
#######################################################
#                                                     #
#                        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:   144      18_A - 161_A       4.98    11.70
  LONGEST_CONTINUOUS_SEGMENT:   144      19_A - 162_A       4.89    11.70
  LONGEST_CONTINUOUS_SEGMENT:   144      20_A - 163_A       4.88    11.70
  LONGEST_CONTINUOUS_SEGMENT:   144      21_A - 164_A       4.96    11.70
  LCS_AVERAGE:     72.90

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   116      46_A - 161_A       2.00    12.55
  LONGEST_CONTINUOUS_SEGMENT:   116      47_A - 162_A       1.99    12.53
  LCS_AVERAGE:     46.88

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    31      71_A - 101_A       1.00    12.82
  LCS_AVERAGE:      9.73

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    4   16      3    3    4    4    4    4    5    8    8   11   12   14   14   14   15   15   16   16   16   17 
LCS_GDT     E     2_A     E     2_A      4    4   16      3    3    4    4    4    7    8   10   12   13   13   14   14   14   15   15   16   16   16   17 
LCS_GDT     Q     3_A     Q     3_A      4    4   16      3    3    4    4    5    7    8   10   12   13   13   14   14   14   15   15   16   16   17   17 
LCS_GDT     S     4_A     S     4_A      4    4   16      3    3    4    4    4    6    8   10   12   13   13   14   14   14   15   15   16   16   17   17 
LCS_GDT     S     5_A     S     5_A      3    4   16      3    3    4    4    4    4    6    7    7    8   12   13   14   14   15   15   16   16   16   17 
LCS_GDT     G     6_A     G     6_A      3    4   16      3    3    4    4    4    5    7    7   10   13   13   14   14   14   15   15   16   16   16   17 
LCS_GDT     D     7_A     D     7_A      3    4   16      0    3    4    4    5    8    9    9   12   13   13   14   14   14   15   16   18   19   37   56 
LCS_GDT     K     8_A     K     8_A      3    4   16      0    3    3    4    5    6    9   10   12   13   13   14   17   24   27   43   55   58   78   86 
LCS_GDT     D     9_A     D     9_A      3    7   17      3    3    3    4    7    8    9   10   12   13   13   15   17   24   33   50   76   83   98  108 
LCS_GDT     G    10_A     G    10_A      5    7   31      3    3    6    6    7    8   12   16   20   28   38   51   58   68   78   91  108  118  124  133 
LCS_GDT     G    11_A     G    11_A      5    7   35      4    4    6    6    9   15   24   29   35   45   51   56   64   76   84   90  105  116  125  131 
LCS_GDT     S    12_A     S    12_A      5    7   35      4    4    6    6    9   12   24   29   33   45   51   56   62   76   86   94  109  118  128  139 
LCS_GDT     D    13_A     D    13_A      5    7   35      4    4    6    6    7   17   23   29   33   38   45   51   56   70   74   89   95  104  109  120 
LCS_GDT     S    14_A     S    14_A      5    7   35      4    4    6   10   15   20   23   29   33   38   45   48   57   68   74   81   92  101  108  114 
LCS_GDT     G    15_A     G    15_A      5    7   36      3    3    6    9   14   21   25   30   34   38   45   47   50   60   69   77   86   91  103  111 
LCS_GDT     G    16_A     G    16_A      3    7   43      3    5    5   10   15   21   25   30   34   38   45   49   55   63   70   79   91  100  104  113 
LCS_GDT     A    17_A     A    17_A      3    7   65      3    4    4    5    7   21   25   30   34   38   45   47   54   60   71   81   92  101  108  115 
LCS_GDT     Q    18_A     Q    18_A      3    7  144      3    3    5   13   16   21   36   45   50   58   64   73   88   96  106  114  125  137  143  145 
LCS_GDT     D    19_A     D    19_A      4   12  144      3    4    9   13   18   28   37   45   50   58   64   73   88   95  106  114  123  136  143  145 
LCS_GDT     G    20_A     G    20_A      4   12  144      3    4    5    7   13   17   21   33   45   54   63   75   88   97  108  120  130  141  143  145 
LCS_GDT     G    21_A     G    21_A      4   13  144      3    4    5   11   18   27   37   45   50   58   64   80   88   97  109  119  131  141  143  145 
LCS_GDT     S    22_A     S    22_A      4   13  144      3    4    7   12   18   28   37   45   50   58   71   87  100  112  126  135  140  141  143  145 
LCS_GDT     L    23_A     L    23_A      7   13  144      4    5    9   13   18   28   37   45   51   58   69   87   97  112  126  135  140  141  143  145 
LCS_GDT     D    24_A     D    24_A      7   13  144      4    7    9   13   18   28   37   45   50   58   68   84   97  112  126  135  140  141  143  145 
LCS_GDT     S    25_A     S    25_A      7   13  144      4    7    9   13   23   30   36   47   69   84  103  122  127  130  132  135  140  141  143  145 
LCS_GDT     L    26_A     L    26_A      7   13  144      5    7    9   16   23   33   48   66   81  108  119  123  127  130  132  135  140  141  143  145 
LCS_GDT     K    27_A     K    27_A      7   13  144      5    7    9   13   23   30   37   47   61   75   89  103  116  129  132  135  140  141  143  145 
LCS_GDT     K    28_A     K    28_A      7   13  144      5    7    9   13   22   30   37   47   61   76   89  107  116  130  132  135  140  141  143  145 
