
#######################################################
#                                                     #
#                        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  243 ( 1952),  selected  222 , name one
# Molecule2: number of CA atoms  222 ( 1756),  selected  222 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:A  -ch2:A  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   102      94_A - 195_A       4.99    23.99
  LONGEST_CONTINUOUS_SEGMENT:   102      95_A - 196_A       4.83    24.03
  LONGEST_CONTINUOUS_SEGMENT:   102      96_A - 197_A       4.76    24.01
  LONGEST_CONTINUOUS_SEGMENT:   102      97_A - 198_A       4.86    23.96
  LCS_AVERAGE:     27.43

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    36     152_A - 187_A       1.98    24.40
  LCS_AVERAGE:      9.02

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    23     115_A - 137_A       0.95    23.75
  LONGEST_CONTINUOUS_SEGMENT:    23     116_A - 138_A       0.95    23.72
  LCS_AVERAGE:      4.08

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  222
LCS_GDT     RESIDUE       RESIDUE       SEGMENT_SIZE    GLOBAL DISTANCE TEST COLUMNS: number of residues under the threshold assigned to each residue pair
LCS_GDT   NAME NUMBER   NAME NUMBER    1.0  2.0  5.0    0.5  1.0  1.5  2.0  2.5  3.0  3.5  4.0  4.5  5.0  5.5  6.0  6.5  7.0  7.5  8.0  8.5  9.0  9.5 10.0
LCS_GDT     G    22_A     G    22_A      3    4   19      0    3    3    3    4    4    6    8    8   11   15   22   25   26   29   33   36   42   46   59 
LCS_GDT     S    23_A     S    23_A      3    4   19      1    3    3    4    5    7    8   11   13   14   17   21   24   26   32   40   43   55   57   69 
LCS_GDT     F    24_A     F    24_A      3    6   19      3    3    3    4    6    7    9   14   17   22   24   29   53   59   70   83  108  116  119  124 
LCS_GDT     Q    25_A     Q    25_A      4    8   19      3    4    4    6    7   10   13   16   19   22   24   29   53   59   68   79   99  105  119  122 
LCS_GDT     Y    26_A     Y    26_A      4    8   19      3    4    4    7    9    9   13   13   14   19   24   27   32   34   37   41   47   83   97  112 
LCS_GDT     M    27_A     M    27_A      4    8   29      3    4    4    7    9    9   13   13   17   22   24   29   32   34   68   89  101  113  120  123 
LCS_GDT     K    28_A     K    28_A      4    8   29      3    4    4    7    9   10   13   16   19   22   34   45   53   67   94  103  112  120  124  124 
LCS_GDT     D    29_A     D    29_A      4    8   29      3    4    4    7    8   10   13   16   19   22   34   45   53   78   96  108  113  119  124  124 
LCS_GDT     L    30_A     L    30_A      4    8   29      3    4    4    7    9   10   13   16   19   22   49   77   88   96  115  119  120  122  124  125 
LCS_GDT     N    31_A     N    31_A      4    8   29      3    4    4    7    9   11   26   52   74   88  102  109  114  116  117  120  121  122  124  125 
LCS_GDT     K    32_A     K    32_A      4    8   29      3    3    4    7    7   14   50   63   83   95  105  109  114  116  117  120  121  122  124  125 
LCS_GDT     H    33_A     H    33_A      4   19   29      3   11   34   53   66   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     I    34_A     I    34_A      6   19   29      7   27   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     P    35_A     P    35_A      6   19   29      3   10   32   55   70   77   83   92  100  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     F    36_A     F    36_A      6   19   29      3   10   43   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     Y    37_A     Y    37_A      6   19   29      7   19   43   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     H    38_A     H    38_A      6   19   29      5   19   43   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     I    39_A     I    39_A      6   19   29      7   19   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     E    40_A     E    40_A      6   19   29     11   28   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     D    41_A     D    41_A      4   19   29      3   11   21   38   56   74   84   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     S    42_A     S    42_A     11   19   29     17   34   46   58   69   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     K    43_A     K    43_A     11   19   29      4   31   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     F    44_A     F    44_A     11   19   29     17   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     K    45_A     K    45_A     11   19   29     17   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     H    46_A     H    46_A     11   19   29     17   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     Y    47_A     Y    47_A     11   19   29     17   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     G    48_A     G    48_A     11   19   29     17   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     K    49_A     K    49_A     11   19   29     11   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     V    50_A     V    50_A     11   19   29      9   27   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     I    51_A     I    51_A     11   19   29      8   25   43   57   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     N    52_A     N    52_A     11   19   29      7   21   34   50   65   76   85   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     E    53_A     E    53_A     10   17   29      3    6   16   24   49   64   78   86   98  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     Y    54_A     Y    54_A      6   17   29      3    7   17   33   50   64   77   88   98  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     D    55_A     D    55_A      7   17   29      3    7   17   35   53   72   80   89   94  102  108  111  114  116  117  120  121  122  124  125 
LCS_GDT     F    56_A     F    56_A     13   17   29      9   11   13   15   15   28   35   47   60   75   89   94  101  103  110  115  118  120  122  124 
LCS_GDT     N    57_A     N    57_A     13   17   29      9   11   13   15   15   17   20   26   39   54   65   79   96  101  105  108  111  119  121  124 
LCS_GDT     E    58_A     E    58_A     13   17   29      9   11   13   15   15   17   19   24   32   38   49   57   75   80   97  102  108  111  117  120 
LCS_GDT     L    59_A     L    59_A     13   17   29      9   11   13   15   15   17   19   20   21   24   31   38   44   50   58   66   72   96  101  105 
LCS_GDT     E    60_A     E    60_A     13   17   29      9   11   13   15   15   17   19   20   21   27   31   36   42   51   58   69   77   84   93  107 
LCS_GDT     T    61_A     T    61_A     13   17   29      9   11   13   15   15   17   19   20   21   23   27   33   37   42   46   59   65   74   81   96 
LCS_GDT     Y    62_A     Y    62_A     13   17   29      9   11   13   15   15   17   19   20   21   23   24   26   30   35   40   45   50   56   65   72 
