
#######################################################
#                                                     #
#                        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:   169      24_A - 192_A       4.95    12.13
  LONGEST_CONTINUOUS_SEGMENT:   169      25_A - 193_A       4.90    12.15
  LONGEST_CONTINUOUS_SEGMENT:   169      26_A - 194_A       4.88    12.19
  LONGEST_CONTINUOUS_SEGMENT:   169      27_A - 195_A       4.95    12.23
  LCS_AVERAGE:     61.63

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    62     114_A - 175_A       1.99    12.77
  LCS_AVERAGE:     12.31

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    19     121_A - 139_A       0.98    13.03
  LCS_AVERAGE:      3.78

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     11   12   15      4    4   11   11   12   14   14   17   20   21   28   31   35   39   42   44   63   70   79   91 
LCS_GDT     S    23_A     S    23_A     11   12  168      4   10   11   11   12   14   14   17   20   22   28   31   36   40   57   68   74   85  102  119 
LCS_GDT     F    24_A     F    24_A     11   12  169      8   10   11   11   12   14   14   17   20   22   28   43   48   64   76   88   98  116  130  141 
LCS_GDT     Q    25_A     Q    25_A     11   12  169      8   10   11   11   12   14   14   17   20   30   36   47   57   66   83   94  110  133  139  152 
LCS_GDT     Y    26_A     Y    26_A     11   12  169      8   10   11   11   12   14   16   22   29   36   47   61   72   86   98  115  132  152  160  166 
LCS_GDT     M    27_A     M    27_A     11   12  169      8   10   11   11   14   26   34   43   58   75  100  116  131  152  158  167  173  174  175  178 
LCS_GDT     K    28_A     K    28_A     11   12  169      8   10   11   11   12   18   26   36   53   73  100  116  131  142  158  167  173  174  175  178 
LCS_GDT     D    29_A     D    29_A     11   12  169      8   10   11   18   25   31   42   58   75   93  116  131  145  155  162  167  173  174  175  178 
LCS_GDT     L    30_A     L    30_A     11   12  169      8   10   11   18   30   48   63   85  108  126  146  153  159  163  168  170  173  174  176  178 
LCS_GDT     N    31_A     N    31_A     11   12  169      8   19   35   56   71   95  116  132  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     K    32_A     K    32_A     11   12  169      6   10   27   50   70   87  109  127  140  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     H    33_A     H    33_A      4   12  169      9   29   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     I    34_A     I    34_A      4    6  169      3    4   29   71   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     P    35_A     P    35_A      3    6  169      9   29   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     F    36_A     F    36_A      4    6  169      3   11   20   40   70   96  122  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     Y    37_A     Y    37_A      4    6  169      3   13   38   69   92  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     H    38_A     H    38_A      4    7  169      4    4   11   29   45   86  108  131  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     I    39_A     I    39_A      4    7  169      4    4    7   14   27   49   80  106  133  146  155  160  163  166  168  170  173  174  176  178 
LCS_GDT     E    40_A     E    40_A      4    7  169      4    4    5   10   13   17   32   53  105  123  132  146  155  165  168  170  173  174  176  178 
LCS_GDT     D    41_A     D    41_A      4    7  169      4    4    6   15   21   31   81  102  125  145  155  160  163  166  168  170  173  174  176  178 
LCS_GDT     S    42_A     S    42_A      4   12  169      3   11   44   70   91  111  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     K    43_A     K    43_A      4   12  169      3   19   42   75   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     F    44_A     F    44_A      7   12  169      3    5   31   63   93  111  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     K    45_A     K    45_A      7   12  169      3   16   42   73   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     H    46_A     H    46_A      7   12  169      3   16   42   73   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     Y    47_A     Y    47_A      7   12  169      4   12   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     G    48_A     G    48_A      7   12  169     14   31   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     K    49_A     K    49_A      7   12  169     15   30   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     V    50_A     V    50_A      7   12  169     10   28   51   75   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     I    51_A     I    51_A      6   12  169      4   18   44   70   89  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     N    52_A     N    52_A      6   12  169      3   11   33   66   91  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     E    53_A     E    53_A      4   12  169      3    3    9   24   32   58  114  126  141  148  156  160  162  166  168  170  173  174  176  178 
LCS_GDT     Y    54_A     Y    54_A      4    9  169     15   29   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     D    55_A     D    55_A      4    6  169      4    4   10   29   35   56   90  128  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     F    56_A     F    56_A      4    4  169      4    4   10   16   18   46   67   87  101  122  147  158  162  166  168  170  173  174  176  178 
LCS_GDT     N    57_A     N    57_A      4    4  169      4    4    4    5    9   31   49  107  119  131  151  158  162  166  168  170  173  174  176  178 
LCS_GDT     E    58_A     E    58_A      4    4  169      4    7   19   42   77  102  121  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     L    59_A     L    59_A      3    4  169      4   28   44   72   92  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     E    60_A     E    60_A      3    5  169      0    6   27   64   91  110  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     T    61_A     T    61_A      4    5  169      4    9   28   58   88  109  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     Y    62_A     Y    62_A      4    5  169      4    4    4   21   33   53   67   96  121  138  148  154  163  166  168  170  173  174  176  178 
LCS_GDT     M    63_A     M    63_A      4    5  169      4    4    4    5   15   19   37   79   94  130  145  155  163  166  168  170  173  174  176  178 
