102  105  108  112  114  117  120  122  124  126 
LCS_GDT     G   115_A     G   115_A     10   46   71      7   21   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     E   116_A     E   116_A     10   46   71      4   16   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     L   117_A     L   117_A     10   46   71      7   21   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     K   118_A     K   118_A     10   46   71      7   21   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     A   119_A     A   119_A     10   46   71      6   21   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     T   120_A     T   120_A     10   46   71      7   21   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     V   121_A     V   121_A     10   46   71      7   21   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     G   122_A     G   122_A     10   46   71      6   18   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     E   123_A     E   123_A      4   25   71      3    4    4   14   23   34   49   59   77   89   98  101  106  111  114  116  120  122  124  125 
LCS_GDT     N   124_A     N   124_A      4    6   71      3    4    4    6    8   11   14   18   40   47   70   86   93   99  101  107  111  116  120  125 
LCS_GDT     S   125_A     S   125_A      4    6   71      3    4    4    8    9   10   12   13   16   18   20   21   26   32   38   56   72   85   97  106 
LCS_GDT     N   126_A     N   126_A      5   11   68      3    4    5    5   11   12   15   15   16   18   20   23   27   28   32   40   46   59   66   68 
LCS_GDT     I   127_A     I   127_A      5   11   19      3    4    5    5   11   12   15   15   16   20   24   29   38   41   43   51   64   76   80   96 
LCS_GDT     T   128_A     T   128_A      5   11   19      3    4    5    9   11   12   15   15   16   21   24   29   36   40   43   59   71   81   88  100 
LCS_GDT     L   129_A     L   129_A      7   11   19      4    7    8    9   11   12   15   15   18   21   24   29   38   50   62   71   79   98  101  105 
LCS_GDT     F   130_A     F   130_A      7   11   19      4    7    8    9   11   12   15   15   16   21   28   31   42   48   56   64   75   86   89  100 
LCS_GDT     D   131_A     D   131_A      7   11   19      4    7    8    9   12   15   18   21   28   32   39   42   47   55   63   71   77   85   89   95 
LCS_GDT     V   132_A     V   132_A      7   11   19      4    7    8    9   12   15   18   23   28   32   39   42   52   55   63   71   77   86   89   97 
LCS_GDT     Q   133_A     Q   133_A      7   11   19      3    7    8    9   11   12   15   17   27   32   35   41   43   48   50   54   63   69   78   86 
LCS_GDT     E   134_A     E   134_A      7   11   19      4    7    8    9   11   12   15   15   27   32   35   37   43   48   50   58   63   70   79   89 
LCS_GDT     Y   135_A     Y   135_A      7   11   19      4    4    8    9   11   13   18   21   27   32   35   39   44   46   56   61   70   78   87   92 
LCS_GDT     S   136_A     S   136_A      6   11   19      4    4    6    9   11   12   15   15   24   32   35   39   44   48   56   60   70   81   87   93 
LCS_GDT     V   137_A     V   137_A      6   10   19      4    4    6    7    9   11   15   15   17   17   20   24   26   33   38   42   50   56   59   77 
LCS_GDT     S   138_A     S   138_A      6   10   19      3    4    6    7    9   12   15   15   17   17   24   24   28   37   39   47   51   56   59   74 
LCS_GDT     D   139_A     D   139_A      6    9   19      3    4    6    7    9   11   15   15   17   17   19   24   26   30   32   33   47   52   56   61 
LCS_GDT     N   140_A     N   140_A      4    8   19      3    7    8    9   11   12   15   15   17   17   20   24   26   30   38   42   50   53   59   64 
LCS_GDT     T   141_A     T   141_A      6    8   19      3    6    6    7    9   11   14   18   21   23   28   35   41   46   51   53   60   81   86   91 
LCS_GDT     I   142_A     I   142_A      6    8   19      3    6    6    6    7   10   11   16   24   35   50   59   74   84   93   99  104  111  116  119 
LCS_GDT     T   143_A     T   143_A      6    9   19      3    6    6    7   10   12   37   49   61   78   86   90   96  105  111  114  117  118  121  125 
