
#######################################################
#                                                     #
#                        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  176 ( 1334),  selected  176 , name one
# Molecule2: number of CA atoms  176 ( 1334),  selected  176 , 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:   143      28_A - 170_A       4.89    11.70
  LONGEST_CONTINUOUS_SEGMENT:   143      29_A - 171_A       4.92    11.71
  LCS_AVERAGE:     70.14

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   104      45_A - 148_A       1.99    11.23
  LCS_AVERAGE:     39.65

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    34      52_A - 85_A        1.00    11.06
  LCS_AVERAGE:      7.99

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  176
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     M     1_A     M     1_A      4    5   12      3    4    5    5    5    7    7    8    9   11   12   13   26   31   34   35   42   73   77   82 
LCS_GDT     E     2_A     E     2_A      4    5   16      3    4    5    5    6    7    7    8    9   11   12   15   17   48   52   97  103  109  115  121 
LCS_GDT     Q     3_A     Q     3_A      4    7   16      3    4    5    5    7    8    8    9   17   20   53   60   67   77   91  109  113  124  129  132 
LCS_GDT     S     4_A     S     4_A      4    7   16      3    4    5    5    7    8   15   16   42   46   53   60   90   96  101  109  113  124  129  132 
LCS_GDT     S     5_A     S     5_A      3    7   16      3    3    5    5    7   14   16   22   28   40   53   86   90   96  101  109  113  124  129  132 
LCS_GDT     G     6_A     G     6_A      5    7   16      4    4    5    6    7    8    9   10   12   20   22   42   49   52   91   97  113  120  124  129 
LCS_GDT     D     7_A     D     7_A      5    7   16      4    4    5    6    7    8   21   33   42   46   53   86   90   96  101  110  124  125  129  132 
LCS_GDT     K     8_A     K     8_A      5    7   16      4    4    5    6    7    8   21   33   51   60   69   86  102  114  120  123  127  127  130  132 
LCS_GDT     D     9_A     D     9_A      5    7   16      4    4    7    9   13   16   21   42   51   69   82   88  102  114  120  124  127  128  130  132 
LCS_GDT     G    10_A     G    10_A      5    7   16      3    4    5    6   15   39   60   79   94  105  110  117  118  122  126  127  131  133  136  138 
LCS_GDT     G    11_A     G    11_A      4    5   16      3    4    4    5    6    7   11   24   33   49   63   80   95  109  120  123  127  133  136  138 
LCS_GDT     S    12_A     S    12_A      4    5   16      3    4    4    4    4    5    9   12   12   13   15   15   16   18   25   37   61   86  100  124 
LCS_GDT     D    13_A     D    13_A      4    5   16      3    4    4    4    4    5    6    8   11   19   25   43   65   82   96  114  126  131  136  138 
LCS_GDT     S    14_A     S    14_A      4    6   16      3    3    4    5    7    7   11   12   12   17   34   69   90  104  119  127  131  133  136  138 
LCS_GDT     G    15_A     G    15_A      4    6   16      4    4    4    7    7    7   11   12   12   21   35   58   72   82  100  114  126  131  136  138 
LCS_GDT     G    16_A     G    16_A      4    6   16      4    4    4    7    7    7   11   12   12   14   17   19   24   50   83   99  119  129  134  138 
LCS_GDT     A    17_A     A    17_A      4    6   25      4    4    4    7    7    7   11   12   12   14   29   53   56   66  105  118  127  132  134  138 
LCS_GDT     Q    18_A     Q    18_A      4    6   25      4    4    4    7    7    7   24   40   79   98  118  124  127  130  131  132  133  134  136  138 
LCS_GDT     D    19_A     D    19_A      4    6   25      3    3    4    7    7    7   11   12   12   23   45   54   84  107  126  128  132  133  136  138 
LCS_GDT     G    20_A     G    20_A      3    6   25      3    4    4    6    8   15   24   34   60   85  105  122  127  130  131  132  133  134  136  138 
LCS_GDT     G    21_A     G    21_A      3    6   25      3    3    4    5    7   10   13   17   22   32   39   56   64   82   99  111  121  131  134  136 
LCS_GDT     S    22_A     S    22_A      3    6   25      3    3    4    4    5    6   11   15   17   19   22   23   28   40   52   62   68   80   88  100 
LCS_GDT     L    23_A     L    23_A      4    6   25      3    3    7    8    9   10   12   15   17   19   22   23   26   30   41   47   54   61   75   82 
LCS_GDT     D    24_A     D    24_A      4    7   25      3    3    7    8    9   10   12   15   17   19   22   23   26   30   41   47   52   59   73   78 
LCS_GDT     S    25_A     S    25_A      6    8  138      5    6    7    8    9    9    9    9   16   19   21   23   25   32   41   47   52   56   59   76 
LCS_GDT     L    26_A     L    26_A      6    8  141      5    6    7    8    9    9    9    9   12   19   21   23   31   38   41   64   79   89  100  109 
LCS_GDT     K    27_A     K    27_A      6    8  142      5    6    6    6    8    8    8   10   17   19   22   27   37   51   69   75   87   97  103  113 
LCS_GDT     K    28_A     K    28_A      6    8  143      5    6    6    6    8   13   21   28   37   43   52   62   78   86   96  105  120  130  134  136 