LCS_GDT     D    64_A     D    64_A      4   13  169      4   29   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     S    65_A     S    65_A      4   13  169      3   13   45   73   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     L    66_A     L    66_A      4   18  169     12   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     T    67_A     T    67_A      4   18  169      8   19   45   71   91  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     I    68_A     I    68_A      4   18  169      3   16   48   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     P    69_A     P    69_A      5   18  169      3    4   36   75   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     Q    70_A     Q    70_A      5   18  169      9   29   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     D    71_A     D    71_A      5   18  169      3    9   31   66   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     Q    72_A     Q    72_A      5   18  169      9   31   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     N    73_A     N    73_A      5   18  169      9   31   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     V    74_A     V    74_A      5   18  169     11   31   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     Y    75_A     Y    75_A      5   18  169      3   28   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     V    76_A     V    76_A      5   18  169      7   12   46   71   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     A    77_A     A    77_A      4   18  169      3    9   19   52   79  108  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     S    78_A     S    78_A      6   18  169      5   28   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     V    79_A     V    79_A      6   18  169     12   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     T    80_A     T    80_A      6   18  169      3   25   52   73   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     E    81_A     E    81_A      6   18  169      3    7   21   43   81  105  120  131  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     M    82_A     M    82_A      6   18  169      4    8   15   28   45   85  116  129  142  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     E    83_A     E    83_A      6   18  169      4   10   24   67   92  111  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     N    84_A     N    84_A      4    9  169      4    4   31   69   92  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     T    85_A     T    85_A      4    9  169      4   10   25   40   65   92  119  131  142  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     I    86_A     I    86_A      3    6  169      0    3    3    6    7   50   62   93  121  138  148  157  162  164  168  170  173  174  176  178 
LCS_GDT     I    87_A     I    87_A      3    6  169      6   28   52   75   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     K    88_A     K    88_A      3    9  169      1    4    8   33   79  105  122  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     N    89_A     N    89_A      7    9  169      5    6    7    8    9   13   30   37   81  124  135  148  158  165  168  170  173  174  176  178 
LCS_GDT     Q    90_A     Q    90_A      7    9  169      5    9   16   57   81  106  122  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     L    91_A     L    91_A      7    9  169      5    6   18   40   70   95  111  125  141  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     Q    92_A     Q    92_A      7    9  169      5    6    7   32   51   73  110  123  140  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     E    93_A     E    93_A      7   17  169      5    6   23   58   88  108  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     A    94_A     A    94_A      7   18  169      4   24   51   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     F    95_A     F    95_A      7   18  169      4    5    9   26   57   98  117  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     Y    96_A     Y    96_A      6   18  169      4   18   47   75   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     G    97_A     G    97_A      6   18  169      3    7   23   37   52   98  110  127  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     E    98_A     E    98_A      6   18  169      4    9   18   46   75   98  119  132  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     M    99_A     M    99_A      6   18  169      4    5   13   33   69  102  119  132  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     S   100_A     S   100_A      6   18  169      4   13   43   73   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     I   101_A     I   101_A      7   37  169      9   25   52   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     Q   102_A     Q   102_A      8   37  169      9   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     I   103_A     I   103_A      8   37  169      9   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     G   104_A     G   104_A      8   37  169     11   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     Y   105_A     Y   105_A      8   37  169      5   29   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     C   106_A     C   106_A      8   37  169      9   29   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     N   107_A     N   107_A      8   37  169      4   29   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     G   108_A     G   108_A      8   37  169      4   29   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     P   109_A     P   109_A      8   37  169      4   26   51   75   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     N   110_A     N   110_A      3   37  169      3    8   27   50   83  108  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     S   111_A     S   111_A      4   37  169      3    4   32   51   70   95  115  131  142  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     T   112_A     T   112_A      4   37  169      3    6   20   51   80  102  121  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     L   113_A     L   113_A      4   37  169      3    7    9   17   47   70  103  118  140  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     N   114_A     N   114_A      4   62  169      4   10   38   72   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     G   115_A     G   115_A      4   62  169      3   16   38   71   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     L   116_A     L   116_A      4   62  169     10   24   53   75   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     E   117_A     E   117_A      3   62  169      6   24   48   72   