LCS_GDT     M    63_A     M    63_A     13   17   29      9   11   13   15   15   17   19   20   21   23   24   26   28   35   40   43   48   55   61   66 
LCS_GDT     D    64_A     D    64_A     13   17   29      9   11   13   15   15   17   19   20   21   23   24   26   30   35   40   43   48   55   61   66 
LCS_GDT     S    65_A     S    65_A     13   17   29      7   11   13   15   15   17   19   20   21   23   24   26   27   31   36   41   46   53   60   64 
LCS_GDT     L    66_A     L    66_A     13   17   29      4   11   13   15   15   17   19   20   21   23   24   25   27   29   31   37   46   51   56   62 
LCS_GDT     T    67_A     T    67_A     13   17   29      3    9   13   15   15   17   19   20   21   23   24   25   27   29   31   36   41   46   52   56 
LCS_GDT     I    68_A     I    68_A     13   17   29      3    5   13   15   15   17   19   20   21   23   24   25   27   29   31   36   41   46   52   56 
LCS_GDT     P    69_A     P    69_A      5   16   29      4    5    6    9   11   13   16   19   21   23   24   25   27   29   31   36   41   44   52   56 
LCS_GDT     Q    70_A     Q    70_A      5   15   29      4    5    6    9   11   13   16   18   20   23   24   25   27   29   31   36   41   44   48   54 
LCS_GDT     D    71_A     D    71_A      5    9   29      4    5    6    9   11   13   14   16   17   19   21   24   26   29   30   31   32   37   44   54 
LCS_GDT     Q    72_A     Q    72_A      5    9   29      4    5    6    9   11   14   16   19   21   23   24   25   26   29   31   31   34   38   47   54 
LCS_GDT     N    73_A     N    73_A      4    9   29      3    3    5    8   14   16   19   20   21   23   24   25   27   29   31   31   34   38   41   47 
LCS_GDT     V    74_A     V    74_A      5    9   29      4    4    6    9   11   13   18   20   21   23   24   25   27   29   31   31   41   44   47   54 
LCS_GDT     Y    75_A     Y    75_A      5    9   29      4    4    5    6   11   13   14   16   18   20   22   24   27   29   31   36   41   44   48   54 
LCS_GDT     V    76_A     V    76_A      5    8   28      4    4    5    5    8    8   12   14   15   17   21   23   26   27   29   36   41   44   47   54 
LCS_GDT     A    77_A     A    77_A      5    8   27      4    4    5    5    8    8   12   14   15   17   20   21   26   26   28   33   41   44   47   56 
LCS_GDT     S    78_A     S    78_A      5    8   27      3    4    5    5    8    9   12   14   15   17   20   21   30   34   37   44   48   55   61   84 
LCS_GDT     V    79_A     V    79_A      4    8   27      3    4    6    7   11   13   14   16   17   17   20   21   25   29   30   37   46   60   63   75 
LCS_GDT     T    80_A     T    80_A      4    8   27      3    4    4    9   11   13   14   16   17   17   20   22   25   29   30   42   50   60   63   75 
LCS_GDT     E    81_A     E    81_A      3    5   27      3    3    4    9   10   12   14   16   17   17   20   23   25   29   31   32   38   60   63   75 
LCS_GDT     M    82_A     M    82_A      3    7   27      3    3    3    4    6    8   10   11   15   17   20   29   35   42   73   79   99  104  109  112 
LCS_GDT     E    83_A     E    83_A      3    7   27      3    3    3    4    7   10   14   16   17   17   20   28   35   40   44   50   67  105  109  109 
LCS_GDT     N    84_A     N    84_A      3    7   27      1    3    3    4    7    8    9   12   15   17   20   28   32   34   38   44   60   67   77   84 
LCS_GDT     T    85_A     T    85_A      4    7   27      3    4    4    5    7    8    9   11   15   16   20   21   31   34   43   50   60   67   77   84 
LCS_GDT     I    86_A     I    86_A      4    7   27      3    4    4    5    7    9   12   16   17   17   20   21   32   37   43   72   82   97  105  112 
LCS_GDT     I    87_A     I    87_A      4    7   27      3    4    4    7    7    9   10   14   17   19   26   47   55   60   72   89   97  103  111  114 
LCS_GDT     K    88_A     K    88_A      7    9   27      4    6    7    9    9   10   10   13   17   19   23   27   32   60   65   72   97  103  104  112 
LCS_GDT     N    89_A     N    89_A      7    9   27      5    6    7    9    9   10   10   13   14   16   38   47   55   60   81   89   97  103  109  113 
LCS_GDT     Q    90_A     Q    90_A      7    9   27      5    6    7    9    9   10   10   13   14   17   19   22   29   35   40   45   75   81  104  112 
LCS_GDT     L    91_A     L    91_A      7    9   19      5    6    7    9    9   10   10   13   14   15   19   21   26   30   38   69   75   91  104  112 
LCS_GDT     Q    92_A     Q    92_A      7    9   99      5    6    7    9    9   10   10   13   24   30   46   58   83   90   98  105  109  115  119  124 
LCS_GDT     E    93_A     E    93_A      7    9  100      5    6    7    9    9   10   10   15   24   30   39   58   67   79  101  105  109  115  119  124 
LCS_GDT     A    94_A     A    94_A      7    9  102      4    6    7    9    9   10   10   13   14   16   19   22   29   35   44   50   72  100  112  115 
LCS_GDT     F    95_A     F    95_A      4    9  102      3    4    5    9    9   10   10   13   14   16   19   22   24   31   44   50   72   78  112  115 
LCS_GDT     Y    96_A     Y    96_A      4    9  102      3    4    5    9    9   10   10   13   14   16   19   22   24   26   68   70   78  100  119  122 
LCS_GDT     G    97_A     G    97_A      4    6  102      3    4    4    4   17   23   33   45   74   90   94  103  108  110  111  113  117  119  122  125 
LCS_GDT     E    98_A     E    98_A      4    8  102      3    4    9   14   21   52   61   69   85   94  103  108  109  111  112  115  118  121  123  125 
LCS_GDT     M    99_A     M    99_A      3   28  102      3    9   27   49   63   76   85   96  101  107  109  111  113  116  117  120  121  122  124  125 
LCS_GDT     S   100_A     S   100_A      5   28  102      3    4    7   44   63   76   85   95  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     I   101_A     I   101_A      5   28  102      4   17   34   49   65   76   85   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     Q   102_A     Q   102_A      5   28  102      4   17   34   49   65   76   85   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     I   103_A     I   103_A      5   28  102      4   13   34   49   63   76   85   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     G   104_A     G   104_A      5   28  102      4   16   34   49   65   76   85   95  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     Y   105_A     Y   105_A      5   34  102      3    5   11   33   55   76   84   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     C   106_A     C   106_A      4   34  102      3    5   11   33   62   76   85   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     N   107_A     N   107_A      4   34  102      3    4   22   47   63   76   85   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     G   108_A     G   108_A      4   34  102      8   24   40   55   65   76   85   