LCS_GDT     Y    29_A     Y    29_A      6    8  143      5    6    6   11   19   28   38   50   59   64   90  107  124  127  129  132  133  134  135  136 
LCS_GDT     N    30_A     N    30_A      6    8  143      3    6   11   14   17   23   27   34   40   51   63   70   78   96  113  126  132  133  134  136 
LCS_GDT     G    31_A     G    31_A      3    8  143      3    6   11   15   19   25   33   46   58   64   74   94  109  124  129  131  132  134  135  136 
LCS_GDT     K    32_A     K    32_A      8   12  143      4    7   14   20   33   51   61   84  104  116  125  127  128  130  131  132  133  136  137  137 
LCS_GDT     L    33_A     L    33_A      8   12  143      4    7   16   29   49   70   97  112  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     P    34_A     P    34_A      8   12  143      3    9   14   26   49   70   92  111  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     K    35_A     K    35_A      8   12  143      4    7   14   25   38   70   85  105  117  122  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     H    36_A     H    36_A      8   95  143      4   13   21   42   60   84  105  114  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     D    37_A     D    37_A      8  100  143      4    7   27   66   83  100  108  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     P    38_A     P    38_A      8  100  143      4    7   10   14   89  100  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     S    39_A     S    39_A      8  100  143      4    6   10   24   97  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     F    40_A     F    40_A      8  100  143      3    6   16   77   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     V    41_A     V    41_A      5  100  143      4   34   65   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     Q    42_A     Q    42_A      5  100  143      3    5    8   24   87  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     P    43_A     P    43_A      3  100  143      1   18   49   78   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     G    44_A     G    44_A      3  100  143      3    3    3   10   17   75  105  112  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     N    45_A     N    45_A      5  104  143      8   35   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     R    46_A     R    46_A      5  104  143      4    7   13   36   91  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     H    47_A     H    47_A      5  104  143      4    4   41   82   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     Y    48_A     Y    48_A     11  104  143      4   22   56   82   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     K    49_A     K    49_A     11  104  143      3   22   56   85   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     Y    50_A     Y    50_A     11  104  143      4    8   41   74   94  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     Q    51_A     Q    51_A     32  104  143      5   34   65   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     C    52_A     C    52_A     34  104  143     15   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     T    53_A     T    53_A     34  104  143     15   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     W    54_A     W    54_A     34  104  143     15   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     Y    55_A     Y    55_A     34  104  143     15   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     A    56_A     A    56_A     34  104  143     13   45   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     Y    57_A     Y    57_A     34  104  143     13   44   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     N    58_A     N    58_A     34  104  143     15   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     R    59_A     R    59_A     34  104  143     10   40   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     R    60_A     R    60_A     34  104  143      6   27   63   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     G    61_A     G    61_A     34  104  143     10   41   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     Q    62_A     Q    62_A     34  104  143      9   24   66   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     L    63_A     L    63_A     34  104  143      6   16   50   85   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     G    64_A     G    64_A     34  104  143      9   34   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     I    65_A     I    65_A     34  104  143      9   40   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     P    66_A     P    66_A     34  104  143      3   32   65   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     V    67_A     V    67_A     34  104  143      4   27   67   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     P    68_A     P    68_A     34  104  143      8   40   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     L    69_A     L    69_A     34  104  143      4   36   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     W    70_A     W    70_A     34  104  143      8   51   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     G    71_A     G    71_A     34  104  143     11   43   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     D    