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     Y   118_A     Y   118_A      3   62  169      4   28   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     H   119_A     H   119_A     15   62  169      3   20   52   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     K   120_A     K   120_A     18   62  169      9   29   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     S   121_A     S   121_A     19   62  169      4   25   52   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     S   122_A     S   122_A     19   62  169      9   31   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     E   123_A     E   123_A     19   62  169     15   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     I   124_A     I   124_A     19   62  169     15   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     N   125_A     N   125_A     19   62  169     15   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     I   126_A     I   126_A     19   62  169     15   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     A   127_A     A   127_A     19   62  169     15   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     I   128_A     I   128_A     19   62  169     10   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     T   129_A     T   129_A     19   62  169     11   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     D   130_A     D   130_A     19   62  169      8   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     M   131_A     M   131_A     19   62  169      5   22   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     V   132_A     V   132_A     19   62  169     11   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     L   133_A     L   133_A     19   62  169     11   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     L   134_A     L   134_A     19   62  169     10   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     L   135_A     L   135_A     19   62  169     10   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     G   136_A     G   136_A     19   62  169     11   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     K   137_A     K   137_A     19   62  169      9   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     V   138_A     V   138_A     19   62  169      8   31   50   74   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     Q   139_A     Q   139_A     19   62  169      7   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     E   140_A     E   140_A     18   62  169      9   25   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     V   141_A     V   141_A     11   62  169     10   21   42   69   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     E   142_A     E   142_A     11   62  169      3   10   42   67   92  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     N   143_A     N   143_A      4   62  169      3    3    4    6    6   17  102  126  140  148  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     N   144_A     N   144_A      4   62  169      3   24   52   75   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     V   145_A     V   145_A      4   62  169      3    7   12   39   80  104  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     F   146_A     F   146_A      4   62  169      3    7   10   25   70  102  122  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     H   147_A     H   147_A      4   62  169      3    7   10   23   74   98  122  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     S   148_A     S   148_A      8   62  169      9   29   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     N   149_A     N   149_A      8   62  169      5   29   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     D   150_A     D   150_A     17   62  169      3   11   41   71   91  110  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     V   151_A     V   151_A     17   62  169     10   29   52   75   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     I   152_A     I   152_A     17   62  169      5   29   52   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     A   153_A     A   153_A     17   62  169     12   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     F   154_A     F   154_A     17   62  169     12   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     F   155_A     F   155_A     17   62  169     10   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     V   156_A     V   156_A     17   62  169     10   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     P   157_A     P   157_A     17   62  169      8   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     K   158_A     K   158_A     17   62  169     15   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     G   159_A     G   159_A     17   62  169     15   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     T   160_A     T   160_A     17   62  169     15   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     A   161_A     A   161_A     17   62  169     15   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     V   162_A     V   162_A     17   62  169     10   28   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     E   163_A     E   163_A     17   62  169     15   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     L   164_A     L   164_A     17   62  169     12   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     Y   165_A     Y   165_A     17   62  169     12   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     S   166_A     S   166_A     17   62  169     11   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     T   167_A     T   167_A     14   62  169      5   20   47   75   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     T   168_A     T   168_A     14   62  169      5   23   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     L   169_A     L   169_A      7   62  169      6   29   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     H   170_A     H   170_A      7   62  169      6   24   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     F   171_A     F   171_A      7   62  169      5    8   28   54   85  107  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     A   172_A     A   172_A      6   62  169      3    7   30   59   90  111  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     P   173_A     P   173_A      5   62  169      3   24   52   74   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     C   174_A     C   174_A      5   62  169      3   23   52   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     K   175_A     K   175_A      5   62  169     10   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     