LCS_GDT     V   144_A     V   144_A      6    9   19      3    6   20   28   46   68   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     T   145_A     T   145_A      6    9   19      3    6    6    7   24   54   74   87   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     P   146_A     P   146_A      6    9   19      3    6    6    7   10   11   20   26   32   50   60   75   85  106  111  114  117  122  124  126 
LCS_GDT     K   147_A     K   147_A      4    9   19      3    4    6    7    9   11   14   18   21   29   35   50   61   68   83   94  101  114  120  125 
LCS_GDT     I   148_A     I   148_A      4    9   19      3    4    4    6    7    9   11   13   16   17   19   26   31   35   50   55   68   81   95  107 
LCS_GDT     P   149_A     P   149_A      4    9   19      3    4    6    7    7    9   11   13   16   17   19   22   23   30   35   37   51   59   67   73 
LCS_GDT     P   150_A     P   150_A      4    9   19      3    4    6    7    7    9   11   13   16   17   19   22   23   25   27   30   39   43   46   52 
LCS_GDT     C   151_A     C   151_A      3    9   19      3    3    6    7    7    9   11   12   16   17   19   22   23   25   27   30   35   41   43   52 
LCS_GDT     T   152_A     T   152_A      3    7   19      3    3    4    6    7    8   11   13   16   22   28   30   33   35   37   39   46   48   49   54 
LCS_GDT     T   153_A     T   153_A      3    7   19      3    3    4    6    9   10   13   16   23   26   29   30   33   34   37   39   43   44   47   51 
LCS_GDT     G   154_A     G   154_A      6    7   19      3    4    5    7    8    9   11   15   21   26   29   30   33   34   37   39   43   44   47   51 
LCS_GDT     T   155_A     T   155_A      6    7   19      3    5    5    7    9   10   13   18   23   26   29   30   33   34   37   40   46   48   49   52 
LCS_GDT     W   156_A     W   156_A      6    7   19      4    5    5    7    8   10   13   18   23   26   29   30   33   36   41   47   52   58   64   68 
LCS_GDT     K   157_A     K   157_A      6    7   18      4    5    6    7   10   11   13   18   22   25   29   30   33   40   45   51   61   65   71   83 
LCS_GDT     P   158_A     P   158_A      6    7   18      4    5    5    7    8    9   14   16   22   25   27   36   46   51   62   71   85   98  112  119 
LCS_GDT     W   159_A     W   159_A      6    7   19      4    5    5    7    8   11   14   18   21   29   40   57   64   78   95  111  115  120  123  125 
LCS_GDT     H   160_A     H   160_A      4    7   19      3    4    5    5    5   16   20   26   32   47   60   73   85   95  106  113  116  122  124  126 
LCS_GDT     N   161_A     N   161_A      4    5   19      3    4    5    5    5    6    7    9   32   36   44   66   75   90   99  112  116  122  124  126 
LCS_GDT     D   162_A     D   162_A      4    5   19      3    3    5    5    5   22   30   34   45   56   67   77   87   97  109  113  116  122  124  126 
LCS_GDT     L   163_A     L   163_A      3    6   19      3    5    7   11   21   36   49   59   66   92   98  104  108  111  114  117  120  122  124  126 
LCS_GDT     T   164_A     T   164_A      5    6   19      3    4    7   10   15   30   43   70   75   94  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     S   165_A     S   165_A      5    6   19      3    4    7   10   31   43   58   81   91   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     K   166_A     K   166_A      5    6   19      3    4    7   10   31   42   58   81   91   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     L   167_A     L   167_A      5    6   19      3    4    5    8   13   17   36   49   81   93  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     G   168_A     G   168_A      5    6   19      3    4    5    5   13   18   25   52   64   75   92  103  108  111  114  117  120  122  124  126 
LCS_GDT     S   169_A     S   169_A      7    8   24      3    6    7    8   13   19   32   55   68   82   95  105  108  112  115  117  120  122  124  126 
LCS_GDT     L   170_A     L   170_A      7    8   25      3    6    7    8   12   16   19   21   46   74   93  101  106  112  115  117  120  121  124  126 