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     P   109_A     P   109_A      3   34  102      4   14   32   52   65   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     N   110_A     N   110_A     10   34  102      3    3    4   46   63   76   84   95  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     S   111_A     S   111_A     13   34  102      3   22   39   52   65   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     T   112_A     T   112_A     13   34  102      5   13   37   50   65   76   85   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     L   113_A     L   113_A     13   34  102      5   25   40   55   65   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     N   114_A     N   114_A     13   34  102      5   13   37   51   65   76   85   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     G   115_A     G   115_A     23   34  102      8   28   42   56   65   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     L   116_A     L   116_A     23   34  102     17   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     E   117_A     E   117_A     23   34  102     17   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     Y   118_A     Y   118_A     23   34  102     17   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     H   119_A     H   119_A     23   34  102     17   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     K   120_A     K   120_A     23   34  102     16   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     S   121_A     S   121_A     23   34  102     17   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     S   122_A     S   122_A     23   34  102     17   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     E   123_A     E   123_A     23   34  102     17   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     I   124_A     I   124_A     23   34  102     17   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     N   125_A     N   125_A     23   34  102      9   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     I   126_A     I   126_A     23   34  102     16   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     A   127_A     A   127_A     23   34  102      7   17   43   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     I   128_A     I   128_A     23   34  102      7   15   43   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     T   129_A     T   129_A     23   34  102      8   15   43   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     D   130_A     D   130_A     23   34  102     10   30   45   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     M   131_A     M   131_A     23   34  102     16   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     V   132_A     V   132_A     23   34  102     10   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     L   133_A     L   133_A     23   34  102     17   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     L   134_A     L   134_A     23   34  102      7   33   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     L   135_A     L   135_A     23   34  102      8   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     G   136_A     G   136_A     23   34  102     16   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     K   137_A     K   137_A     23   34  102      7   31   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     V   138_A     V   138_A     23   34  102      6   19   39   55   69   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     Q   139_A     Q   139_A      4   34  102      7   19   42   57   70   77   85   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     E   140_A     E   140_A      4   26  102      3    4    4    8   17   43   50   79   84   95  105  110  114  116  117  119  121  122  124  125 
LCS_GDT     V   141_A     V   141_A      4    8  102      3    4    4    5   16   34   42   63   78   86  104  111  114  116  117  120  121  122  124  125 
LCS_GDT     E   142_A     E   142_A      4   14  102      4    6    9   12   23   27   35   52   73   92  102  111  113  116  117  120  121  122  124  125 
LCS_GDT     N   143_A     N   143_A      4   19  102      3    3    7    9   17   29   44   60   91   97  107  111  113  116  117  120  121  122  124  125 
LCS_GDT     N   144_A     N   144_A      4   28  102      3   11   19   29   53   73   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     V   145_A     V   145_A     10   28  102      5   10   22   36   59   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     F   146_A     F   146_A     10   28  102      5   10   22   44   63   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     H   147_A     H   147_A     10   28  102      5   11   19   35   63   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     S   148_A     S   148_A     10   28  102      5   11   32   52   65   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     N   149_A     N   149_A     10   28  102      5   11   28   52   65   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     D   150_A     D   150_A     10   28  102      5   11   33   52   65   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     V   151_A     V   151_A     10   28  102      4   28   46   56   69   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     I   152_A     I   152_A     12   36  102     17   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     A   153_A     A   153_A     12   36  102     12   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     F   154_A     F   154_A     12   36  102      7   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     F   155_A     F   155_A     12   36  102      7   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     V   156_A     V   156_A     12   36  102      4   25   46   58   69   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     P   157_A     P   157_A     12   36  102      3   20   41   55   66   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     K   158_A     K   158_A     12   36  102      7   26   43   57   68   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     G   159_A     G   159_A     12   36  102      5   15   34   52   64   74   85   95  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     T   160_A     T   160_A     12   36  102      8   26   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     A   161_A     A   161_A     12   36  102     11   27   46   57   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     V   162_A     V   162_A     12   36  102     11   28   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     E   163_A     E   163_A     12   36  102     11   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     L   164_A     L   164_A     12   36  102     17   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     Y   165_A     Y   165_A     12   36  102     13   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     S   166_A     S   166_A     12   36  