V   176_A     V   176_A      4   30  169      3   13   26   50   77  101  116  133  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     N   177_A     N   177_A      4   30  169      3    5   11   40   55  103  122  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     N   178_A     N   178_A      4   29  169      3    4    4    9   18   42  107  131  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     E   179_A     E   179_A      3   29  169      3    5   27   66   92  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     G   180_A     G   180_A      9   11  169      8   29   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     F   181_A     F   181_A      9   11  169     15   29   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     K   182_A     K   182_A      9   11  169     15   29   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     T   183_A     T   183_A      9   11  169      8   29   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     I   184_A     I   184_A      9   11  169     15   31   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     V   185_A     V   185_A      9   11  169      9   31   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     I   186_A     I   186_A      9   11  169     11   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     L   187_A     L   187_A      9   11  169      6   32   53   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     P   188_A     P   188_A      9   11  169      6   12   42   69   89  108  122  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     K   189_A     K   189_A      3   10  169      3    4    4   16   26   42   66   89  102  119  132  144  152  158  165  168  172  173  176  178 
LCS_GDT     G   190_A     G   190_A      3    8  169      3    3    4    7   12   26   40   51   70   85  101  112  124  135  149  154  163  172  174  177 
LCS_GDT     T   191_A     T   191_A      6    8  169      3    5    6   10   16   21   28   29   33   58   65   85  101  122  129  142  155  161  168  174 
LCS_GDT     N   192_A     N   192_A      6    8  169      3    6    7   10   16   21   28   29   32   55   65   74   92  109  123  135  147  156  165  172 
LCS_GDT     D   193_A     D   193_A      6    8  169      4    5    6   10   14   21   28   29   32   55   65   72   78   92  105  123  133  143  155  160 
LCS_GDT     P   194_A     P   194_A      6    8  169      4    5    6    7   11   21   28   29   32   35   43   72   78   92  105  115  130  143  150  158 
LCS_GDT     L   195_A     L   195_A      6    8  169      4    5    6    7   11   21   28   29   32   35   43   72   78   92  105  115  130  143  149  158 
LCS_GDT     S   196_A     S   196_A      6    8  167      4    5    6    7    9   21   28   29   32   35   65   72   81   92  105  115  130  143  149  158 
LCS_GDT     T   197_A     T   197_A      6    8   29      3    5    6    7    9   11   28   29   32   55   65   72   81   95  108  120  130  143  150  158 
LCS_GDT     N   198_A     N   198_A      4    8   29      3    4    4    6    9   19   31   42   51   60   71   86   98  110  121  130  137  151  157  160 
LCS_GDT     I   199_A     I   199_A      3    5   29      3    3    7   17   30   41   53   63   77   97  110  124  132  145  154  159  165  172  174  177 
LCS_GDT     Q   200_A     Q   200_A      3    5   20      3    3   12   25   31   34   39   80  100  115  128  138  149  156  161  167  169  173  176  178 
LCS_GDT     K   201_A     K   201_A      3    5   20      3    3   12   25   33   34   55   73  100  114  122  136  149  156  161  167  170  173  176  178 
LCS_GDT     R   202_A     R   202_A      3    7   20      3    3    3    4    6    9   12   13   13   64   92  119  145  153  161  163  168  172  176  178 
LCS_GDT     T   203_A     T   203_A      7    7   20      4    6    8   10   12   24   55  109  131  143  152  157  163  166  168  170  173  174  176  178 
LCS_GDT     K   204_A     K   204_A      7    7   20      4    6    8   14   24   76   97  123  138  148  155  159  163  166  168  170  173  174  176  178 
LCS_GDT     E   205_A     E   205_A      7    7   20      4    6   11   26   63  102  120  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     D   206_A     D   206_A      7    7   20      4   28   42   67   92  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     E   207_A     E   207_A      7    7   20      5   21   43   70   91  112  122  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     L   208_A     L   208_A      7    7   18      3    6   11   45   80  104  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     L   209_A     L   209_A      7    7   20      3    3   30   66   88  105  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     F   210_A     F   210_A      4    7   21      6   28   52   77   93  112  123  134  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     M   211_A     M   211_A      4    7   21      3    3    9   24   34   57   84  113  131  144  155  160  163  166  168  170  172  174  176  178 
LCS_GDT     K   212_A     K   212_A      3    8   21      3    4    4    7   19   35   45   64  105  128  143  154  159  165  168  170  172  173  176  178 
LCS_GDT     N   213_A     N   213_A      6   12   21      4    5    8   16   24   41   72  110  128  142  152  160  163  166  168  170  173  174  176  178 
LCS_GDT     K   214_A     K   214_A      6   12   21      4    8   16   39   69   93  110  132  143  149  156  160  163  166  168  170  173  174  176  178 
LCS_GDT     W   215_A     W   215_A      6   12   21      4    5    7   10   14   24   33   57   83  109  134  145  153  158  166  170  173  174  176  178 
LCS_GDT     L   216_A     L   216_A      6   12   21      4    5    7   10   11   23   27   34   48   55   63   77   94  120  129  140  157  165  170  174 
LCS_GDT     I   217_A     I   217_A      6   12   21      4    5    7   10   11   13   23   26   31   40   44   53   66   69   79   97  111  123  135  144 
LCS_GDT     A   218_A     A   218_A      6   12   21      4    5    7   10   11   13   15   16   19   22   27   31   35   44   48   55   64   70   89   96 
LCS_GDT     H   219_A     H   219_A      6   12   21      4    5    7   10   11   13   15   16   18   19   21   22   25   30   35   39   50   55   59   64 
LCS_GDT     P   220_A     P   220_A      6   12   21      4    5    7   10   11   13   15   16   18   19   21   21   25   25   29   34   38   43   45   50 
LCS_GDT     E   221_A     E   221_A      6   15   21      4    5    7   10   14   14   15   16   18   19   21   22   27   35   39   41   44   48   51   54 