LCS_GDT     K   171_A     K   171_A      7    8   28      3    6    7    8   12   16   19   22   63   85   95  102  107  112  115  117  120  122  124  126 
LCS_GDT     S   172_A     S   172_A      7    8   28      3    6   12   29   46   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     V   173_A     V   173_A      7    8   28      3    6    7   11   15   16   22   69   82   91   97  102  104  109  115  117  120  121  124  126 
LCS_GDT     F   174_A     F   174_A      7    8   28      3    6    7   11   18   33   57   85   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     F   175_A     F   175_A      7    8   28      3   14   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     E   176_A     E   176_A      3    8   28      3   15   35   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     S   177_A     S   177_A      3    8   28      3    3    4    7    8   16   39   65   84   91  101  105  108  112  115  117  120  122  124  126 
LCS_GDT     Y   178_A     Y   178_A      4    8   28      3    3    4    7    8   10   13   22   26   34   51   82  100  111  115  116  120  121  124  125 
LCS_GDT     T   179_A     T   179_A      4    8   28      3    3    4    7    8   10   13   14   17   23   46   53   69   87  107  116  119  121  124  125 
LCS_GDT     C   180_A     C   180_A      4    8   28      3    3    4    7    8   10   18   39   63   82   95  101  106  112  115  117  120  121  124  125 
LCS_GDT     N   181_A     N   181_A      4    8   28      3    3    4    7    8   10   13   14   17   38   46   53   73   87  104  116  119  121  124  125 
LCS_GDT     N   182_A     N   182_A      4    8   28      3    3    4    7    8   11   15   30   39   65   85   95  104  112  115  116  119  121  124  125 
LCS_GDT     D   183_A     D   183_A      3    8   28      3    3    4    7    8   11   16   25   35   52   64   91  104  112  115  117  119  121  124  125 
LCS_GDT     D   184_A     D   184_A      3    5   28      0    3    3    7   13   25   34   37   71   80   94  103  108  112  115  117  120  122  124  125 
LCS_GDT     I   185_A     I   185_A      3   10   28      4   21   30   44   53   67   81   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     A   186_A     A   186_A      3   11   28      3    8   28   45   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     K   187_A     K   187_A      3   11   28      3   11   24   36   58   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     K   188_A     K   188_A      3   11   28      3   11   26   45   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     P   189_A     P   189_A      3   11   28      3   10   24   37   58   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     L   190_A     L   190_A      6   11   28      5   10   23   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     P   191_A     P   191_A      6   11   28      5    8   31   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     L   192_A     L   192_A      6   11   28      5   16   25   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     T   193_A     T   193_A      6   11   28      5   16   25   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     V   194_A     V   194_A      6   11   28      5   12   21   36   56   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     V   195_A     V   195_A      6   11   28      3   13   22   46   58   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     L   196_A     L   196_A      4   11   28      3   15   34   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_GDT     N   197_A     N   197_A      4   11   28      3    8   23   33   46   65   78   88   92   99  102  105  108  112  115  117  120  122  124  125 
LCS_GDT     G   198_A     G   198_A      3   11   28      4   15   29   46   61   70   82   88   92   99  102  105  108  112  115  117  120  122  124  126 
LCS_AVERAGE  LCS_A:  10.86  (   3.10    9.03   20.45 )

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      7     21     35     46     61     70     82     88     92     99    102    105    108    112    115    117    120    122    124    126 