LCS_GDT     Y    29_A     Y    29_A      7   13  144      5    7    9   15   22   29   40   53   66   81   97  112  126  130  132  135  140  141  143  145 
LCS_GDT     N    30_A     N    30_A      7   13  144      5    7    9   12   15   26   37   47   54   63   76   88  104  115  127  135  140  141  143  145 
LCS_GDT     G    31_A     G    31_A      3   13  144      3    3    4    6   11   28   36   45   50   57   64   72   88   96  108  115  130  141  143  145 
LCS_GDT     K    32_A     K    32_A      3   13  144      3    4    8   13   17   28   37   45   50   62   77   87  101  114  128  135  140  141  143  145 
LCS_GDT     L    33_A     L    33_A      4   13  144      3    3    9   15   23   30   45   61   75   93  110  123  127  130  132  135  140  141  143  145 
LCS_GDT     P    34_A     P    34_A      4   13  144      3    4    5   14   22   27   37   48   62   76   95  111  126  130  132  135  140  141  143  145 
LCS_GDT     K    35_A     K    35_A      6   12  144      3    4    9   15   22   27   37   47   62   81   94  111  124  130  132  135  140  141  143  145 
LCS_GDT     H    36_A     H    36_A      6   12  144      3    5    9   15   22   27   37   52   66   81  101  118  127  130  132  135  140  141  143  145 
LCS_GDT     D    37_A     D    37_A      6   12  144      4    4    9   15   22   33   46   63   77  106  118  123  127  130  132  135  140  141  143  145 
LCS_GDT     P    38_A     P    38_A      6   12  144      4    4    9   21   23   31   45   63   80  106  118  123  127  130  132  135  140  141  143  145 
LCS_GDT     S    39_A     S    39_A      6   12  144      4    5    9   14   31   50   63   90  111  120  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     F    40_A     F    40_A      6   12  144      4    5   25   32   47   71  108  112  118  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     V    41_A     V    41_A      5   91  144      3    4    5   16   24   65   80  111  117  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     Q    42_A     Q    42_A      5   94  144      3   24   44   65   96  104  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     P    43_A     P    43_A      5   94  144      4   24   50   69   96  104  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     G    44_A     G    44_A      5   94  144      7   28   49   61   80  102  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     N    45_A     N    45_A      5   94  144      4    5   13   18   56   87  108  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     R    46_A     R    46_A      5  116  144      4    9   22   27   71  103  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     H    47_A     H    47_A     12  116  144      4    7   15   34   93  104  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     Y    48_A     Y    48_A     22  116  144      4    5   54   90  102  105  109  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     K    49_A     K    49_A     22  116  144     10   47   79   91  102  105  109  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     Y    50_A     Y    50_A     22  116  144      5   38   73   90  102  105  109  115  120  121  122  123  125  128  131  135  140  140  143  145 
LCS_GDT     Q    51_A     Q    51_A     22  116  144     10   47   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     C    52_A     C    52_A     22  116  144     17   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     T    53_A     T    53_A     22  116  144     21   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     W    54_A     W    54_A     22  116  144     21   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     Y    55_A     Y    55_A     22  116  144     21   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     A    56_A     A    56_A     22  116  144     10   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     Y    57_A     Y    57_A     22  116  144     17   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     N    58_A     N    58_A     22  116  144     21   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     R    59_A     R    59_A     22  116  144     10   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     R    60_A     R    60_A     22  116  144     10   48   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     G    61_A     G    61_A     22  116  144     14   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     Q    62_A     Q    62_A     22  116  144     10   32   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     L    63_A     L    63_A     22  116  144     10   31   77   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     G    64_A     G    64_A     22  116  144     10   33   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     I    65_A     I    65_A     22  116  144     11   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     P    66_A     P    66_A     22  116  144     19   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     V    67_A     V    67_A     22  116  