102      7   30   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     T   167_A     T   167_A     12   36  102      4   10   31   50   63   76   85   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     T   168_A     T   168_A     12   36  102      7   21   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     L   169_A     L   169_A     12   36  102     12   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     H   170_A     H   170_A     12   36  102     16   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     F   171_A     F   171_A     12   36  102      6   26   42   56   66   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     A   172_A     A   172_A      8   36  102      3   16   40   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     P   173_A     P   173_A      8   36  102      3   12   30   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     C   174_A     C   174_A      8   36  102      4   13   30   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     K   175_A     K   175_A      8   36  102      4   11   23   57   70   77   87   93  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     V   176_A     V   176_A      6   36  102      4   13   33   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     N   177_A     N   177_A      6   36  102      3   16   32   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     N   178_A     N   178_A      6   36  102      4   11   28   54   70   77   87   93   99  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     E   179_A     E   179_A      6   36  102      3   11   26   54   70   77   87   93   99  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     G   180_A     G   180_A      9   36  102      3   14   24   45   61   76   82   87   95  104  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     F   181_A     F   181_A      9   36  102      4   17   32   54   70   77   84   93  100  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     K   182_A     K   182_A      9   36  102      6   17   32   57   70   77   87   93  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     T   183_A     T   183_A      9   36  102      6   17   43   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     I   184_A     I   184_A      9   36  102      8   17   43   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     V   185_A     V   185_A      9   36  102      7   17   43   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     I   186_A     I   186_A      9   36  102      8   23   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     L   187_A     L   187_A      9   36  102      9   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     P   188_A     P   188_A      9   31  102      4   34   46   58   70   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     K   189_A     K   189_A      9   31  102      8   26   43   56   68   77   87   96  101  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     G   190_A     G   190_A      3   31  102      3   10   29   57   70   77   87   93  100  107  109  111  114  116  117  120  121  122  124  125 
LCS_GDT     T   191_A     T   191_A      3    6  102      3    3    4    5    5    8    9   12   21   66   94  100  109  115  117  120  121  122  124  125 
LCS_GDT     N   192_A     N   192_A      3    6  102      3    3    5    5    7   11   24   33   42   65   81   91  101  109  116  120  121  122  124  125 
LCS_GDT     D   193_A     D   193_A      3    6  102      3    3    4    5   23   28   31   63   82   87   94  102  108  113  116  120  121  122  124  125 
LCS_GDT     P   194_A     P   194_A      4    6  102      3    4    4    5    6   14   18   22   46   54   88   95  104  112  115  120  121  122  124  125 
LCS_GDT     L   195_A     L   195_A      4    6  102      3    4    4    5    9   10   11   12   19   34   44   78   86  107  111  115  117  119  123  125 
LCS_GDT     S   196_A     S   196_A      6    7  102      3    4    6    7    7    8   10   11   13   19   26   32   35   49   70   78   88   99  107  116 
LCS_GDT     T   197_A     T   197_A      6    7  102      3    5    6    6    6    8   10   11   13   18   24   32   35   41   46   58   75   89  105  111 
LCS_GDT     N   198_A     N   198_A      6    7  102      4    5    6    6    6    8   10   11   13   16   27   32   35   41   46   58   71   89  105  108 
LCS_GDT     I   199_A     I   199_A      6    7   16      4    5    6    6    6    8   10   11   14   19   28   37   43   53   65   74   82   91  101  108 
LCS_GDT     Q   200_A     Q   200_A      6    7   16      4    5    6    6    6    8    8   10   13   17   24   32   36   42   49   58   66   77   87   98 
LCS_GDT     K   201_A     K   201_A      6    7   16      4    5    6    8   10   15   17   23   29   35   42   52   64   72   80   87   97  104  110  115 
LCS_GDT     R   202_A     R   202_A      3    7   16      3    3    5    8   10   15   17   23   29   35   44   52   64   72   83   91   99  106  110  115 
LCS_GDT     T   203_A     T   203_A      3    5   16      3    3    4    7   10   15   17   23   29   32   43   50   61   72   83   91   99  106  110  115 
LCS_GDT     K   204_A     K   204_A      3    5   16      3    3    3    5    6    6   13   14   24   28   35   46   57   71   81   91   99  106  110  115 
LCS_GDT     E   205_A     E   205_A      3    5   16      3    4    4    5    6    7   10   15   20   25   30   36   43   55   63   74   88   95  102  111 
LCS_GDT     D   206_A     D   206_A      3    4   16      3    4    4    4    7    7    8   11   12   21   24   32   36   41   53   58   66   76   87   98 
LCS_GDT     E   207_A     E   207_A      3    6   16      3    4    4    7    8   12   15   17   21   27   32   37   43   53   61   71   81   90  100  108 
LCS_GDT     L   208_A     L   208_A      4    9   16      3    4    4    7    8   10   10   15   17   21   26   33   37   45   53   62   72   82   93  103 
LCS_GDT     L   209_A     L   209_A      4    9   16      3    4    4    4    8   10   10   11   12   14   17   21   24   28   39   44   49   56   66   74 
LCS_GDT     F   210_A     F   210_A      7    9   15      4    6    7    7    8   10   10   10   11   14   17   19   22   26   31   35   41   49   56   61 
LCS_GDT     M   211_A     M   211_A      7    9   15      4    6    7    7    8   10   10   10   11   12   12   14   15   26   31   35   37   40   43   47 
LCS_GDT     K   212_A     K   212_A      7    9   15      4    6    7    7    8   10   10   10   11   11   12   13   14   16   17   19   20   23   26   28 
LCS_GDT     N   213_A     N   213_A      7    9   15      3    6    7    7    8   10   10   10   11   11   12   13   13   14   17   19   20   23   26   28 
LCS_GDT     K   214_A     K   214_A      7    9   15      3    6    7    7    8   10   10   10   11   11   12   14   15   16   18   19   22   27   33   47 
LCS_GDT     W   215_A     W   215_A      7    9   15      4    6    7    7    8   10   10   10   11   12   12   14   15   18   19   25   25   27   33   37 