GDT PERCENT_AT   3.54  10.61  17.68  23.23  30.81  35.35  41.41  44.44  46.46  50.00  51.52  53.03  54.55  56.57  58.08  59.09  60.61  61.62  62.63  63.64
GDT RMS_LOCAL    0.28   0.69   1.08   1.34   1.64   1.87   2.15   2.31   2.44   2.73   2.90   3.03   3.29   3.71   3.90   3.89   4.07   4.43   4.50   5.38
GDT RMS_ALL_AT  13.18  13.06  13.09  13.26  13.28  13.25  13.25  13.25  13.23  13.18  13.16  13.21  13.14  13.25  13.24  13.12  13.14  13.04  13.05  12.90

# Checking swapping
#   possible swapping detected:  E     2_A      E     2_A
#   possible swapping detected:  E     3_A      E     3_A
#   possible swapping detected:  Y    10_A      Y    10_A
#   possible swapping detected:  D    22_A      D    22_A
#   possible swapping detected:  F    28_A      F    28_A
#   possible swapping detected:  E    29_A      E    29_A
#   possible swapping detected:  E    48_A      E    48_A
#   possible swapping detected:  E    61_A      E    61_A
#   possible swapping detected:  F    68_A      F    68_A
#   possible swapping detected:  Y    82_A      Y    82_A
#   possible swapping detected:  E    89_A      E    89_A
#   possible swapping detected:  E   134_A      E   134_A
#   possible swapping detected:  D   139_A      D   139_A
#   possible swapping detected:  D   162_A      D   162_A
#   possible swapping detected:  F   175_A      F   175_A
#   possible swapping detected:  E   176_A      E   176_A
#   possible swapping detected:  D   184_A      D   184_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    S     1_A      S     1_A    25.889     0    0.022   0.646    27.420    0.000    0.000
LGA    E     2_A      E     2_A    21.644     0    0.559   1.358    25.309    0.000    0.000
LGA    E     3_A      E     3_A    15.029     0    0.088   1.309    17.180    0.000    0.000
LGA    V     4_A      V     4_A    10.502     0    0.058   0.118    14.622    1.905    1.088
LGA    K     5_A      K     5_A     3.731     0    0.525   0.474     5.832   42.976   43.228
LGA    N     6_A      N     6_A     2.187     0    0.074   0.749     6.134   61.071   45.952
LGA    A     7_A      A     7_A     1.384     0    0.087   0.114     1.780   79.286   79.714
LGA    D     8_A      D     8_A     0.963     0    0.019   0.681     3.360   83.690   74.464
LGA    L     9_A      L     9_A     1.104     0    0.139   0.247     2.050   85.952   79.464
LGA    Y    10_A      Y    10_A     2.340     0    0.045   1.335    10.903   60.952   35.397
LGA    W    11_A      W    11_A     3.138     0    0.725   0.775     5.682   48.929   44.626
LGA    G    12_A      G    12_A     1.080     0    0.570   0.570     3.331   73.571   73.571
LGA    F    13_A      F    13_A     1.081     0    0.375   1.216     5.236   73.452   54.892
LGA    S    14_A      S    14_A     7.012     0    0.092   0.734    10.569   17.619   11.984
LGA    G    15_A      G    15_A     5.872     0    0.422   0.422     6.725   24.524   24.524
LGA    S    16_A      S    16_A     5.703     0    0.092   0.622     9.163   30.833   21.984
LGA    S    17_A      S    17_A     3.056     0    0.085   0.090     4.805   50.357   48.333
LGA    H    18_A      H    18_A     3.140     0    0.428   1.540     7.137   59.286   39.143
LGA    H    19_A      H    19_A     2.095     0    0.098   1.148     4.291   62.857   57.048
LGA    K    20_A      K    20_A     2.834     0    0.175   0.600     9.457   55.357   33.810
LGA    Y    21_A      Y    21_A     3.928     0    0.342   0.446     9.459   42.024   21.627
LGA    D    22_A      D    22_A     3.579     0    0.232   0.585     6.147   35.476   36.726
LGA    H    23_A      H    23_A     5.975     0    0.657   0.806     8.165   21.786   13.667
LGA    N    24_A      N    24_A     7.191     0    0.105   1.015     7.627    9.405   12.381
LGA    G    25_A      G    25_A     9.750     0    0.094   0.094     9.750    3.214    3.214
LGA    P    26_A      P    26_A    11.398     0    0.712   0.623    15.991    0.000    0.000
LGA    K    27_A      K    27_A    11.329     0    0.061   0.750    12.813    0.000    0.000
LGA    F    28_A      F    28_A    14.665     0    0.115   1.457    17.956    0.000    0.000
LGA    E    29_A      E    29_A    18.656     0    0.623   1.336    20.124    0.000    0.000