144      8   53   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     P    68_A     P    68_A     22  116  144      8   45   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     L    69_A     L    69_A     22  116  144     10   19   34   81  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     W    70_A     W    70_A     23  116  144      3    4   18   73  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     G    71_A     G    71_A     31  116  144     10   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     D    72_A     D    72_A     31  116  144     21   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     A    73_A     A    73_A     31  116  144     21   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     A    74_A     A    74_A     31  116  144     21   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     D    75_A     D    75_A     31  116  144     21   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     W    76_A     W    76_A     31  116  144     13   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     I    77_A     I    77_A     31  116  144     10   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     G    78_A     G    78_A     31  116  144     17   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     G    79_A     G    79_A     31  116  144     17   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     A    80_A     A    80_A     31  116  144      8   26   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     K    81_A     K    81_A     31  116  144      6   23   70   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     G    82_A     G    82_A     31  116  144     14   50   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     A    83_A     A    83_A     31  116  144     17   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     G    84_A     G    84_A     31  116  144     18   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     Y    85_A     Y    85_A     31  116  144     18   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     G    86_A     G    86_A     31  116  144     14   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     V    87_A     V    87_A     31  116  144     20   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     G    88_A     G    88_A     31  116  144     21   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     R    89_A     R    89_A     31  116  144     21   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     T    90_A     T    90_A     31  116  144     21   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     P    91_A     P    91_A     31  116  144      6   34   72   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     K    92_A     K    92_A     31  116  144     20   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     Q    93_A     Q    93_A     31  116  144     15   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     G    94_A     G    94_A     31  116  144     10   40   73   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     A    95_A     A    95_A     31  116  144     20   51   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     C    96_A     C    96_A     31  116  144     20   51   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     V    97_A     V    97_A     31  116  144     21   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     I    98_A     I    98_A     31  116  144     21   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     W    99_A     W    99_A     31  116  144     21   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     Q   100_A     Q   100_A     31  116  144     14   54   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     R   101_A     R   101_A     31  116  144     13   44   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     G   102_A     G   102_A     18  116  144      4   29   74   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     V   103_A     V   103_A     18  116  144      5   25   76   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     Q   104_A     Q   104_A     18  116  144      4   12   20   54   95  105  109  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     G   105_A     G   105_A     15  116  144      3   13   22   48   63   98  109  114  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     G   106_A     G   106_A     24  116  144      3   13   66   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     S   107_A     S   107_A     24  116  144      4    6   50   88  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     P   108_A     P   108_A     24  116  144      4    8   50   88  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     Q   109_A     Q   109_A     24  116  144      4   36   72   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     Y   110_A     Y   110_A     24  116  144      3   35   72   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     G   111_A     G   111_A     24  116  144     19   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     H   112_A     H   112_A     24  116  144     19   