72_A     D    72_A     34  104  143     15   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     A    73_A     A    73_A     34  104  143     15   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     A    74_A     A    74_A     34  104  143     13   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     D    75_A     D    75_A     34  104  143     12   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     W    76_A     W    76_A     34  104  143     15   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     I    77_A     I    77_A     34  104  143     13   47   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     G    78_A     G    78_A     34  104  143      8   30   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     G    79_A     G    79_A     34  104  143      7   51   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     A    80_A     A    80_A     34  104  143     14   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     K    81_A     K    81_A     34  104  143     10   30   67   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     G    82_A     G    82_A     34  104  143      7   22   61   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     A    83_A     A    83_A     34  104  143     19   51   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     G    84_A     G    84_A     34  104  143     13   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     Y    85_A     Y    85_A     34  104  143     10   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     G    86_A     G    86_A     21  104  143      6   31   68   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     V    87_A     V    87_A     21  104  143      7   40   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     G    88_A     G    88_A     21  104  143     19   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     R    89_A     R    89_A     19  104  143     23   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     T    90_A     T    90_A     19  104  143     23   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     P    91_A     P    91_A     19  104  143     23   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     K    92_A     K    92_A     19  104  143     23   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     Q    93_A     Q    93_A     19  104  143     23   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     G    94_A     G    94_A     19  104  143     23   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     A    95_A     A    95_A     19  104  143     19   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     C    96_A     C    96_A     19  104  143     17   48   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     V    97_A     V    97_A     19  104  143     19   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     I    98_A     I    98_A     19  104  143     19   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     W    99_A     W    99_A     19  104  143     19   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     Q   100_A     Q   100_A     19  104  143     17   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     R   101_A     R   101_A     19  104  143     20   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     G   102_A     G   102_A     19  104  143     10   33   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     V   103_A     V   103_A     18  104  143      6   41   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     Q   104_A     Q   104_A     18  104  143     11   49   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     G   105_A     G   105_A      9  104  143      3    9   18   33   58   94  108  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     G   106_A     G   106_A     15  104  143      7   18   49   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     S   107_A     S   107_A     15  104  143      8   21   64   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     P   108_A     P   108_A     15  104  143      8   38   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     Q   109_A     Q   109_A     15  104  143     13   41   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     Y   110_A     Y   110_A     15  104  143     23   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     G   111_A     G   111_A     15  104  143     23   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     H   112_A     H   112_A     15  104  143     23   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     V   113_A     V   113_A     15  104  143     23   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     A   114_A     A   114_A     15  104  143     23   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     F   115_A     F   115_A     15  104  143     23   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     V   116_A     V   116_A     15  104  143     23   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     E   117_A     E   117_A     15  104  143     23   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     K   118_A     K   118_A     15  104  143     23   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     V   119_A     V   119_A     15  104  143     23   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     L   120_A     L   120_A     15  104  143     23   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     D   121_A     D   121_A     15  104  143      3    6   33   60   78  101  107  114  119  122  125  127  128  130  131  132  133  136  137  138 