LCS_GDT     R   222_A     R   222_A     12   15   21      4   10   11   13   14   14   15   16   18   24   26   30   33   35   39   42   45   54   63   65 
LCS_GDT     E   223_A     E   223_A     12   15   21      4   10   12   13   14   14   15   16   17   19   21   25   30   38   41   44   51   67   74   80 
LCS_GDT     Q   224_A     Q   224_A     12   15   21      5   10   12   13   14   14   15   16   19   22   27   31   34   38   41   47   59   67   80   89 
LCS_GDT     L   225_A     L   225_A     12   15   21      5   10   12   13   14   14   15   16   18   19   27   31   34   45   57   62   65   74   89  102 
LCS_GDT     I   226_A     I   226_A     12   15   21      5   10   12   13   14   14   15   16   31   37   43   55   63   70   81   97  106  115  124  142 
LCS_GDT     N   227_A     N   227_A     12   15   21      5   10   12   13   14   14   23   26   34   42   50   59   66   75   87  106  114  127  140  154 
LCS_GDT     K   228_A     K   228_A     12   15   21      5   10   12   13   14   14   15   26   31   43   54   59   76   92  110  128  138  151  161  168 
LCS_GDT     G   229_A     G   229_A     12   15   21      5   10   12   13   14   21   33   40   49   59   71   88  104  120  140  146  157  165  170  174 
LCS_GDT     A   230_A     A   230_A     12   15   21      5   10   12   13   14   14   15   16   22   29   35   55   57   78   86   97  120  133  147  155 
LCS_GDT     H   231_A     H   231_A     12   15   21      5   10   12   13   14   14   15   23   31   38   45   55   66   79   87  104  120  133  147  155 
LCS_GDT     P   232_A     P   232_A     12   15   21      4    8   12   13   14   14   15   15   19   27   32   38   53   55   66   71   85   90  105  115 
LCS_GDT     G   233_A     G   233_A     12   15   21      3   10   12   13   14   14   15   16   18   20   27   38   44   49   57   62   77   84   91  105 
LCS_GDT     I   234_A     I   234_A      3   15   21      3    5    7   11   14   14   15   16   17   19   24   27   31   35   42   47   55   59   63   66 
LCS_GDT     K   235_A     K   235_A      3   15   21      4   10   12   13   14   14   15   16   17   19   24   27   31   35   40   44   50   55   59   64 
LCS_GDT     G   236_A     G   236_A      4   15   21      3    4    5    7   12   12   13   14   16   19   24   27   31   35   37   39   50   55   59   64 
LCS_GDT     E   237_A     E   237_A      4    8   21      3    3    5    7    7    8   11   13   16   19   24   27   31   35   37   39   50   55   59   64 
LCS_GDT     N   238_A     N   238_A      6    8   21      4    5    6    7    7    8   11   13   16   19   24   27   31   35   37   39   50   55   59   64 
LCS_GDT     I   239_A     I   239_A      6    8   15      4    5    6    6    7    8    9   11   12   19   24   27   31   35   37   44   50   55   59   64 
LCS_GDT     K   240_A     K   240_A      6    8   13      4    5    6    7    7    8    9   11   11   14   20   26   30   35   37   39   42   45   48   64 
LCS_GDT     V   241_A     V   241_A      6    8   12      4    5    6    7    7    8    9    9   10   13   14   16   17   27   29   32   38   43   48   50 
LCS_GDT     Y   242_A     Y   242_A      6    8   12      3    5    6    7    7    8    9    9   10   13   14   16   17   21   26   32   38   43   45   48 
LCS_GDT     Q   243_A     Q   243_A      6    8   12      3    5    6    7    7    8    9    9   10   10   14   14   15   21   26   32   38   41   45   48 
LCS_AVERAGE  LCS_A:  25.91  (   3.78   12.31   61.63 )

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     15     32     53     77     93    112    123    134    143    149    156    160    163    166    168    170    173    174    176    178 
GDT PERCENT_AT   6.76  14.41  23.87  34.68  41.89  50.45  55.41  60.36  64.41  67.12  70.27  72.07  73.42  74.77  75.68  76.58  77.93  78.38  79.28  80.18
GDT RMS_LOCAL    0.31   0.68   1.04   1.33   1.57   1.88   2.07   2.30   2.54   2.66   2.86   3.01   3.14   3.24   3.33   3.43   3.84   3.87   3.90   4.11
GDT RMS_ALL_AT  12.54  12.74  12.76  12.72  12.89  12.68  12.81  12.75  12.88  12.79  12.76  12.82  12.79  12.80  12.80  12.82  12.52  12.55  12.64  12.53

# Checking swapping
#   possible swapping detected:  Y    26_A      Y    26_A
#   possible swapping detected:  D    29_A      D    29_A
#   possible swapping detected:  Y    37_A      Y    37_A
#   possible swapping detected:  D    41_A      D    41_A
#   possible swapping detected:  F    44_A      F    44_A
#   possible swapping detected:  Y    54_A      Y    54_A
#   possible swapping detected:  D    55_A      D    55_A
#   possible swapping detected:  E    58_A      E    58_A
#   possible swapping detected:  E    60_A      E    60_A
#   possible swapping detected:  Y    62_A      Y    62_A
#   possible swapping detected:  D    64_A      D    64_A
#   possible swapping detected:  E    98_A      E    98_A
#   possible swapping detected:  E   117_A      E   117_A
#   possible swapping detected:  E   123_A      E   123_A
#   possible swapping detected:  E   140_A      E   140_A
#   possible swapping detected:  E   163_A      E   163_A
#   possible swapping detected:  E   207_A      E   207_A
#   possible swapping detected:  E   223_A      E   223_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    G    22_A      G    22_A    30.107     0    0.651   0.651    30.296    0.000    0.000
LGA    S    23_A      S    23_A    24.325     0    0.134   0.231    26.660    0.000    0.000
LGA    F    24_A      F    24_A    22.203     0    0.109   1.136    27.285    0.000    0.000
LGA    Q    25_A      Q    25_A    22.563     0    0.041   0.137    25.043    0.000    0.000
LGA    Y    26_A      Y    26_A    19.554     0    0.041   0.164    21.048    0.000    0.000
LGA    M    27_A      M    27_A    13.508     0    0.050   0.692    16.070    0.000    0.000
LGA    K    28_A      K    28_A    13.973     0    0.028   0.814    24.755    0.000    0.000
LGA    D    29_A      D    29_A    13.492     0    0.063   1.111    19.514    0.000    0.000
LGA    L    30_A      L    30_A     9.575     0    0.227   1.332    13.567    8.810    4.405
LGA    N    31_A      N    31_A     4.958     0    0.391   0.525     6.672   25.595   25.536
LGA    K    32_A      K    32_A     5.863     0    0.025   0.480    13.053   26.429   13.228
LGA    H    33_A      H    33_A     2.273     0    0.648   1.274     5.891   54.167   48.095
LGA    I    34_A      I    34_A     2.701     0    0.083   0.317     9.188   69.286   41.429
LGA    P    35_A      P    35_A     1.465     0    0.132   0.376     4.736   69.286   57.415
LGA    F    36_A      F    36_A     4.669     0    0.088   1.087    14.659   40.476   15.671
LGA    Y    37_A      Y    37_A     2.694     0    0.094   1.230     8.050   38.690   35.040