LCS_GDT     L   216_A     L   216_A      7    9   15      4    5    7    7    8   10   10   10   11   12   17   20   25   35   40   46   50   59   76   90 
LCS_GDT     I   217_A     I   217_A      6    7   15      4    5    6    6    7    7    9   12   15   18   24   32   35   41   47   58   65   76   87   98 
LCS_GDT     A   218_A     A   218_A      6    7   15      4    5    6    6    7    7    8   12   15   17   23   32   36   41   49   58   66   77   87   96 
LCS_GDT     H   219_A     H   219_A      6    7   14      4    5    6    6    7    9   11   12   15   18   23   29   35   41   47   55   64   71   84   91 
LCS_GDT     P   220_A     P   220_A      6    7   11      3    5    6    6    6    8   11   12   15   18   23   26   29   33   38   46   50   57   63   72 
LCS_GDT     E   221_A     E   221_A      6    7   11      3    4    6    6    6    9   11   12   15   18   23   26   29   33   38   46   50   56   63   71 
LCS_GDT     R   222_A     R   222_A      4    5   11      3    3    5    5    6    8   11   12   15   18   23   26   29   33   36   42   48   55   61   66 
LCS_GDT     E   223_A     E   223_A      4    5   11      3    3    4    5    5    6    7    9   14   16   20   26   29   33   35   38   44   51   56   63 
LCS_GDT     Q   224_A     Q   224_A      4    5   11      3    3    4    5    5    6    6    7   10   12   16   17   20   27   31   35   39   42   48   55 
LCS_GDT     L   225_A     L   225_A      3    5   10      3    3    3    3    5    6    6    8   10   10   11   14   15   19   22   29   34   36   45   50 
LCS_GDT     I   226_A     I   226_A      3    3   12      3    3    3    3    4    5    6    8   10   10   11   14   16   19   22   25   29   37   41   46 
LCS_GDT     N   227_A     N   227_A      3    5   13      3    3    3    4    6    7    8   10   10   11   13   18   19   21   24   27   32   37   41   46 
LCS_GDT     K   228_A     K   228_A      6    7   16      3    5    6    6    7    7    8   10   10   11   12   14   16   19   21   23   26   30   33   37 
LCS_GDT     G   229_A     G   229_A      6    7   16      5    5    6    6    7    7    8   10   10   11   12   14   18   23   25   25   30   35   38   41 
LCS_GDT     A   230_A     A   230_A      6    7   16      5    5    6    6    7    7    8   10   10   13   13   14   20   25   29   31   32   35   36   41 
LCS_GDT     H   231_A     H   231_A      6    7   16      5    5    6    6    8   12   12   12   12   13   17   21   24   25   29   31   32   33   36   41 
LCS_GDT     P   232_A     P   232_A      6   12   16      5    5    6    6   11   12   12   12   12   13   13   14   15   18   22   29   31   32   35   39 
LCS_GDT     G   233_A     G   233_A      9   12   16      5    6    7   10   11   12   12   12   12   13   13   13   15   17   18   19   20   22   23   26 
LCS_GDT     I   234_A     I   234_A     10   12   16      4    8   10   10   11   12   12   12   12   13   13   14   15   17   18   19   20   21   23   25 
LCS_GDT     K   235_A     K   235_A     10   12   16      4    8   10   10   11   12   12   12   12   13   13   14   15   17   18   19   20   21   23   25 
LCS_GDT     G   236_A     G   236_A     10   12   16      4    8   10   10   11   12   12   12   12   13   13   14   15   17   18   19   20   21   23   25 
LCS_GDT     E   237_A     E   237_A     10   12   16      3    8   10   10   11   12   12   12   12   13   13   14   15   15   15   18   20   20   23   25 
LCS_GDT     N   238_A     N   238_A     10   12   16      4    8   10   10   11   12   12   12   12   13   13   14   14   14   15   15   15   16   18   23 
LCS_GDT     I   239_A     I   239_A     10   12   16      4    8   10   10   11   12   12   12   12   13   13   14   14   14   15   15   17   20   22   25 
LCS_GDT     K   240_A     K   240_A     10   12   16      4    8   10   10   11   12   12   12   12   13   13   14   14   14   15   15   15   16   17   17 
LCS_GDT     V   241_A     V   241_A     10   12   16      4    8   10   10   11   12   12   12   12   13   13   14   14   14   15   15   15   16   17   17 
LCS_GDT     Y   242_A     Y   242_A     10   12   16      4    8   10   10   11   12   12   12   12   13   13   14   14   14   15   15   15   16   17   17 
LCS_GDT     Q   243_A     Q   243_A     10   12   16      4    8   10   10   11   12   12   12   12   13   13   14   14   14   15   15   15   16   17   17 
LCS_AVERAGE  LCS_A:  13.51  (   4.08    9.02   27.43 )

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     17     34     46     58     70     77     87     96    101    107    109    111    114    116    117    120    121    122    124    125 
GDT PERCENT_AT   7.66  15.32  20.72  26.13  31.53  34.68  39.19  43.24  45.50  48.20  49.10  50.00  51.35  52.25  52.70  54.05  54.50  54.95  55.86  56.31
GDT RMS_LOCAL    0.32   0.66   0.94   1.25   1.61   1.73   2.15   2.38   2.50   2.70   2.78   2.89   3.20   3.35   3.40   3.67   3.72   3.81   4.05   4.11
GDT RMS_ALL_AT  23.91  23.97  24.08  24.00  24.19  24.13  24.25  24.36  24.31  24.31  24.35  24.30  24.45  24.52  24.48  24.44  24.46  24.47  24.49  24.40

# Checking swapping
#   possible swapping detected:  F    24_A      F    24_A
#   possible swapping detected:  D    29_A      D    29_A
#   possible swapping detected:  F    36_A      F    36_A
#   possible swapping detected:  D    41_A      D    41_A
#   possible swapping detected:  Y    47_A      Y    47_A
#   possible swapping detected:  E    53_A      E    53_A
#   possible swapping detected:  Y    54_A      Y    54_A
#   possible swapping detected:  D    55_A      D    55_A
#   possible swapping detected:  Y    62_A      Y    62_A
#   possible swapping detected:  Y    75_A      Y    75_A
#   possible swapping detected:  E    81_A      E    81_A
#   possible swapping detected:  F    95_A      F    95_A
#   possible swapping detected:  E   123_A      E   123_A
#   possible swapping detected:  E   140_A      E   140_A
#   possible swapping detected:  F   146_A      F   146_A
#   possible swapping detected:  D   150_A      D   150_A
#   possible swapping detected:  F   155_A      F   155_A
#   possible swapping detected:  F   181_A      F   181_A
#   possible swapping detected:  E   223_A      E   223_A
#   possible swapping detected:  Y   242_A      Y   242_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    G    22_A      G    22_A    25.387     0    0.104   0.104    28.200    0.000    0.000
LGA    S    23_A      S    23_A    21.356     0    0.653   0.957    22.875    0.000    0.000
LGA    F    24_A      F    24_A    14.746     0    0.607   1.271    17.058    0.000    0.000
LGA    Q    25_A      Q    25_A    14.632     0    0.460   1.442    15.245    0.000    0.000
LGA    Y    26_A      Y    26_A    16.288     0    0.098   0.994    17.503    0.000    0.000
LGA    M    27_A      M    27_A    13.464     0    0.278   1.235    16.249    0.000    0.000
LGA    K    28_A      K    28_A    11.905     0    0.506   1.426    15.206    0.000    0.000