LCS_GDT     G   122_A     G   122_A      4  104  143      3    7   32   81   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     G   123_A     G   123_A      4  104  143      3    4   11   17   49   94  108  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     K   124_A     K   124_A      7  104  143      7   39   67   87   97  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     K   125_A     K   125_A      7  104  143     23   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     I   126_A     I   126_A      7  104  143     23   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     F   127_A     F   127_A      7  104  143     23   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     I   128_A     I   128_A      7  104  143     23   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     S   129_A     S   129_A      7  104  143     15   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     E   130_A     E   130_A      7  104  143      3    9   49   83   97  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     H   131_A     H   131_A      4  104  143      3    3    7    9   13   34   49  100  116  122  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     N   132_A     N   132_A      4  104  143      3    3   14   43   77  101  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     Y   133_A     Y   133_A      4  104  143     11   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     A   134_A     A   134_A      4  104  143     16   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     T   135_A     T   135_A      7  104  143      9   40   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     P   136_A     P   136_A      7  104  143      9   39   68   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     N   137_A     N   137_A     11  104  143      5    8   18   32   49   80  101  106  116  123  126  127  128  130  131  132  133  136  137  137 
LCS_GDT     G   138_A     G   138_A     11  104  143      5   14   28   45   65   96  103  114  118  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     Y   139_A     Y   139_A     11  104  143      5   19   36   63   84  101  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     G   140_A     G   140_A     11  104  143      8   28   51   79   96  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     T   141_A     T   141_A     11  104  143     16   44   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     R   142_A     R   142_A     11  104  143     23   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     T   143_A     T   143_A     11  104  143     23   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     I   144_A     I   144_A     11  104  143     23   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     D   145_A     D   145_A     11  104  143     19   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     M   146_A     M   146_A     11  104  143      5   15   61   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     S   147_A     S   147_A     11  104  143     23   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     S   148_A     S   148_A      9  104  143      4    6   10   13   70  102  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     A   149_A     A   149_A      4   98  143      4    4    4    5    7    9   30   75   98  113  121  126  128  130  131  132  133  136  137  138 
LCS_GDT     I   150_A     I   150_A      4   11  143      4    4    9   10   16   24   29   44   64   81  109  118  128  130  131  132  133  136  137  138 
LCS_GDT     G   151_A     G   151_A     10   11  143      5   12   14   31   38   56  104  112  119  122  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     K   152_A     K   152_A     10   11  143      5   12   15   38   73   94  105  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     N   153_A     N   153_A     10   11  143      5   14   46   75   97  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     A   154_A     A   154_A     10   11  143      5   20   64   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     Q   155_A     Q   155_A     10   11  143     16   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     F   156_A     F   156_A     10   11  143     15   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     I   157_A     I   157_A     10   11  143      9   52   70   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     Y   158_A     Y   158_A     10   11  143     10   28   66   87   98  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     D   159_A     D   159_A     10   11  143      7   13   40   74   92  104  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     K   160_A     K   160_A     10   11  143      7   13   40   66   92  102  109  115  119  123  126  127  128  130  131  132  133  136  137  138 
LCS_GDT     K   161_A     K   161_A      4   11  143      3   14   28   64   93  104  108  115  119  123  126  127  128  129  131  132  133  136  137  138 