LGA    H    38_A      H    38_A     5.485     0    0.621   1.085     9.543   31.548   16.524
LGA    I    39_A      I    39_A     6.013     0    0.113   1.204     8.517   15.119   11.726
LGA    E    40_A      E    40_A     9.208     0    0.235   0.765    15.837    3.214    1.429
LGA    D    41_A      D    41_A     7.291     0    0.601   0.735     7.581   11.905   10.952
LGA    S    42_A      S    42_A     2.939     0    0.355   0.641     4.269   60.000   61.667
LGA    K    43_A      K    43_A     2.367     0    0.066   0.849     4.058   63.095   54.550
LGA    F    44_A      F    44_A     3.263     0    0.600   0.800     7.896   47.738   29.697
LGA    K    45_A      K    45_A     2.919     2    0.092   0.692     4.244   53.571   37.619
LGA    H    46_A      H    46_A     2.980     0    0.088   1.045     5.637   60.952   42.476
LGA    Y    47_A      Y    47_A     1.750     0    0.031   0.355     5.208   77.143   54.087
LGA    G    48_A      G    48_A     1.007     0    0.149   0.149     1.570   81.548   81.548
LGA    K    49_A      K    49_A     1.341     4    0.026   0.044     1.624   77.143   43.333
LGA    V    50_A      V    50_A     2.182     0    0.168   0.185     3.946   59.524   57.483
LGA    I    51_A      I    51_A     3.007     0    0.209   1.041     5.252   59.167   51.667
LGA    N    52_A      N    52_A     3.100     0    0.683   1.220     4.297   48.333   46.726
LGA    E    53_A      E    53_A     5.355     0    0.534   0.993    12.955   34.524   15.873
LGA    Y    54_A      Y    54_A     1.494     0    0.042   1.241     9.926   65.833   32.540
LGA    D    55_A      D    55_A     5.741     0    0.183   1.090    11.803   24.762   13.869
LGA    F    56_A      F    56_A     7.277     0    0.024   0.172    12.918   10.119    3.723
LGA    N    57_A      N    57_A     7.479     0    0.658   0.812    12.346   12.619    6.667
LGA    E    58_A      E    58_A     4.223     0    0.633   0.675     4.976   35.833   56.825
LGA    L    59_A      L    59_A     2.358     0    0.640   1.448     7.209   53.214   40.417
LGA    E    60_A      E    60_A     3.115     0    0.605   1.141     9.699   61.190   32.593
LGA    T    61_A      T    61_A     3.530     0    0.557   1.399     5.230   45.714   40.544
LGA    Y    62_A      Y    62_A     8.182     0    0.220   1.245    18.432    7.500    2.500
LGA    M    63_A      M    63_A     7.634     0    0.156   0.140    14.590   13.929    7.024
LGA    D    64_A      D    64_A     1.744     0    0.651   1.326     6.103   71.905   52.798
LGA    S    65_A      S    65_A     2.390     0    0.592   0.788     6.400   79.524   61.111
LGA    L    66_A      L    66_A     0.937     0    0.073   0.105     2.371   77.381   77.381
LGA    T    67_A      T    67_A     3.357     0    0.139   0.183     5.328   59.167   46.531
LGA    I    68_A      I    68_A     2.397     0    0.119   0.996     2.899   64.881   61.964
LGA    P    69_A      P    69_A     2.298     0    0.279   0.324     3.331   66.786   60.612
LGA    Q    70_A      Q    70_A     1.268     0    0.033   1.027     5.780   72.976   56.825
LGA    D    71_A      D    71_A     2.877     3    0.234   0.262     3.986   59.167   35.000
LGA    Q    72_A      Q    72_A     0.705     3    0.170   0.605     1.895   92.857   59.418
LGA    N    73_A      N    73_A     1.064     0    0.054   1.204     4.130   85.952   77.083
LGA    V    74_A      V    74_A     0.831     0    0.088   1.052     3.132   92.857   84.762
LGA    Y    75_A      Y    75_A     1.749     0    0.577   1.236     9.070   62.143   40.397
LGA    V    76_A      V    76_A     3.138     0    0.497   1.302     7.316   57.738   39.932
LGA    A    77_A      A    77_A     3.746     0    0.560   0.508     6.303   48.810   42.476
LGA    S    78_A      S    78_A     1.587     0    0.024   0.159     2.290   79.405   75.873
LGA    V    79_A      V    79_A     0.851     0    0.100   0.961     3.000   77.738   73.673
LGA    T    80_A      T    80_A     3.069     0    0.060   1.057     6.073   47.381   41.905
LGA    E    81_A      E    81_A     4.433     0    0.041   1.160     6.358   34.524   30.265
LGA    M    82_A      M    82_A     4.908     0    0.438   0.748     8.716   34.286   22.679
LGA    E    83_A      E    83_A     3.449     0    0.063   0.952     4.468   46.667   47.090
LGA    N    84_A      N    84_A     2.921     0    0.388   0.923     3.290   55.357   63.393
LGA    T    85_A      T    85_A     4.985     0    0.694   0.606     7.311   23.571   22.721
LGA    I    86_A      I    86_A     7.058     0    0.593   0.731    11.892   18.690    9.524
LGA    I    87_A      I    87_A     2.513     0    0.642   1.702     5.957   55.595   47.917
LGA    K    88_A      K    88_A     3.826     0    0.559   0.967     6.107   42.262   33.492
LGA    N    89_A      N    89_A     8.283     0    0.603   1.039    14.645   12.262    6.131
LGA    Q    90_A      Q    90_A     4.124     0    0.050   1.395     7.048   36.429   30.741
LGA    L    91_A      L    91_A     5.580     0    0.032   0.071     9.694   27.738   16.964
LGA    Q    92_A      Q    92_A     5.412     0    0.072   1.096    13.103   33.690   16.614
LGA    E    93_A      E    93_A     3.183     0    0.094   1.008     3.982   53.810   52.540
LGA    A    94_A      A    94_A     2.290     0    0.154   0.157     3.176   57.381   55.905
LGA    F    95_A      F    95_A     4.549     0    0.076   1.534     7.406   37.381   27.749
LGA    Y    96_A      Y    96_A     2.553     0    0.624   1.065     7.861   57.262   42.183
LGA    G    97_A      G    97_A     5.938     0    0.594   0.594     5.938   26.310   26.310
LGA    E    98_A      E    98_A     5.382     0    0.025   0.312     8.630   26.548   16.825
LGA    M    99_A      M    99_A     4.907     0    0.133   0.369     8.345   36.071   24.464
LGA    S   100_A      S   100_A     3.038     0    0.097   0.615     5.398   57.738   50.079
LGA    I   101_A      I   101_A     1.380     0    0.128   0.148     3.938   79.405   66.607
LGA    Q   102_A      Q   102_A     1.402     0    0.332   0.941     2.531   88.333   80.899
LGA    I   103_A      I   103_A     0.751     0    0.185   0.212     3.083   90.476   77.798
LGA    G   104_A      G   104_A     1.062     0    0.237   0.237     1.062   90.595   90.595
LGA    Y   105_A      Y   105_A     1.757     0    0.093   1.231     8.101   75.000   48.413
LGA    C   106_A      C   106_A     1.732     0    0.031   0.812     3.703   70.833   66.587
LGA    N   107_A      N   107_A     1.956     0    0.109   0.284     3.023   79.405   68.333
LGA    G   108_A      G   108_A     1.236     0    0.208   0.208     1.821   77.143   77.143
LGA    P   109_A      P   109_A     2.299     0    0.626   0.718     3.618   59.524   59.660