LGA    D    29_A      D    29_A    11.781     0    0.124   0.876    12.918    0.000    0.000
LGA    L    30_A      L    30_A    10.012     0    0.175   1.365    11.305    1.548    1.369
LGA    N    31_A      N    31_A     8.363     0    0.429   0.526     9.630    5.833    4.583
LGA    K    32_A      K    32_A     8.397     0    0.507   1.258    16.759   15.119    6.720
LGA    H    33_A      H    33_A     2.843     0    0.185   1.357     7.782   53.333   39.143
LGA    I    34_A      I    34_A     2.682     0    0.324   1.101     4.255   50.357   50.298
LGA    P    35_A      P    35_A     4.628     0    0.100   0.358     5.299   43.810   40.272
LGA    F    36_A      F    36_A     3.643     0    0.046   1.298     4.607   38.810   42.381
LGA    Y    37_A      Y    37_A     2.641     0    0.020   1.353     8.289   67.143   41.746
LGA    H    38_A      H    38_A     1.857     0    0.052   1.126     3.190   68.810   66.524
LGA    I    39_A      I    39_A     1.699     0    0.652   1.503     3.699   65.476   61.607
LGA    E    40_A      E    40_A     1.935     0    0.697   0.857     8.859   65.476   39.630
LGA    D    41_A      D    41_A     4.328     0    0.604   0.944     7.551   52.143   30.774
LGA    S    42_A      S    42_A     0.654     0    0.088   0.678     2.124   86.190   84.921
LGA    K    43_A      K    43_A     1.230     0    0.044   0.652     4.596   83.810   60.635
LGA    F    44_A      F    44_A     0.773     0    0.115   0.362     2.347   88.333   77.056
LGA    K    45_A      K    45_A     1.271     2    0.063   0.878     5.997   81.429   50.794
LGA    H    46_A      H    46_A     1.217     0    0.045   1.090     3.747   81.429   73.619
LGA    Y    47_A      Y    47_A     1.077     0    0.040   0.266     1.263   81.429   84.444
LGA    G    48_A      G    48_A     1.231     0    0.084   0.084     1.231   81.429   81.429
LGA    K    49_A      K    49_A     1.085     4    0.145   0.303     2.020   79.286   42.434
LGA    V    50_A      V    50_A     1.624     0    0.049   0.972     2.846   77.143   75.578
LGA    I    51_A      I    51_A     1.807     0    0.528   0.815     3.218   67.143   68.988
LGA    N    52_A      N    52_A     3.040     0    0.648   1.046     3.842   51.786   50.952
LGA    E    53_A      E    53_A     5.614     0    0.466   0.403     7.891   23.810   15.873
LGA    Y    54_A      Y    54_A     5.687     0    0.067   0.632     9.068   18.333   12.341
LGA    D    55_A      D    55_A     7.502     0    0.341   0.985    11.540    6.190    4.702
LGA    F    56_A      F    56_A    12.319     0    0.196   1.185    16.232    0.000    8.095
LGA    N    57_A      N    57_A    15.430     0    0.024   0.986    19.712    0.000    0.000
LGA    E    58_A      E    58_A    19.262     0    0.028   1.383    23.616    0.000    0.000
LGA    L    59_A      L    59_A    22.343     0    0.043   1.435    25.573    0.000    0.000
LGA    E    60_A      E    60_A    22.979     0    0.061   0.607    27.478    0.000    0.000
LGA    T    61_A      T    61_A    27.189     0    0.019   0.125    31.669    0.000    0.000
LGA    Y    62_A      Y    62_A    31.235     0    0.061   1.323    36.067    0.000    0.000
LGA    M    63_A      M    63_A    32.190     0    0.069   0.559    35.596    0.000    0.000
LGA    D    64_A      D    64_A    34.573     0    0.094   0.186    39.218    0.000    0.000
LGA    S    65_A      S    65_A    39.639     0    0.102   0.108    43.757    0.000    0.000
LGA    L    66_A      L    66_A    42.546     0    0.042   0.162    43.708    0.000    0.000
LGA    T    67_A      T    67_A    47.354     0    0.222   1.046    51.523    0.000    0.000
LGA    I    68_A      I    68_A    45.703     0    0.081   0.586    49.575    0.000    0.000
LGA    P    69_A      P    69_A    47.988     0    0.182   0.268    49.361    0.000    0.000
LGA    Q    70_A      Q    70_A    53.320     0    0.052   1.491    56.729    0.000    0.000
LGA    D    71_A      D    71_A    55.559     3    0.078   0.081    56.569    0.000    0.000
LGA    Q    72_A      Q    72_A    50.656     3    0.684   0.914    51.927    0.000    0.000
LGA    N    73_A      N    73_A    46.000     0    0.451   1.429    47.745    0.000    0.000
LGA    V    74_A      V    74_A    42.609     0    0.074   1.356    45.005    0.000    0.000
LGA    Y    75_A      Y    75_A    36.365     0    0.199   1.082    38.852    0.000    0.000
LGA    V    76_A      V    76_A    35.547     0    0.028   1.038    38.368    0.000    0.000
LGA    A    77_A      A    77_A    29.819     0    0.615   0.589    32.291    0.000    0.000
LGA    S    78_A      S    78_A    26.416     0    0.072   0.678    27.937    0.000    0.000
LGA    V    79_A      V    79_A    24.722     0    0.659   0.704    24.951    0.000    0.000
LGA    T    80_A      T    80_A    23.465     0    0.129   1.040    24.072    0.000    0.000
LGA    E    81_A      E    81_A    24.034     0    0.577   1.063    28.635    0.000    0.000
LGA    M    82_A      M    82_A    18.387     0    0.659   0.988    20.279    0.000    0.000
LGA    E    83_A      E    83_A    18.758     0    0.601   1.117    22.157    0.000    0.000
LGA    N    84_A      N    84_A    20.876     0    0.411   0.658    24.233    0.000    0.000
LGA    T    85_A      T    85_A    24.048     0    0.624   0.587    25.652    0.000    0.000
LGA    I    86_A      I    86_A    22.555     0    0.659   1.079    25.542    0.000    0.000
LGA    I    87_A      I    87_A    21.031     0    0.421   1.607    22.756    0.000    0.000
LGA    K    88_A      K    88_A    21.279     0    0.700   1.102    23.410    0.000    0.000
LGA    N    89_A      N    89_A    21.410     0    0.060   0.121    23.658    0.000    0.000
LGA    Q    90_A      Q    90_A    24.796     0    0.070   1.063    32.409    0.000    0.000
LGA    L    91_A      L    91_A    22.645     0    0.019   0.109    26.747    0.000    0.000
LGA    Q    92_A      Q    92_A    16.238     0    0.129   1.142    18.710    0.000    0.000
LGA    E    93_A      E    93_A    17.094     0    0.124   0.755    22.702    0.000    0.000
LGA    A    94_A      A    94_A    21.924     0    0.151   0.166    24.537    0.000    0.000
LGA    F    95_A      F    95_A    20.132     0    0.610   1.216    23.380    0.000    0.000
LGA    Y    96_A      Y    96_A    15.551     0    0.222   1.343    20.705    0.000    0.000
LGA    G    97_A      G    97_A    11.129     0    0.379   0.379    12.988    0.238    0.238
LGA    E    98_A      E    98_A     8.815     0    0.680   1.166    15.944   13.214    5.873
LGA    M    99_A      M    99_A     4.113     0    0.154   0.612     8.570   34.762   22.976
LGA    S   100_A      S   100_A     3.869     0    0.157   0.691     8.287   45.119   34.444
LGA    I   101_A      I   101_A     3.735     0    0.190   1.147     6.605   43.333   43.988
LGA    Q   102_A      Q   102_A     3.782     0    0.096   0.689     4.851   40.238   37.884
LGA    I   103_A      I   103_A     3.871     0    0.691   0.828     6.596   36.310   30.298