LCS_GDT     K   162_A     K   162_A      4    6  143      3    4    9   14   32   56   83   99  108  118  123  126  128  129  130  131  133  136  137  137 
LCS_GDT     N   163_A     N   163_A      4    6  143      3    4    7    9   10   15   18   26   59   88  108  118  123  125  128  130  133  136  137  137 
LCS_GDT     S   164_A     S   164_A      4    5  143      3    4    4    6    6   18   21   36   46   69  100  115  123  125  127  130  133  135  137  137 
LCS_GDT     S   165_A     S   165_A      4    5  143      3    4    4    4    6    8   10   26   32   57   84  114  123  125  126  130  133  136  137  137 
LCS_GDT     S   166_A     S   166_A      3    5  143      3    4    4    9   17   24   40   78  112  117  121  125  128  129  130  131  133  136  137  137 
LCS_GDT     V   167_A     V   167_A      3    4  143      3    4    4    4    5    7    9   11   23   30   43   50   99  106  122  128  131  136  137  137 
LCS_GDT     D   168_A     D   168_A      6    7  143      5    5    7    9   10   14   17   25   34   44   57   76   90  104  117  124  131  136  137  137 
LCS_GDT     K   169_A     K   169_A      6    7  143      5    5    7    9   10   14   17   22   31   41   48   68   78   85  101  120  124  131  135  136 
LCS_GDT     L   170_A     L   170_A      6    7  143      5    5    7    9   10   14   17   21   31   33   39   47   52   74   79   93  108  117  131  134 
LCS_GDT     A   171_A     A   171_A      6    7  143      5    5    7    9   10   14   17   17   20   22   26   31   41   58   71   81   94  101  114  131 
LCS_GDT     A   172_A     A   172_A      6    7  142      5    5    7    9   10   14   17   17   20   22   23   27   30   36   41   48   70   86   96  106 
LCS_GDT     A   173_A     A   173_A      6    7   30      4    5    7    9   10   14   17   17   20   21   23   24   37   39   45   48   52   59   66   95 
LCS_GDT     L   174_A     L   174_A      5    7   30      3    4    6    8   10   14   17   17   20   21   23   24   27   30   32   35   38   39   45   45 
LCS_GDT     E   175_A     E   175_A      4    4   30      3    4    4    7    7    7    9   15   20   21   22   24   26   29   31   32   34   36   39   40 
LCS_GDT     H   176_A     H   176_A      4    4   30      1    4    4    7    7    8    9   15   15   16   22   24   26   27   29   32   33   35   39   40 
LCS_AVERAGE  LCS_A:  39.26  (   7.99   39.65   70.14 )

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     23     52     70     87     98    104    109    115    119    123    126    127    128    130    131    132    133    136    137    138 
GDT PERCENT_AT  13.07  29.55  39.77  49.43  55.68  59.09  61.93  65.34  67.61  69.89  71.59  72.16  72.73  73.86  74.43  75.00  75.57  77.27  77.84  78.41
GDT RMS_LOCAL    0.31   0.74   0.97   1.22   1.44   1.54   1.69   1.90   2.03   2.31   2.45   2.48   2.56   2.91   2.93   3.02   3.22   3.63   3.72   4.36
GDT RMS_ALL_AT  11.39  11.25  11.23  11.21  11.22  11.22  11.23  11.25  11.26  11.34  11.38  11.36  11.34  11.28  11.28  11.31  11.36  11.46  11.46  10.98

# Checking swapping
#   possible swapping detected:  E     2_A      E     2_A
#   possible swapping detected:  D     9_A      D     9_A
#   possible swapping detected:  D    37_A      D    37_A
#   possible swapping detected:  Y    57_A      Y    57_A
#   possible swapping detected:  D    72_A      D    72_A
#   possible swapping detected:  Y   110_A      Y   110_A
#   possible swapping detected:  F   127_A      F   127_A
#   possible swapping detected:  E   130_A      E   130_A
#   possible swapping detected:  Y   133_A      Y   133_A
#   possible swapping detected:  D   145_A      D   145_A
#   possible swapping detected:  F   156_A      F   156_A
#   possible swapping detected:  D   168_A      D   168_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    M     1_A      M     1_A    32.668     0    0.077   0.700    34.092    0.000    0.000
LGA    E     2_A      E     2_A    30.980     0    0.111   1.065    35.544    0.000    0.000
LGA    Q     3_A      Q     3_A    27.950     0    0.236   1.159    28.971    0.000    0.000
LGA    S     4_A      S     4_A    28.305     0    0.209   0.567    29.411    0.000    0.000
LGA    S     5_A      S     5_A    27.349     0    0.190   0.228    27.616    0.000    0.000
LGA    G     6_A      G     6_A    26.578     0    0.682   0.682    26.663    0.000    0.000
LGA    D     7_A      D     7_A    24.328     0    0.133   1.166    28.455    0.000    0.000
LGA    K     8_A      K     8_A    20.846     0    0.043   0.075    21.554    0.000    0.000
LGA    D     9_A      D     9_A    19.289     0    0.047   0.963    23.964    0.000    0.000
LGA    G    10_A      G    10_A    12.886     0    0.114   0.114    15.214    0.000    0.000
LGA    G    11_A      G    11_A    16.101     0    0.168   0.168    17.946    0.000    0.000
LGA    S    12_A      S    12_A    20.979     0    0.039   0.682    23.812    0.000    0.000
LGA    D    13_A      D    13_A    16.069     0    0.673   1.050    17.517    0.000    0.000
LGA    S    14_A      S    14_A    15.068     0    0.141   0.130    15.491    0.000    0.000
LGA    G    15_A      G    15_A    16.753     0    0.470   0.470    18.545    0.000    0.000
LGA    G    16_A      G    16_A    17.029     0    0.041   0.041    17.029    0.000    0.000