LGA    N   110_A      N   110_A     3.609     0    0.420   1.014    10.112   50.119   27.976
LGA    S   111_A      S   111_A     4.763     0    0.651   0.854     7.693   34.762   26.032
LGA    T   112_A      T   112_A     3.912     0    0.126   0.896     4.421   40.238   44.694
LGA    L   113_A      L   113_A     5.724     0    0.613   1.359    11.837   42.619   21.964
LGA    N   114_A      N   114_A     2.628     0    0.571   1.299     6.839   44.167   36.310
LGA    G   115_A      G   115_A     2.918     0    0.186   0.186     3.041   61.190   61.190
LGA    L   116_A      L   116_A     2.095     0    0.104   0.157     8.792   61.429   38.393
LGA    E   117_A      E   117_A     2.696     0    0.018   1.021    10.006   67.024   35.767
LGA    Y   118_A      Y   118_A     1.813     0    0.679   1.268    12.754   67.262   30.833
LGA    H   119_A      H   119_A     1.911     0    0.472   1.443     7.028   65.595   44.143
LGA    K   120_A      K   120_A     1.230     0    0.125   0.217     3.903   81.429   71.693
LGA    S   121_A      S   121_A     1.746     0    0.041   0.601     2.482   79.286   74.444
LGA    S   122_A      S   122_A     1.169     0    0.135   0.213     1.616   79.286   78.571
LGA    E   123_A      E   123_A     0.547     0    0.038   0.808     1.971   95.238   85.714
LGA    I   124_A      I   124_A     0.533     0    0.034   1.184     2.782   92.857   81.131
LGA    N   125_A      N   125_A     0.455     0    0.027   0.698     2.077  100.000   90.893
LGA    I   126_A      I   126_A     0.571     0    0.079   0.397     1.629   90.595   88.333
LGA    A   127_A      A   127_A     0.952     0    0.068   0.078     1.042   88.214   88.667
LGA    I   128_A      I   128_A     0.847     0    0.071   0.136     1.695   90.476   83.810
LGA    T   129_A      T   129_A     0.803     0    0.090   0.234     1.097   88.214   87.891
LGA    D   130_A      D   130_A     1.627     0    0.073   0.097     1.946   72.857   72.857
LGA    M   131_A      M   131_A     1.683     0    0.192   0.636     2.865   75.000   71.071
LGA    V   132_A      V   132_A     0.622     0    0.092   0.325     1.331   88.214   89.252
LGA    L   133_A      L   133_A     0.778     0    0.055   0.054     0.953   90.476   90.476
LGA    L   134_A      L   134_A     1.524     0    0.022   1.355     4.905   75.000   62.202
LGA    L   135_A      L   135_A     1.572     0    0.195   0.351     2.640   68.929   74.107
LGA    G   136_A      G   136_A     1.152     0    0.250   0.250     1.484   81.429   81.429
LGA    K   137_A      K   137_A     1.948     0    0.061   1.144     5.865   68.810   55.661
LGA    V   138_A      V   138_A     2.761     0    0.454   0.948     5.015   49.524   48.231
LGA    Q   139_A      Q   139_A     2.139     0    0.173   1.159     5.898   73.095   50.000
LGA    E   140_A      E   140_A     1.376     0    0.337   0.650     3.980   75.476   64.762
LGA    V   141_A      V   141_A     2.925     0    0.666   1.318     5.186   55.595   47.007
LGA    E   142_A      E   142_A     2.985     4    0.609   0.550     3.959   60.952   31.905
LGA    N   143_A      N   143_A     4.727     0    0.313   0.661     9.639   35.000   20.000
LGA    N   144_A      N   144_A     2.014     0    0.210   0.226     2.711   59.048   65.060
LGA    V   145_A      V   145_A     3.864     0    0.025   0.050     5.607   45.000   37.755
LGA    F   146_A      F   146_A     4.113     0    0.278   1.296     8.884   35.714   23.766
LGA    H   147_A      H   147_A     4.094     0    0.030   1.040     8.512   50.952   26.619
LGA    S   148_A      S   148_A     1.479     0    0.632   0.611     5.397   81.548   64.921
LGA    N   149_A      N   149_A     1.505     0    0.248   1.296     5.323   67.262   59.405
LGA    D   150_A      D   150_A     3.094     0    0.378   0.351     5.853   59.167   43.452
LGA    V   151_A      V   151_A     2.603     0    0.104   0.363     3.175   60.952   58.299
LGA    I   152_A      I   152_A     1.942     0    0.148   0.646     2.619   75.119   71.012
LGA    A   153_A      A   153_A     1.179     0    0.052   0.047     1.377   81.429   81.429
LGA    F   154_A      F   154_A     0.647     0    0.064   1.268     7.449   90.476   57.706
LGA    F   155_A      F   155_A     0.985     0    0.028   1.347     6.735   85.952   59.091
LGA    V   156_A      V   156_A     1.203     0    0.041   0.042     1.431   81.429   81.429
LGA    P   157_A      P   157_A     1.643     0    0.121   0.334     1.968   79.286   77.755
LGA    K   158_A      K   158_A     0.848     1    0.081   0.113     0.978   90.476   80.423
LGA    G   159_A      G   159_A     0.653     0    0.092   0.092     0.794   90.476   90.476
LGA    T   160_A      T   160_A     0.631     0    0.019   0.167     0.954   92.857   91.837
LGA    A   161_A      A   161_A     0.587     0    0.031   0.035     1.134   88.214   88.667
LGA    V   162_A      V   162_A     1.367     0    0.087   1.063     3.406   81.429   74.490
LGA    E   163_A      E   163_A     0.918     0    0.014   0.123     1.995   88.214   81.587
LGA    L   164_A      L   164_A     0.348     0    0.017   0.125     0.546   97.619   98.810
LGA    Y   165_A      Y   165_A     0.572     0    0.114   0.239     1.384   90.595   87.500
LGA    S   166_A      S   166_A     1.148     0    0.569   0.769     2.863   79.881   80.476
LGA    T   167_A      T   167_A     2.328     0    0.159   1.000     5.325   64.881   53.265
LGA    T   168_A      T   168_A     1.420     0    0.111   0.181     2.056   81.429   76.599
LGA    L   169_A      L   169_A     1.305     0    0.069   0.280     1.928   77.143   78.214
LGA    H   170_A      H   170_A     1.942     0    0.112   1.142     4.181   70.833   63.095
LGA    F   171_A      F   171_A     3.605     0    0.238   1.591    10.869   43.452   23.939
LGA    A   172_A      A   172_A     3.125     0    0.078   0.141     3.624   61.548   57.905
LGA    P   173_A      P   173_A     2.205     0    0.276   0.514     4.662   54.524   56.735
LGA    C   174_A      C   174_A     1.854     0    0.075   0.784     4.154   66.905   60.317
LGA    K   175_A      K   175_A     1.589     0    0.635   1.090    10.559   67.262   40.688
LGA    V   176_A      V   176_A     4.706     0    0.173   0.911     8.578   45.476   28.844
LGA    N   177_A      N   177_A     4.328     0    0.626   1.186     6.520   43.452   29.821
LGA    N   178_A      N   178_A     4.932     0    0.102   1.032     9.148   37.262   20.833
LGA    E   179_A      E   179_A     3.119     4    0.173   0.173     4.102   63.571   32.381
LGA    G   180_A      G   180_A     1.512     0    0.133   0.133     1.512   83.810   83.810
LGA    F   181_A      F   181_A     1.837     0    0.079   1.173     6.261   70.833   54.372