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     V   113_A     V   113_A     24  116  144     17   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     A   114_A     A   114_A     24  116  144     15   55   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     F   115_A     F   115_A     24  116  144     18   51   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     V   116_A     V   116_A     24  116  144     20   51   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     E   117_A     E   117_A     24  116  144     18   51   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     K   118_A     K   118_A     24  116  144     20   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     V   119_A     V   119_A     24  116  144     21   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     L   120_A     L   120_A     24  116  144     14   53   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     D   121_A     D   121_A     24  116  144     14   55   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     G   122_A     G   122_A     24  116  144     17   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  140  143  145 
LCS_GDT     G   123_A     G   123_A     24  116  144     21   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     K   124_A     K   124_A     24  116  144     21   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     K   125_A     K   125_A     24  116  144     21   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     I   126_A     I   126_A     24  116  144     21   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     F   127_A     F   127_A     24  116  144     20   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     I   128_A     I   128_A     24  116  144     20   42   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     S   129_A     S   129_A     24  116  144     14   42   75   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     E   130_A     E   130_A     24  116  144      5   31   50   87  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     H   131_A     H   131_A     19  116  144      4   15   33   59   90  102  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     N   132_A     N   132_A     19  116  144      3   15   33   59   90  102  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     Y   133_A     Y   133_A      9  116  144      3    8   13   58   79  102  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     A   134_A     A   134_A      9  116  144      3    8   33   90  102  104  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     T   135_A     T   135_A      6  116  144      3   12   29   76   96  104  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     P   136_A     P   136_A      6  116  144      3    4   40   52   72   96  107  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     N   137_A     N   137_A      9  116  144      3    6    9   19   42   52   72   93  110  116  121  123  125  128  132  135  140  141  143  145 
LCS_GDT     G   138_A     G   138_A     20  116  144      3   10   39   52   72   94  107  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     Y   139_A     Y   139_A     21  116  144     14   38   53   83   98  104  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     G   140_A     G   140_A     21  116  144     17   42   61   89  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     T   141_A     T   141_A     21  116  144     20   42   76   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     R   142_A     R   142_A     21  116  144     20   42   77   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     T   143_A     T   143_A     21  116  144     20   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     I   144_A     I   144_A     21  116  144     20   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     D   145_A     D   145_A     21  116  144     21   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     M   146_A     M   146_A     21  116  144     21   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     S   147_A     S   147_A     21  116  144     21   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     S   148_A     S   148_A     21  116  144     20   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     A   149_A     A   149_A     21  116  144     14   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     I   150_A     I   150_A     21  116  144     20   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     G   151_A     G   151_A     21  116  144     16   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     K   152_A     K   152_A     21  116  144     20   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     N   153_A     N   153_A     21  116  144      8   35   63   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     A   154_A     A   154_A     21  116  144      6   32   67   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     Q   155_A     Q   155_A     21  116  144     11   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     F   156_A     F   156_A     21  116  144     21   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     I   157_A     I   157_A     21  116  144     19   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     Y   158_A     Y   158_A     21  116  144     16   58   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     D   159_A     D   159_A     21  116  144     11   56   79   91  102  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     K   160_A     K   160_A     21  116  144      4   13   52   85  100  105  110  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     K   161_A     K   161_A      5  116  144      4   25   52   82   96  105  109  115  120  121  122  123  127  130  132  135  140  141  143  145 