LGA    A    17_A      A    17_A    15.377     0    0.136   0.192    17.841    0.000    0.000
LGA    Q    18_A      Q    18_A    10.181     0    0.666   1.474    11.960    0.000    2.434
LGA    D    19_A      D    19_A    13.827     0    0.189   1.027    17.500    0.000    0.000
LGA    G    20_A      G    20_A    11.831     0    0.283   0.283    13.788    0.000    0.000
LGA    G    21_A      G    21_A    18.043     0    0.376   0.376    20.745    0.000    0.000
LGA    S    22_A      S    22_A    21.893     0    0.052   0.696    23.101    0.000    0.000
LGA    L    23_A      L    23_A    25.790     0    0.493   1.479    28.967    0.000    0.000
LGA    D    24_A      D    24_A    28.576     0    0.149   1.001    30.398    0.000    0.000
LGA    S    25_A      S    25_A    27.162     0    0.582   0.925    28.437    0.000    0.000
LGA    L    26_A      L    26_A    23.224     0    0.043   0.181    25.906    0.000    0.000
LGA    K    27_A      K    27_A    23.786     0    0.025   0.968    34.048    0.000    0.000
LGA    K    28_A      K    28_A    19.209     0    0.020   0.850    21.626    0.000    0.000
LGA    Y    29_A      Y    29_A    14.665     0    0.155   1.353    17.438    0.000    0.000
LGA    N    30_A      N    30_A    17.919     0    0.396   0.577    21.352    0.000    0.000
LGA    G    31_A      G    31_A    15.401     0    0.669   0.669    16.672    0.000    0.000
LGA    K    32_A      K    32_A     9.895     0    0.668   1.066    12.168    1.548    0.688
LGA    L    33_A      L    33_A     6.988     0    0.073   1.031     9.280   10.119    9.167
LGA    P    34_A      P    34_A     7.246     0    0.091   0.141     7.246   12.619   12.925
LGA    K    35_A      K    35_A     7.688     0    0.037   0.903    15.263   11.190    5.291
LGA    H    36_A      H    36_A     5.615     0    0.080   0.874     7.562   21.548   20.429
LGA    D    37_A      D    37_A     4.481     0    0.077   1.287     7.314   43.929   33.750
LGA    P    38_A      P    38_A     3.660     0    0.168   0.386     5.665   46.667   37.211
LGA    S    39_A      S    39_A     2.636     0    0.170   0.556     4.395   60.952   56.349
LGA    F    40_A      F    40_A     2.423     0    0.252   0.274     4.186   64.881   57.619
LGA    V    41_A      V    41_A     1.821     0    0.053   1.087     3.560   59.762   65.646
LGA    Q    42_A      Q    42_A     3.577     0    0.072   0.943    10.167   36.310   20.106
LGA    P    43_A      P    43_A     2.954     0    0.673   0.674     5.651   44.762   53.333
LGA    G    44_A      G    44_A     4.740     0    0.621   0.621     4.740   43.690   43.690
LGA    N    45_A      N    45_A     1.302     0    0.473   1.139     5.682   72.976   61.012
LGA    R    46_A      R    46_A     3.575     0    0.089   1.002     5.999   50.119   39.004
LGA    H    47_A      H    47_A     2.777     0    0.109   0.992     6.553   59.048   39.571
LGA    Y    48_A      Y    48_A     2.609     0    0.108   1.198    11.440   62.857   31.389
LGA    K    49_A      K    49_A     2.450     0    0.634   1.136     4.014   66.905   56.931
LGA    Y    50_A      Y    50_A     3.774     0    0.101   1.363     9.997   45.000   23.968
LGA    Q    51_A      Q    51_A     1.997     0    0.029   1.126     7.748   75.119   49.788
LGA    C    52_A      C    52_A     0.473     0    0.056   0.109     0.971   97.619   96.825
LGA    T    53_A      T    53_A     0.174     0    0.043   0.048     0.568  100.000   98.639
LGA    W    54_A      W    54_A     0.370     0    0.032   1.554     6.954  100.000   70.952
LGA    Y    55_A      Y    55_A     0.392     0    0.051   1.506     7.874  100.000   62.500
LGA    A    56_A      A    56_A     0.650     0    0.021   0.041     0.925   92.857   92.381
LGA    Y    57_A      Y    57_A     0.524     0    0.055   1.269     7.535   95.238   62.817
LGA    N    58_A      N    58_A     0.375     0    0.053   0.555     2.030   95.238   86.310
LGA    R    59_A      R    59_A     0.999     0    0.114   1.226     4.841   83.810   62.900
LGA    R    60_A      R    60_A     1.618     0    0.044   1.327     5.485   77.143   63.550
LGA    G    61_A      G    61_A     0.821     0    0.122   0.122     0.948   90.476   90.476
LGA    Q    62_A      Q    62_A     1.640     0    0.088   1.155     5.085   72.976   59.206
LGA    L    63_A      L    63_A     2.268     0    0.105   0.249     4.062   70.833   58.869
LGA    G    64_A      G    64_A     1.221     0    0.147   0.147     1.526   79.286   79.286
LGA    I    65_A      I    65_A     1.208     0    0.100   0.188     1.712   79.286   78.214
LGA    P    66_A      P    66_A     1.547     0    0.122   0.271     2.052   72.976   76.667
LGA    V    67_A      V    67_A     1.561     0    0.051   1.270     3.302   79.286   72.109
LGA    P    68_A      P    68_A     1.168     0    0.087   0.306     1.738   81.429   82.789
LGA    L    69_A      L    69_A     1.371     0    0.026   0.941     4.369   83.690   67.262
LGA    W    70_A      W    70_A     1.467     0    0.636   1.259     7.932   68.214   53.844
LGA    G    71_A      G    71_A     0.970     0    0.316   0.316     2.157   81.786   81.786
LGA    D    72_A      D    72_A     0.900     0    0.099   0.877     3.082   88.214   78.750
LGA    A    73_A      A    73_A     0.510     0    0.044   0.042     0.702   90.476   90.476