LGA    K    30_A      K    30_A    21.874     0    0.395   1.009    29.288    0.000    0.000
LGA    A    31_A      A    31_A    20.042     0    0.551   0.592    21.107    0.000    0.000
LGA    G    32_A      G    32_A    21.196     0    0.080   0.080    21.196    0.000    0.000
LGA    K    33_A      K    33_A    21.016     0    0.476   1.568    21.618    0.000    0.000
LGA    G    34_A      G    34_A    19.345     0    0.639   0.639    19.809    0.000    0.000
LGA    A    35_A      A    35_A    12.834     0    0.112   0.156    15.119    0.000    0.000
LGA    E    36_A      E    36_A     8.607     0    0.068   0.114    17.163    3.690    1.640
LGA    L    37_A      L    37_A     7.473     0    0.109   0.855    10.009    5.952   20.655
LGA    T    38_A      T    38_A    14.335     0    0.631   0.970    17.837    0.000    0.000
LGA    N    39_A      N    39_A    18.233     0    0.095   0.252    22.203    0.000    0.000
LGA    I    40_A      I    40_A    18.872     0    0.647   1.634    21.154    0.000    0.000
LGA    D    41_A      D    41_A    24.199     0    0.126   1.107    26.764    0.000    0.000
LGA    A    42_A      A    42_A    19.948     0    0.210   0.225    20.809    0.000    0.000
LGA    A    43_A      A    43_A    17.806     0    0.547   0.606    19.310    0.000    0.000
LGA    S    44_A      S    44_A    17.701     0    0.065   0.616    20.362    0.000    0.000
LGA    A    45_A      A    45_A    16.750     0    0.476   0.453    16.750    0.000    0.000
LGA    Y    46_A      Y    46_A    15.001     0    0.599   1.448    19.976    0.000    0.000
LGA    A    47_A      A    47_A    15.572     0    0.370   0.370    19.120    0.000    0.000
LGA    E    48_A      E    48_A    19.882     0    0.058   1.022    23.006    0.000    0.000
LGA    T    49_A      T    49_A    18.628     0    0.343   1.172    20.588    0.000    0.000
LGA    F    50_A      F    50_A    14.384     0    0.338   1.401    15.787    0.000    0.000
LGA    K    51_A      K    51_A    16.064     0    0.153   1.099    18.574    0.000    0.000
LGA    K    52_A      K    52_A    21.011     0    0.081   0.915    28.723    0.000    0.000
LGA    G    53_A      G    53_A    18.780     0    0.072   0.072    19.571    0.000    0.000
LGA    V    54_A      V    54_A    19.035     0    0.483   1.298    20.008    0.000    0.000
LGA    F    55_A      F    55_A    16.991     0    0.285   0.661    22.399    0.000    0.000
LGA    P    56_A      P    56_A    12.617     0    0.076   0.635    13.565    0.000    0.068
LGA    N    57_A      N    57_A    15.546     0    0.264   1.434    17.654    0.000    0.000
LGA    N    58_A      N    58_A    17.283     0    0.591   0.504    23.853    0.000    0.000
LGA    K    59_A      K    59_A    11.423     0    0.151   0.682    16.969    0.000    0.000
LGA    R    60_A      R    60_A     9.500     0    0.203   1.795    16.140    8.095    2.944
LGA    E    61_A      E    61_A     5.555     0    0.407   0.935    11.205   25.833   12.328
LGA    K    62_A      K    62_A     3.248     0    0.492   1.347    10.913   45.476   24.815
LGA    S    63_A      S    63_A     2.690     0    0.236   0.851     5.985   59.167   48.254
LGA    D    64_A      D    64_A     4.165     0    0.583   1.308     9.570   50.357   28.095
LGA    I    65_A      I    65_A     1.157     0    0.346   1.181     3.711   73.214   69.524
LGA    L    66_A      L    66_A     0.756     0    0.056   1.397     3.642   90.476   77.202
LGA    V    67_A      V    67_A     0.290     0    0.065   1.162     3.187   97.619   85.374
LGA    F    68_A      F    68_A     0.956     0    0.257   0.797     2.050   88.214   80.866
LGA    H    69_A      H    69_A     0.818     0    0.170   1.095     7.021   85.952   56.524
LGA    N    70_A      N    70_A     2.297     0    0.325   0.391     6.011   54.524   43.393
LGA    G    71_A      G    71_A     5.070     0    0.499   0.499     5.070   36.190   36.190
LGA    E    72_A      E    72_A     3.452     0    0.389   1.374     5.904   41.905   38.889
LGA    V    73_A      V    73_A     3.154     0    0.192   1.209     4.722   50.119   47.483
LGA    K    74_A      K    74_A     2.699     0    0.380   0.812     3.388   53.571   61.640