LGA    K   182_A      K   182_A     1.769     0    0.089   0.806     2.877   75.000   74.974
LGA    T   183_A      T   183_A     1.805     0    0.111   0.156     1.930   72.857   72.857
LGA    I   184_A      I   184_A     1.098     0    0.030   1.099     2.669   81.429   76.250
LGA    V   185_A      V   185_A     1.097     0    0.154   1.116     2.944   88.214   80.612
LGA    I   186_A      I   186_A     0.791     0    0.050   1.244     4.841   90.476   74.167
LGA    L   187_A      L   187_A     1.363     0    0.167   0.681     2.360   73.095   76.310
LGA    P   188_A      P   188_A     3.612     0    0.051   0.409     7.436   31.905   35.986
LGA    K   189_A      K   189_A     9.520     2    0.301   0.867    11.514    3.452    1.587
LGA    G   190_A      G   190_A    14.356     0    0.088   0.088    17.337    0.000    0.000
LGA    T   191_A      T   191_A    15.456     0    0.647   0.946    17.930    0.000    0.000
LGA    N   192_A      N   192_A    16.013     0    0.564   0.950    18.003    0.000    0.000
LGA    D   193_A      D   193_A    19.156     0    0.014   0.958    22.273    0.000    0.000
LGA    P   194_A      P   194_A    21.091     0    0.096   0.167    22.037    0.000    0.000
LGA    L   195_A      L   195_A    22.468     0    0.185   1.458    24.181    0.000    0.000
LGA    S   196_A      S   196_A    23.981     0    0.101   0.674    24.525    0.000    0.000
LGA    T   197_A      T   197_A    24.371     0    0.687   0.902    25.236    0.000    0.000
LGA    N   198_A      N   198_A    21.654     0    0.271   1.063    25.152    0.000    0.000
LGA    I   199_A      I   199_A    15.225     0    0.626   1.137    17.397    0.000    0.000
LGA    Q   200_A      Q   200_A    11.825     4    0.644   0.578    13.235    0.357    0.159
LGA    K   201_A      K   201_A    11.376     0    0.566   0.675    14.498    0.000    0.000
LGA    R   202_A      R   202_A    11.110     0    0.048   1.293    18.178    0.119    0.043
LGA    T   203_A      T   203_A     6.421     0    0.601   0.609     7.216   18.690   27.075
LGA    K   204_A      K   204_A     5.261     0    0.023   1.041     9.775   33.690   19.735
LGA    E   205_A      E   205_A     4.629     0    0.073   0.992     8.579   37.381   24.709
LGA    D   206_A      D   206_A     2.950     0    0.018   0.206     5.819   55.357   43.631
LGA    E   207_A      E   207_A     3.502     0    0.032   1.112     8.664   45.119   26.931
LGA    L   208_A      L   208_A     3.509     0    0.649   1.437     7.726   53.690   42.560
LGA    L   209_A      L   209_A     3.825     0    0.098   0.117     8.675   48.452   31.071
LGA    F   210_A      F   210_A     2.455     0    0.585   1.260    10.220   59.167   33.506
LGA    M   211_A      M   211_A     6.348     0    0.714   0.808     8.401   15.952   12.321
LGA    K   212_A      K   212_A     7.966     0    0.081   0.674    15.737   15.119    6.931
LGA    N   213_A      N   213_A     6.975     0    0.489   1.105    11.356   24.524   13.631
LGA    K   214_A      K   214_A     4.864     0    0.051   1.191     7.645   20.833   22.275
LGA    W   215_A      W   215_A     9.416     0    0.076   1.109    12.008    2.857    0.850
LGA    L   216_A      L   216_A    14.806     0    0.038   1.092    18.104    0.000    0.000
LGA    I   217_A      I   217_A    20.577     0    0.026   0.300    23.146    0.000    0.000
LGA    A   218_A      A   218_A    26.547     0    0.087   0.175    29.599    0.000    0.000
LGA    H   219_A      H   219_A    33.881     0    0.096   1.076    40.971    0.000    0.000
LGA    P   220_A      P   220_A    37.452     0    0.057   0.334    39.566    0.000    0.000
LGA    E   221_A      E   221_A    40.997     0    0.162   0.926    46.355    0.000    0.000
LGA    R   222_A      R   222_A    34.752     0    0.398   0.869    39.894    0.000    0.000
LGA    E   223_A      E   223_A    32.388     0    0.090   1.327    38.368    0.000    0.000
LGA    Q   224_A      Q   224_A    29.828     4    0.063   0.060    31.336    0.000    0.000
LGA    L   225_A      L   225_A    27.101     0    0.026   0.071    30.968    0.000    0.000
LGA    I   226_A      I   226_A    24.693     0    0.026   0.630    26.951    0.000    0.000
LGA    N   227_A      N   227_A    23.725     0    0.022   0.135    29.126    0.000    0.000
LGA    K   228_A      K   228_A    19.987     0    0.088   0.563    27.628    0.000    0.000
LGA    G   229_A      G   229_A    17.262     0    0.060   0.060    18.643    0.000    0.000
LGA    A   230_A      A   230_A    21.311     0    0.024   0.027    23.484    0.000    0.000
LGA    H   231_A      H   231_A    21.858     0    0.025   0.150    25.581    0.000    0.000
LGA    P   232_A      P   232_A    27.684     0    0.044   0.149    29.010    0.000    0.000
LGA    G   233_A      G   233_A    28.792     0    0.573   0.573    31.763    0.000    0.000
LGA    I   234_A      I   234_A    32.058     0    0.049   0.595    33.941    0.000    0.000
LGA    K   235_A      K   235_A    37.596     0    0.418   1.160    43.739    0.000    0.000
LGA    G   236_A      G   236_A    39.332     0    0.697   0.697    39.332    0.000    0.000
LGA    E   237_A      E   237_A    37.313     4    0.160   0.186    38.229    0.000    0.000
LGA    N   238_A      N   238_A    33.784     0    0.137   0.861    35.178    0.000    0.000
LGA    I   239_A      I   239_A    32.136     0    0.040   0.644    32.591    0.000    0.000
LGA    K   240_A      K   240_A    32.708     0    0.043   0.928    38.670    0.000    0.000
LGA    V   241_A      V   241_A    33.520     0    0.105   1.006    35.784    0.000    0.000
LGA    Y   242_A      Y   242_A    34.366     0    0.084   0.204    34.609    0.000    0.000
LGA    Q   243_A      Q   243_A    35.476     0    0.050   1.252    39.064    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):    10.879         10.770                 11.487           45.732   38.561

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  243  222    4.0    134    2.30    46.509    41.260     5.587

LGA_LOCAL      RMSD:   2.298  Number of atoms:  134  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  12.747  Number of assigned atoms:  222 
Std_ASGN_ATOMS RMSD:  10.879  Standard rmsd on all 222 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.992449 * X  +  -0.096937 * Y  +   0.075158 * Z  +  12.517562
  Y_new =   0.102199 * X  +   0.992323 * Y  +  -0.069650 * Z  +  38.736115
  Z_new =  -0.067829 * X  +   0.076805 * Y  +   0.994736 * Z  +  48.324867 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  0.102615  0.067881  0.077059   [DEG:    5.8794    3.8893    4.4151 ]
ZXZ:  0.823414  0.102649 -0.723417   [DEG:   47.1782    5.8813  -41.4487 ]
 
# END of job