LGA    A    74_A      A    74_A     0.928     0    0.028   0.032     1.109   85.952   85.048
LGA    D    75_A      D    75_A     1.245     0    0.056   0.600     3.117   85.952   78.690
LGA    W    76_A      W    76_A     0.662     0    0.033   0.125     0.862   90.476   90.476
LGA    I    77_A      I    77_A     0.798     0    0.035   1.107     2.643   90.476   80.774
LGA    G    78_A      G    78_A     1.690     0    0.017   0.017     1.804   75.000   75.000
LGA    G    79_A      G    79_A     1.694     0    0.029   0.029     1.694   75.000   75.000
LGA    A    80_A      A    80_A     0.892     0    0.015   0.015     1.321   90.476   88.667
LGA    K    81_A      K    81_A     1.637     0    0.038   1.115     2.813   75.000   68.519
LGA    G    82_A      G    82_A     2.402     0    0.029   0.029     2.615   64.881   64.881
LGA    A    83_A      A    83_A     1.889     0    0.118   0.115     2.208   77.143   74.667
LGA    G    84_A      G    84_A     0.390     0    0.055   0.055     0.860   95.238   95.238
LGA    Y    85_A      Y    85_A     0.714     0    0.062   0.598     2.132   90.476   82.421
LGA    G    86_A      G    86_A     1.757     0    0.169   0.169     1.757   75.000   75.000
LGA    V    87_A      V    87_A     1.249     0    0.055   0.121     1.767   81.429   77.755
LGA    G    88_A      G    88_A     0.773     0    0.050   0.050     0.773   90.476   90.476
LGA    R    89_A      R    89_A     0.948     0    0.042   0.979     4.192   90.476   74.978
LGA    T    90_A      T    90_A     0.963     0    0.043   0.074     1.154   85.952   87.891
LGA    P    91_A      P    91_A     1.256     0    0.105   0.361     1.907   79.286   78.980
LGA    K    92_A      K    92_A     1.332     0    0.057   0.951     6.243   81.429   62.381
LGA    Q    93_A      Q    93_A     1.289     0    0.034   0.262     2.422   81.429   77.672
LGA    G    94_A      G    94_A     1.632     0    0.264   0.264     2.767   68.929   68.929
LGA    A    95_A      A    95_A     1.206     0    0.022   0.038     1.542   79.286   79.714
LGA    C    96_A      C    96_A     1.759     0    0.074   0.753     2.422   77.143   74.365
LGA    V    97_A      V    97_A     0.498     0    0.068   1.125     2.420   97.619   87.211
LGA    I    98_A      I    98_A     0.496     0    0.025   0.052     1.068   95.238   89.464
LGA    W    99_A      W    99_A     0.507     0    0.097   1.110     5.121   92.857   74.762
LGA    Q   100_A      Q   100_A     1.008     0    0.073   0.259     2.018   88.214   79.735
LGA    R   101_A      R   101_A     0.865     0    0.040   0.826     4.414   81.786   60.693
LGA    G   102_A      G   102_A     2.055     0    0.127   0.127     3.391   65.238   65.238
LGA    V   103_A      V   103_A     1.607     0    0.161   1.215     3.806   70.833   69.932
LGA    Q   104_A      Q   104_A     1.455     0    0.424   0.959     7.138   66.190   45.556
LGA    G   105_A      G   105_A     4.282     0    0.096   0.096     5.017   40.952   40.952
LGA    G   106_A      G   106_A     2.015     0    0.045   0.045     2.365   68.810   68.810
LGA    S   107_A      S   107_A     1.769     0    0.070   0.730     4.867   72.857   64.603
LGA    P   108_A      P   108_A     1.565     0    0.031   0.252     1.822   72.857   72.857
LGA    Q   109_A      Q   109_A     2.125     0    0.093   1.293     7.555   68.810   46.772
LGA    Y   110_A      Y   110_A     0.976     0    0.117   0.392     4.441   88.214   68.651
LGA    G   111_A      G   111_A     1.022     0    0.106   0.106     1.056   85.952   85.952
LGA    H   112_A      H   112_A     0.677     0    0.042   0.498     2.357   90.476   85.333
LGA    V   113_A      V   113_A     0.922     0    0.034   1.196     2.966   85.952   79.320
LGA    A   114_A      A   114_A     1.257     0    0.059   0.086     1.549   79.286   79.714
LGA    F   115_A      F   115_A     1.474     0    0.055   0.242     1.626   81.429   79.870
LGA    V   116_A      V   116_A     1.441     0    0.045   0.063     1.497   81.429   81.429
LGA    E   117_A      E   117_A     1.568     0    0.028   0.148     1.693   72.857   73.810
LGA    K   118_A      K   118_A     1.489     0    0.082   0.942     4.005   79.286   70.952
LGA    V   119_A      V   119_A     1.533     0    0.090   0.129     1.950   72.857   74.082
LGA    L   120_A      L   120_A     1.687     0    0.225   1.428     3.816   72.976   65.476
LGA    D   121_A      D   121_A     4.555     0    0.249   1.141    11.113   49.167   26.071
LGA    G   122_A      G   122_A     2.845     0    0.096   0.096     6.141   48.214   48.214
LGA    G   123_A      G   123_A     4.450     0    0.170   0.170     4.450   46.905   46.905
LGA    K   124_A      K   124_A     2.394     0    0.239   0.713     6.393   65.238   49.471
LGA    K   125_A      K   125_A     1.084     0    0.056   0.708     2.032   81.429   81.587
LGA    I   126_A      I   126_A     0.958     0    0.027   0.044     0.958   90.476   90.476
LGA    F   127_A      F   127_A     1.211     0    0.028   1.218     5.310   81.429   66.190
LGA    I   128_A      I   128_A     1.311     0    0.358   0.384     2.680   75.357   78.393
LGA    S   129_A      S   129_A     0.695     0    0.692   0.733     3.023   79.881   76.667
LGA    E   130_A      E   130_A     2.612     0    0.393   1.123     9.278   46.667   25.767