LGA    T    75_A      T    75_A     3.393     0    0.064   1.104     4.222   45.357   44.558
LGA    E    76_A      E    76_A     5.363     0    0.129   1.277     6.368   28.810   24.762
LGA    T    77_A      T    77_A     4.789     0    0.249   1.167     6.903   36.190   28.776
LGA    N    78_A      N    78_A     1.314     0    0.031   0.895     4.646   60.714   66.845
LGA    H    79_A      H    79_A     3.708     0    0.186   1.482    10.857   63.571   28.714
LGA    S    80_A      S    80_A     3.507     0    0.116   0.625     6.253   52.619   45.159
LGA    S    81_A      S    81_A     2.563     0    0.107   0.735     4.047   60.952   55.159
LGA    Y    82_A      Y    82_A     1.360     0    0.060   0.522     2.684   83.810   79.683
LGA    Q    83_A      Q    83_A     0.783     0    0.303   0.907     3.779   77.738   71.481
LGA    I    84_A      I    84_A     1.058     0    0.088   0.355     2.173   88.214   81.667
LGA    N    85_A      N    85_A     0.812     0    0.223   1.110     4.114   92.857   75.595
LGA    W    86_A      W    86_A     1.165     0    0.184   0.255     1.763   79.286   82.755
LGA    P    87_A      P    87_A     0.899     0    0.544   0.441     2.531   86.190   77.075
LGA    G    88_A      G    88_A     1.542     0    0.123   0.123     1.542   79.286   79.286
LGA    E    89_A      E    89_A     1.776     0    0.053   0.761     5.132   77.143   58.042
LGA    V    90_A      V    90_A     1.281     0    0.068   1.068     3.425   75.119   70.952
LGA    T    91_A      T    91_A     1.706     0    0.119   0.120     2.045   68.810   72.993
LGA    M    92_A      M    92_A     2.726     0    0.287   0.860     7.153   54.048   39.107
LGA    K    93_A      K    93_A     0.700     0    0.154   1.062     2.894   73.333   70.529
LGA    L    94_A      L    94_A     3.697     0    0.468   1.583     8.711   51.905   36.845
LGA    G    95_A      G    95_A     2.104     0    0.394   0.394     4.575   54.524   54.524
LGA    Y    96_A      Y    96_A     2.978     0    0.203   1.534    10.727   55.833   31.230
LGA    G    97_A      G    97_A     4.822     0    0.112   0.112     4.822   42.262   42.262
LGA    D    98_A      D    98_A     3.625     0    0.527   0.531     6.822   49.167   37.321
LGA    G    99_A      G    99_A     2.048     0    0.446   0.446     2.048   75.119   75.119
LGA    L   100_A      L   100_A     1.431     0    0.063   1.166     4.893   75.000   61.369
LGA    V   101_A      V   101_A     2.248     0    0.090   1.087     4.116   64.881   60.884
LGA    I   102_A      I   102_A     2.457     0    0.084   1.356     5.490   64.762   54.583
LGA    K   103_A      K   103_A     1.567     0    0.059   0.619     2.373   72.857   73.175
LGA    D   104_A      D   104_A     1.450     0    0.588   0.942     4.586   71.429   58.810
LGA    L   105_A      L   105_A     1.704     0    0.285   0.896     2.695   66.905   67.024
LGA    N   106_A      N   106_A     0.866     0    0.053   0.739     3.795   90.476   73.393
LGA    L   107_A      L   107_A     0.933     0    0.045   1.243     4.989   85.952   74.405
LGA    M   108_A      M   108_A     2.010     0    0.027   1.057     3.023   68.810   69.345
LGA    L   109_A      L   109_A     2.476     0    0.591   0.973     5.055   63.095   51.310
LGA    K   110_A      K   110_A     1.552     0    0.382   0.985     7.864   71.071   47.090
LGA    N   111_A      N   111_A     2.359     0    0.272   0.922     6.585   68.929   48.690
LGA    G   112_A      G   112_A     1.484     0    0.376   0.376     2.740   75.476   75.476
LGA    N   113_A      N   113_A     3.187     0    0.101   0.194     5.090   46.071   44.762
LGA    M   114_A      M   114_A     3.447     0    0.079   0.978     8.127   57.381   41.845
LGA    G   115_A      G   115_A     1.809     0    0.071   0.071     2.260   72.976   72.976
LGA    E   116_A      E   116_A     1.558     0    0.090   0.755     4.383   75.000   62.116
LGA    L   117_A      L   117_A     1.120     0    0.086   1.127     3.630   83.690   70.714
LGA    K   118_A      K   118_A     1.205     0    0.100   0.833     4.669   83.690   72.328
LGA    A   119_A      A   119_A     1.960     0    0.080   0.074     2.657   79.286   74.857