LGA    G   104_A      G   104_A     3.906     0    0.190   0.190     4.091   45.119   45.119
LGA    Y   105_A      Y   105_A     4.002     0    0.326   0.968     5.758   40.238   36.032
LGA    C   106_A      C   106_A     3.461     0    0.131   0.882     4.447   43.452   44.524
LGA    N   107_A      N   107_A     3.187     0    0.006   0.173     6.384   57.262   40.238
LGA    G   108_A      G   108_A     2.516     0    0.113   0.113     3.143   61.190   61.190
LGA    P   109_A      P   109_A     2.422     0    0.710   0.575     4.922   75.238   58.980
LGA    N   110_A      N   110_A     4.093     0    0.185   0.687     9.827   37.976   23.333
LGA    S   111_A      S   111_A     2.318     0    0.449   0.801     3.450   60.952   58.492
LGA    T   112_A      T   112_A     3.129     0    0.195   0.947     4.390   48.571   46.395
LGA    L   113_A      L   113_A     2.153     0    0.560   0.624     5.688   50.238   63.988
LGA    N   114_A      N   114_A     3.018     0    0.082   0.950     7.188   55.476   38.452
LGA    G   115_A      G   115_A     1.865     0    0.029   0.029     2.126   75.119   75.119
LGA    L   116_A      L   116_A     1.060     0    0.143   0.224     1.464   81.429   84.821
LGA    E   117_A      E   117_A     1.133     0    0.042   0.206     1.303   81.429   82.434
LGA    Y   118_A      Y   118_A     1.155     0    0.025   0.192     3.838   81.429   66.825
LGA    H   119_A      H   119_A     1.098     0    0.191   0.237     1.142   83.690   85.952
LGA    K   120_A      K   120_A     2.014     0    0.313   1.038     2.584   64.881   71.323
LGA    S   121_A      S   121_A     1.112     0    0.096   0.616     1.419   81.429   81.429
LGA    S   122_A      S   122_A     1.137     0    0.103   0.304     1.678   83.690   81.508
LGA    E   123_A      E   123_A     0.531     0    0.070   0.611     1.937   88.214   84.550
LGA    I   124_A      I   124_A     0.819     0    0.044   1.425     4.076   90.476   76.190
LGA    N   125_A      N   125_A     0.802     0    0.038   0.670     2.288   95.238   86.310
LGA    I   126_A      I   126_A     1.580     0    0.088   0.207     2.984   69.048   65.952
LGA    A   127_A      A   127_A     2.483     0    0.151   0.269     3.258   61.190   61.905
LGA    I   128_A      I   128_A     3.201     0    0.198   0.936     4.021   51.786   50.298
LGA    T   129_A      T   129_A     3.202     0    0.648   1.455     5.123   46.786   48.027
LGA    D   130_A      D   130_A     2.460     0    0.191   1.115     2.700   64.881   63.929
LGA    M   131_A      M   131_A     1.719     0    0.144   0.318     1.914   77.143   78.214
LGA    V   132_A      V   132_A     1.334     0    0.036   0.172     2.380   77.143   74.150
LGA    L   133_A      L   133_A     0.756     0    0.084   0.872     2.065   90.476   85.060
LGA    L   134_A      L   134_A     0.914     0    0.024   1.359     4.403   88.214   71.488
LGA    L   135_A      L   135_A     0.256     0    0.050   0.948     4.398  100.000   80.238
LGA    G   136_A      G   136_A     0.506     0    0.112   0.112     1.115   90.595   90.595
LGA    K   137_A      K   137_A     1.229     0    0.092   1.090     9.144   88.333   58.042
LGA    V   138_A      V   138_A     1.979     0    0.679   0.607     4.302   71.071   60.204
LGA    Q   139_A      Q   139_A     2.869     0    0.383   1.241     8.787   47.143   28.466
LGA    E   140_A      E   140_A     7.871     0    0.462   1.246    14.064    9.881    4.550
LGA    V   141_A      V   141_A     9.126     0    0.560   0.538    11.179    4.643    2.925
LGA    E   142_A      E   142_A     9.768     4    0.615   0.602    11.117    0.595    0.265
LGA    N   143_A      N   143_A     8.431     0    0.631   0.749    12.143    4.524    2.321
LGA    N   144_A      N   144_A     4.958     0    0.307   0.904     5.615   27.619   34.524
LGA    V   145_A      V   145_A     3.991     0    0.094   0.137     4.527   45.119   41.769
LGA    F   146_A      F   146_A     2.920     0    0.031   1.246     5.993   53.571   51.948
LGA    H   147_A      H   147_A     3.918     0    0.069   1.216     5.927   50.119   36.381
LGA    S   148_A      S   148_A     2.967     0    0.021   0.772     3.775   57.262   52.619
LGA    N   149_A      N   149_A     3.007     0    0.041   1.107     5.146   57.381   48.214
LGA    D   150_A      D   150_A     2.299     0    0.036   1.017     6.272   68.810   50.893
LGA    V   151_A      V   151_A     0.751     0    0.123   0.239     1.592   90.595   85.442
LGA    I   152_A      I   152_A     0.679     0    0.078   0.869     3.414   95.238   84.464
LGA    A   153_A      A   153_A     0.856     0    0.017   0.199     1.874   83.810   81.619
LGA    F   154_A      F   154_A     1.230     0    0.098   0.236     2.287   85.952   76.926
LGA    F   155_A      F   155_A     0.880     0    0.018   0.161     2.666   88.214   73.377
LGA    V   156_A      V   156_A     1.426     0    0.198   0.433     2.652   75.476   69.864
LGA    P   157_A      P   157_A     2.513     0    0.647   0.618     4.447   56.071   59.864
LGA    K   158_A      K   158_A     2.461     1    0.629   0.740     3.908   67.024   55.344
LGA    G   159_A      G   159_A     3.989     0    0.086   0.086     3.989   46.667   46.667
LGA    T   160_A      T   160_A     1.952     0    0.071   0.892     2.747   70.833   68.299
LGA    A   161_A      A   161_A     1.566     0    0.160   0.204     1.917   72.857   72.857
LGA    V   162_A      V   162_A     1.409     0    0.037   0.086     1.776   83.690   81.497
LGA    E   163_A      E   163_A     0.991     0    0.156   0.694     1.869   85.952   84.497
LGA    L   164_A      L   164_A     0.916     0    0.058   1.354     5.059   90.476   76.012
LGA    Y   165_A      Y   165_A     0.653     0    0.047   1.099     7.881   90.476   57.857
LGA    S   166_A      S   166_A     0.648     0    0.660   0.810     2.253   84.048   83.254
LGA    T   167_A      T   167_A     2.968     0    0.051   0.238     4.267   57.262   49.524
LGA    T   168_A      T   168_A     1.555     0    0.084   1.188     3.829   79.405   71.224
LGA    L   169_A      L   169_A     0.639     0    0.025   1.186     4.136   90.476   80.476
LGA    H   170_A      H   170_A     0.738     0    0.057   0.121     0.936   90.476   90.476
LGA    F   171_A      F   171_A     1.827     0    0.176   0.403     5.322   83.810   53.983
LGA    A   172_A      A   172_A     2.008     0    0.066   0.063     2.581   70.952   68.190
LGA    P   173_A      P   173_A     3.600     0    0.112   0.414     4.550   46.786   42.721
LGA    C   174_A      C   174_A     4.117     0    0.066   0.870     4.188   40.238   39.206
LGA    K   175_A      K   175_A     4.901     0    0.113   1.269    10.891   30.119   17.354
LGA    V   176_A      V   176_A     4.137     0    0.570   1.489     6.452   30.714   36.327
LGA    N   177_A      N   177_A     3.605     0    0.069   1.271     6.724   40.476   39.940
LGA    N   178_A      N   178_A     5.700     0    0.721   0.801    10.199   25.119   14.881
LGA    E   179_A      E   179_A     5.790     4    0.609   0.551     6.003   26.548   13.704