LGA    H   131_A      H   131_A     5.337     0    0.480   1.156    11.722   39.167   17.000
LGA    N   132_A      N   132_A     3.755     0    0.210   1.206     6.435   41.905   32.917
LGA    Y   133_A      Y   133_A     0.988     0    0.414   0.453     8.466   81.548   45.159
LGA    A   134_A      A   134_A     0.855     0    0.028   0.044     1.299   85.952   86.857
LGA    T   135_A      T   135_A     1.418     0    0.580   0.790     4.302   66.190   68.027
LGA    P   136_A      P   136_A     2.277     0    0.242   0.305     6.104   50.119   58.980
LGA    N   137_A      N   137_A     6.448     0    0.586   0.728    12.389   22.857   12.024
LGA    G   138_A      G   138_A     5.171     0    0.053   0.053     5.715   27.619   27.619
LGA    Y   139_A      Y   139_A     3.916     0    0.097   1.117    12.310   41.786   21.865
LGA    G   140_A      G   140_A     2.873     0    0.030   0.030     3.153   59.167   59.167
LGA    T   141_A      T   141_A     1.861     0    0.024   1.091     2.922   70.833   69.456
LGA    R   142_A      R   142_A     1.183     0    0.051   0.545     2.799   81.429   72.468
LGA    T   143_A      T   143_A     1.023     0    0.044   0.108     1.200   81.429   84.014
LGA    I   144_A      I   144_A     0.574     0    0.035   0.569     1.662   92.857   91.845
LGA    D   145_A      D   145_A     0.958     0    0.129   0.621     2.071   83.810   81.667
LGA    M   146_A      M   146_A     2.209     0    0.179   1.469     8.972   72.976   49.405
LGA    S   147_A      S   147_A     0.775     0    0.061   0.721     2.990   78.095   77.778
LGA    S   148_A      S   148_A     3.431     0    0.594   0.649     4.193   48.810   46.984
LGA    A   149_A      A   149_A     7.784     0    0.049   0.048    10.429   10.357    8.286
LGA    I   150_A      I   150_A     8.723     0    0.251   1.492    13.708    6.190    3.095
LGA    G   151_A      G   151_A     4.988     0    0.597   0.597     5.324   34.524   34.524
LGA    K   152_A      K   152_A     4.558     0    0.043   1.174     8.059   37.381   24.974
LGA    N   153_A      N   153_A     2.669     0    0.069   0.134     3.434   63.333   59.405
LGA    A   154_A      A   154_A     2.070     0    0.102   0.123     2.462   66.786   66.381
LGA    Q   155_A      Q   155_A     0.931     0    0.027   1.217     5.303   90.595   72.222
LGA    F   156_A      F   156_A     0.446     0    0.079   0.121     1.132   90.595   92.294
LGA    I   157_A      I   157_A     0.799     0    0.022   0.138     1.265   85.952   90.595
LGA    Y   158_A      Y   158_A     1.893     0    0.022   1.077    11.197   70.952   36.587
LGA    D   159_A      D   159_A     3.038     0    0.047   0.364     3.526   52.024   51.071
LGA    K   160_A      K   160_A     3.538     0    0.562   1.188     9.647   47.143   27.143
LGA    K   161_A      K   161_A     3.907     0    0.045   0.881     9.129   52.976   30.106
LGA    K   162_A      K   162_A     6.939     0    0.225   0.857    10.904   10.000    5.926
LGA    N   163_A      N   163_A    10.604     0    0.507   1.173    14.451    0.357    0.179
LGA    S   164_A      S   164_A    10.941     0    0.537   0.859    11.844    0.000    0.079
LGA    S   165_A      S   165_A    12.140     0    0.510   0.663    12.986    0.000    0.000
LGA    S   166_A      S   166_A     8.882     0    0.687   0.591    10.304    0.952    7.063
LGA    V   167_A      V   167_A    14.282     0    0.602   0.689    18.550    0.000    0.000
LGA    D   168_A      D   168_A    16.361     0    0.612   1.254    19.682    0.000    0.000
LGA    K   169_A      K   169_A    18.770     0    0.034   0.889    21.609    0.000    0.000
LGA    L   170_A      L   170_A    19.093     0    0.042   1.400    21.835    0.000    0.000
LGA    A   171_A      A   171_A    20.495     0    0.048   0.062    24.048    0.000    0.000
LGA    A   172_A      A   172_A    24.534     0    0.090   0.106    27.777    0.000    0.000
LGA    A   173_A      A   173_A    26.305     0    0.612   0.582    28.230    0.000    0.000
LGA    L   174_A      L   174_A    29.802     0    0.199   0.316    33.188    0.000    0.000
LGA    E   175_A      E   175_A    35.699     0    0.678   1.106    39.382    0.000    0.000
LGA    H   176_A      H   176_A    36.815     0    0.076   1.159    40.129    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      176     704    704  100.00    1334   1334  100.00               176
SUMMARY(RMSD_GDC):    10.709         10.718                 11.029           51.376   46.071

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  176  176    4.0    115    1.90    54.830    53.764     5.761

LGA_LOCAL      RMSD:   1.896  Number of atoms:  115  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  11.255  Number of assigned atoms:  176 
Std_ASGN_ATOMS RMSD:  10.709  Standard rmsd on all 176 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.925993 * X  +  -0.215909 * Y  +   0.309711 * Z  +   3.778980
  Y_new =  -0.350300 * X  +   0.797306 * Y  +  -0.491522 * Z  +  -9.353704
  Z_new =  -0.140811 * X  +  -0.563637 * Y  +  -0.813932 * Z  + -32.380779 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -2.779935  0.141280 -2.535927   [DEG: -159.2785    8.0948 -145.2979 ]
ZXZ:  0.562263  2.521685 -2.896779   [DEG:   32.2153  144.4819 -165.9732 ]
 
# END of job