LGA    T   120_A      T   120_A     1.569     0    0.051   0.935     3.117   72.857   70.816
LGA    V   121_A      V   121_A     1.831     0    0.107   0.150     1.941   72.857   72.857
LGA    G   122_A      G   122_A     2.104     0    0.264   0.264     6.374   44.524   44.524
LGA    E   123_A      E   123_A     7.881     0    0.651   1.163    12.644    8.810    4.392
LGA    N   124_A      N   124_A    12.444     0    0.116   0.887    16.484    0.000    0.000
LGA    S   125_A      S   125_A    18.587     0    0.245   0.652    20.696    0.000    0.000
LGA    N   126_A      N   126_A    24.234     0    0.490   0.997    28.257    0.000    0.000
LGA    I   127_A      I   127_A    19.575     0    0.091   1.231    20.927    0.000    0.000
LGA    T   128_A      T   128_A    20.015     0    0.053   0.072    23.588    0.000    0.000
LGA    L   129_A      L   129_A    15.982     0    0.590   1.463    18.884    0.000    0.000
LGA    F   130_A      F   130_A    17.427     0    0.049   0.358    18.610    0.000    0.000
LGA    D   131_A      D   131_A    19.483     0    0.116   1.185    23.181    0.000    0.000
LGA    V   132_A      V   132_A    19.203     0    0.032   1.146    20.042    0.000    0.000
LGA    Q   133_A      Q   133_A    23.516     0    0.031   1.333    31.777    0.000    0.000
LGA    E   134_A      E   134_A    22.216     0    0.420   1.131    29.542    0.000    0.000
LGA    Y   135_A      Y   135_A    21.193     0    0.140   1.341    25.006    0.000    0.000
LGA    S   136_A      S   136_A    21.500     0    0.129   0.155    22.570    0.000    0.000
LGA    V   137_A      V   137_A    22.719     0    0.576   1.412    26.123    0.000    0.000
LGA    S   138_A      S   138_A    25.521     0    0.501   1.078    27.959    0.000    0.000
LGA    D   139_A      D   139_A    29.374     0    0.561   0.651    35.312    0.000    0.000
LGA    N   140_A      N   140_A    26.123     0    0.606   1.152    30.224    0.000    0.000
LGA    T   141_A      T   141_A    19.796     0    0.306   1.055    21.863    0.000    0.000
LGA    I   142_A      I   142_A    12.691     0    0.065   1.447    14.949    0.000    0.000
LGA    T   143_A      T   143_A     9.451     0    0.094   0.107    13.103   10.000    5.782
LGA    V   144_A      V   144_A     3.373     0    0.083   1.191     6.508   30.476   32.653
LGA    T   145_A      T   145_A     4.808     0    0.570   0.567     7.563   24.643   34.422
LGA    P   146_A      P   146_A    11.824     0    0.302   0.390    13.310    0.357    0.408
LGA    K   147_A      K   147_A    17.361     0    0.253   0.702    25.745    0.000    0.000
LGA    I   148_A      I   148_A    20.057     0    0.050   0.215    22.371    0.000    0.000
LGA    P   149_A      P   149_A    24.794     0    0.035   0.730    26.741    0.000    0.000
LGA    P   150_A      P   150_A    30.800     0    0.648   0.598    33.681    0.000    0.000
LGA    C   151_A      C   151_A    36.930     0    0.609   1.127    39.694    0.000    0.000
LGA    T   152_A      T   152_A    38.555     0    0.462   1.125    39.579    0.000    0.000
LGA    T   153_A      T   153_A    42.371     0    0.175   0.182    44.743    0.000    0.000
LGA    G   154_A      G   154_A    39.634     0    0.522   0.522    40.315    0.000    0.000
LGA    T   155_A      T   155_A    34.833     0    0.162   1.016    36.422    0.000    0.000
LGA    W   156_A      W   156_A    27.870     0    0.060   0.553    30.351    0.000    0.000
LGA    K   157_A      K   157_A    23.005     0    0.143   1.221    28.878    0.000    0.000
LGA    P   158_A      P   158_A    16.676     0    0.647   0.654    20.927    0.000    0.000
LGA    W   159_A      W   159_A    13.398     0    0.093   0.693    17.572    0.000    0.000
LGA    H   160_A      H   160_A    12.540     0    0.110   1.150    18.795    0.000    0.000
LGA    N   161_A      N   161_A    12.707     0    0.619   1.258    13.842    0.000    0.000
LGA    D   162_A      D   162_A    12.171     0    0.611   0.884    16.003    0.000    0.000
LGA    L   163_A      L   163_A     7.815     0    0.618   0.827     8.778    6.190   13.869
LGA    T   164_A      T   164_A     7.285     0    0.578   1.291    10.056    9.643    6.871