LGA    G   180_A      G   180_A     6.730     0    0.114   0.114     7.365   13.452   13.452
LGA    F   181_A      F   181_A     5.206     0    0.239   1.102     8.964   27.619   19.870
LGA    K   182_A      K   182_A     4.938     0    0.040   0.800     8.814   32.976   20.106
LGA    T   183_A      T   183_A     3.363     0    0.079   0.207     3.915   46.667   48.163
LGA    I   184_A      I   184_A     3.527     0    0.046   1.503     5.836   48.333   40.952
LGA    V   185_A      V   185_A     2.889     0    0.065   0.780     3.843   53.571   52.109
LGA    I   186_A      I   186_A     2.484     0    0.074   1.226     4.512   68.810   60.000
LGA    L   187_A      L   187_A     1.335     0    0.033   0.932     3.591   79.286   71.488
LGA    P   188_A      P   188_A     1.616     0    0.086   0.181     1.863   75.000   76.531
LGA    K   189_A      K   189_A     2.572     2    0.115   0.965     3.154   60.952   47.937
LGA    G   190_A      G   190_A     4.989     0    0.684   0.684     5.361   32.976   32.976
LGA    T   191_A      T   191_A     8.178     0    0.138   0.990    11.726    4.048    2.313
LGA    N   192_A      N   192_A    10.482     0    0.726   1.223    15.578    0.833    0.417
LGA    D   193_A      D   193_A     9.743     0    0.161   1.056    14.240    0.952    0.476
LGA    P   194_A      P   194_A     9.975     0    0.561   0.490    11.215    0.595    0.544
LGA    L   195_A      L   195_A     9.853     0    0.163   1.007    11.583    0.476    1.310
LGA    S   196_A      S   196_A    15.465     0    0.695   0.816    18.670    0.000    0.000
LGA    T   197_A      T   197_A    17.370     0    0.085   1.087    17.466    0.000    0.000
LGA    N   198_A      N   198_A    18.790     0    0.166   0.944    21.867    0.000    0.000
LGA    I   199_A      I   199_A    20.762     0    0.085   1.300    21.454    0.000    0.000
LGA    Q   200_A      Q   200_A    24.250     4    0.087   0.096    26.949    0.000    0.000
LGA    K   201_A      K   201_A    20.562     0    0.534   0.833    22.517    0.000    0.000
LGA    R   202_A      R   202_A    20.976     0    0.084   0.903    25.960    0.000    0.000
LGA    T   203_A      T   203_A    20.549     0    0.546   0.877    21.952    0.000    0.000
LGA    K   204_A      K   204_A    19.641     0    0.450   1.048    23.156    0.000    0.000
LGA    E   205_A      E   205_A    21.919     0    0.703   1.110    25.000    0.000    0.000
LGA    D   206_A      D   206_A    25.916     0    0.640   0.701    32.096    0.000    0.000
LGA    E   207_A      E   207_A    22.293     0    0.063   1.122    23.204    0.000    0.000
LGA    L   208_A      L   208_A    22.634     0    0.634   1.020    23.549    0.000    0.000
LGA    L   209_A      L   209_A    25.801     0    0.043   0.934    27.534    0.000    0.000
LGA    F   210_A      F   210_A    28.119     0    0.642   0.609    29.981    0.000    0.000
LGA    M   211_A      M   211_A    30.979     0    0.163   0.846    33.637    0.000    0.000
LGA    K   212_A      K   212_A    36.387     0    0.614   0.806    40.674    0.000    0.000
LGA    N   213_A      N   213_A    36.032     0    0.491   0.512    38.947    0.000    0.000
LGA    K   214_A      K   214_A    30.871     0    0.196   1.280    32.718    0.000    0.000
LGA    W   215_A      W   215_A    28.348     0    0.652   1.318    33.388    0.000    0.000
LGA    L   216_A      L   216_A    21.942     0    0.433   1.355    24.669    0.000    0.000
LGA    I   217_A      I   217_A    20.914     0    0.067   1.280    21.507    0.000    0.000
LGA    A   218_A      A   218_A    22.612     0    0.019   0.059    24.018    0.000    0.000
LGA    H   219_A      H   219_A    23.676     0    0.045   1.113    26.757    0.000    0.000
LGA    P   220_A      P   220_A    29.540     0    0.727   0.656    30.892    0.000    0.000
LGA    E   221_A      E   221_A    31.128     0    0.730   1.192    31.783    0.000    0.000
LGA    R   222_A      R   222_A    32.481     0    0.258   1.464    35.852    0.000    0.000
LGA    E   223_A      E   223_A    38.425     0    0.657   1.214    40.279    0.000    0.000
LGA    Q   224_A      Q   224_A    40.608     4    0.644   0.599    41.382    0.000    0.000
LGA    L   225_A      L   225_A    40.718     0    0.629   0.597    44.918    0.000    0.000
LGA    I   226_A      I   226_A    46.959     0    0.621   0.979    50.319    0.000    0.000
LGA    N   227_A      N   227_A    50.618     0    0.667   1.051    53.956    0.000    0.000
LGA    K   228_A      K   228_A    52.406     0    0.651   1.111    53.049    0.000    0.000
LGA    G   229_A      G   229_A    55.506     0    0.553   0.553    55.506    0.000    0.000
LGA    A   230_A      A   230_A    55.180     0    0.124   0.125    57.911    0.000    0.000
LGA    H   231_A      H   231_A    58.785     0    0.045   0.321    61.636    0.000    0.000
LGA    P   232_A      P   232_A    61.240     0    0.181   0.358    62.726    0.000    0.000
LGA    G   233_A      G   233_A    62.161     0    0.736   0.736    62.161    0.000    0.000
LGA    I   234_A      I   234_A    59.310     0    0.118   1.141    61.349    0.000    0.000
LGA    K   235_A      K   235_A    59.299     0    0.215   1.064    59.417    0.000    0.000
LGA    G   236_A      G   236_A    60.617     0    0.090   0.090    62.498    0.000    0.000
LGA    E   237_A      E   237_A    63.423     4    0.036   0.049    63.909    0.000    0.000
LGA    N   238_A      N   238_A    64.221     0    0.294   0.318    67.704    0.000    0.000
LGA    I   239_A      I   239_A    62.587     0    0.059   1.394    63.366    0.000    0.000
LGA    K   240_A      K   240_A    65.063     0    0.053   1.128    71.521    0.000    0.000
LGA    V   241_A      V   241_A    63.156     0    0.147   0.986    65.401    0.000    0.000
LGA    Y   242_A      Y   242_A    66.633     0    0.059   1.163    78.140    0.000    0.000
LGA    Q   243_A      Q   243_A    66.735     0    0.540   1.239    72.439    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      222     888    888  100.00    1756   1756  100.00               222
SUMMARY(RMSD_GDC):    19.391         19.382                 19.462           31.807   28.348

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  243  222    4.0     96    2.38    34.685    30.059     3.863

LGA_LOCAL      RMSD:   2.385  Number of atoms:   96  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  24.358  Number of assigned atoms:  222 
Std_ASGN_ATOMS RMSD:  19.391  Standard rmsd on all 222 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.260498 * X  +   0.660198 * Y  +  -0.704471 * Z  +  -3.267804
  Y_new =  -0.701129 * X  +   0.630988 * Y  +   0.332071 * Z  +  36.109650
  Z_new =   0.663746 * X  +   0.407422 * Y  +   0.627255 * Z  +  23.596243 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -1.215062 -0.725815  0.576045   [DEG:  -69.6179  -41.5862   33.0050 ]
ZXZ: -2.011284  0.892772  1.020275   [DEG: -115.2381   51.1521   58.4575 ]
 
# END of job