LGA    S   165_A      S   165_A     6.025     0    0.269   0.578     7.724   16.190   14.841
LGA    K   166_A      K   166_A     5.814     0    0.296   1.120     6.163   20.357   26.138
LGA    L   167_A      L   167_A     7.104     0    0.063   1.383     7.929   10.833   11.369
LGA    G   168_A      G   168_A     9.137     0    0.092   0.092     9.511    2.381    2.381
LGA    S   169_A      S   169_A     8.687     0    0.672   0.826    11.891    7.976    5.317
LGA    L   170_A      L   170_A     9.293     0    0.176   1.411    12.490    3.095    1.548
LGA    K   171_A      K   171_A     7.646     0    0.094   0.674    13.308   17.381    8.042
LGA    S   172_A      S   172_A     2.931     0    0.052   0.052     4.539   47.262   50.635
LGA    V   173_A      V   173_A     6.661     0    0.152   0.146     9.186   16.310   10.136
LGA    F   174_A      F   174_A     4.423     0    0.225   1.094     9.533   46.310   24.978
LGA    F   175_A      F   175_A     1.342     0    0.615   1.420     9.209   71.429   40.952
LGA    E   176_A      E   176_A     0.640     0    0.620   1.306     8.662   72.024   46.243
LGA    S   177_A      S   177_A     6.358     0    0.141   0.695     8.557   14.048   13.413
LGA    Y   178_A      Y   178_A    11.180     0    0.447   1.288    12.736    0.357    0.119
LGA    T   179_A      T   179_A    13.705     0    0.556   1.335    17.063    0.000    0.000
LGA    C   180_A      C   180_A     9.534     0    0.236   0.891    11.398    0.119    2.540
LGA    N   181_A      N   181_A    14.269     0    0.606   0.756    19.728    0.000    0.000
LGA    N   182_A      N   182_A    11.719     0    0.058   1.143    15.199    0.000    0.000
LGA    D   183_A      D   183_A    12.014     0    0.332   1.205    12.549    0.000    0.000
LGA    D   184_A      D   184_A     9.496     0    0.370   1.189    10.376    5.714    2.857
LGA    I   185_A      I   185_A     4.504     0    0.624   0.996     8.699   46.786   32.619
LGA    A   186_A      A   186_A     2.190     0    0.053   0.060     2.994   60.952   61.714
LGA    K   187_A      K   187_A     3.579     0    0.126   0.413     8.704   48.452   31.270
LGA    K   188_A      K   188_A     2.327     0    0.325   0.762     4.623   50.833   56.878
LGA    P   189_A      P   189_A     3.091     0    0.180   0.643     7.109   61.548   42.789
LGA    L   190_A      L   190_A     2.016     0    0.592   1.155     7.795   75.238   45.714
LGA    P   191_A      P   191_A     1.435     0    0.056   0.137     1.597   79.286   80.204
LGA    L   192_A      L   192_A     1.918     0    0.132   0.755     3.870   72.857   68.155
LGA    T   193_A      T   193_A     2.158     0    0.060   0.070     2.359   64.762   64.762
LGA    V   194_A      V   194_A     3.172     0    0.460   0.555     4.738   47.143   48.367
LGA    V   195_A      V   195_A     3.042     0    0.132   0.999     4.294   61.190   52.653
LGA    L   196_A      L   196_A     1.642     0    0.095   1.105     4.378   63.214   59.583
LGA    N   197_A      N   197_A     3.849     0    0.197   1.134     5.715   57.500   41.905
LGA    G   198_A      G   198_A     2.336     0    0.660   0.660     3.290   57.262   57.262

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      198     792    792  100.00    1543   1543  100.00               198
SUMMARY(RMSD_GDC):    12.328         12.284                 12.783           32.448   28.133

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  198  198    4.0     88    2.31    34.343    30.358     3.653

LGA_LOCAL      RMSD:   2.309  Number of atoms:   88  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  13.251  Number of assigned atoms:  198 
Std_ASGN_ATOMS RMSD:  12.328  Standard rmsd on all 198 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.323033 * X  +   0.165356 * Y  +  -0.931830 * Z  + -40.326115
  Y_new =  -0.851571 * X  +   0.378780 * Y  +   0.362426 * Z  + -17.816519
  Z_new =   0.412888 * X  +   0.910595 * Y  +   0.018454 * Z  +  -4.529049 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -1.933365 -0.425622  1.550534   [DEG: -110.7736  -24.3864   88.8390 ]
ZXZ: -1.941732  1.552342  0.425700   [DEG: -111.2530   88.9426   24.3908 ]
 
# END of job