LCS_GDT     K   162_A     K   162_A      5  116  144      3   13   22   72   89  105  109  115  120  121  122  123  125  128  132  135  140  141  143  145 
LCS_GDT     N   163_A     N   163_A      6    6  144      3    5    5    9   11   11   14   21   23   77   91  111  120  121  122  123  125  127  129  136 
LCS_GDT     S   164_A     S   164_A      6    6  144      3    3    5    7    9   11   12   13   15   17   27   31   39   63  107  121  123  125  127  128 
LCS_GDT     S   165_A     S   165_A      6    6  143      3    5    5    6    8   11   12   13   18   22   27   36   70  108  117  121  124  125  127  128 
LCS_GDT     S   166_A     S   166_A      6    8  142      3    5    6    9   15   21   27   41   57   80   99  111  116  119  121  123  125  130  136  139 
LCS_GDT     V   167_A     V   167_A      6    8  139      3    5    5    6   11   17   21   27   36   46   58   75   89  100  110  117  118  120  124  136 
LCS_GDT     D   168_A     D   168_A      6    8  138      3    5    5    7   11   15   19   22   27   32   39   50   57   66   80   92  102  111  118  120 
LCS_GDT     K   169_A     K   169_A      4    8  136      4    4    4    5    9   17   19   22   26   32   37   42   46   55   63   75   85   92   99  108 
LCS_GDT     L   170_A     L   170_A      4    8  132      4    4    5    6    8   11   19   21   23   31   35   37   40   46   50   56   62   66   72   80 
LCS_GDT     A   171_A     A   171_A      4    8   23      4    4    5    6    8   11   12   13   14   14   17   20   25   34   39   44   49   58   68   72 
LCS_GDT     A   172_A     A   172_A      5    8   22      4    4    5    6    8   11   12   13   14   15   20   23   31   34   39   52   58   64   71   78 
LCS_GDT     A   173_A     A   173_A      5    8   22      3    4    5    6    8   11   12   13   14   16   20   23   28   34   39   41   47   49   51   68 
LCS_GDT     L   174_A     L   174_A      5    7   19      3    4    5    5    8   11   12   13   14   14   16   18   22   26   28   29   31   34   38   56 
LCS_GDT     E   175_A     E   175_A      5    7   19      3    4    5    6    8   11   12   13   14   16   18   20   23   26   28   29   31   34   38   40 
LCS_GDT     H   176_A     H   176_A      5    6   19      3    4    5    6    7    9   10   11   14   14   17   19   25   26   28   29   31   34   51   56 
LCS_AVERAGE  LCS_A:  43.17  (   9.73   46.88   72.90 )

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     21     58     79     91    102    105    110    115    120    121    122    123    127    130    132    135    140    141    143    145 
GDT PERCENT_AT  11.93  32.95  44.89  51.70  57.95  59.66  62.50  65.34  68.18  68.75  69.32  69.89  72.16  73.86  75.00  76.70  79.55  80.11  81.25  82.39
GDT RMS_LOCAL    0.33   0.71   0.92   1.09   1.32   1.45   1.71   1.81   2.03   2.10   2.17   2.27   3.05   3.43   3.51   3.79   4.38   4.74   4.76   5.00
GDT RMS_ALL_AT  12.99  12.71  12.77  12.75  12.81  12.76  12.64  12.68  12.58  12.57  12.57  12.55  12.29  12.18  12.14  12.03  11.82  11.71  11.73  11.68

# Checking swapping
#   possible swapping detected:  D     7_A      D     7_A
#   possible swapping detected:  D    24_A      D    24_A
#   possible swapping detected:  Y    29_A      Y    29_A
#   possible swapping detected:  D    37_A      D    37_A
#   possible swapping detected:  Y    50_A      Y    50_A
#   possible swapping detected:  D    72_A      D    72_A
#   possible swapping detected:  Y    85_A      Y    85_A
#   possible swapping detected:  E   130_A      E   130_A
#   possible swapping detected:  D   145_A      D   145_A
#   possible swapping detected:  Y   158_A      Y   158_A
#   possible swapping detected:  E   175_A      E   175_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    M     1_A      M     1_A    24.056     0    0.408   1.258    25.544    0.000    0.000
LGA    E     2_A      E     2_A    25.935     0    0.112   1.097    32.552    0.000    0.000
LGA    Q     3_A      Q     3_A    25.315     0    0.615   1.169    28.348    0.000    0.000
LGA    S     4_A      S     4_A    28.181     0    0.288   0.376    31.367    0.000    0.000
LGA    S     5_A      S     5_A    29.744     0    0.078   0.640    31.582    0.000    0.000
LGA    G     6_A      G     6_A    29.708     0    0.598   0.598    30.539    0.000    0.000
LGA    D     7_A      D     7_A    25.871     0    0.649   1.196    26.635    0.000    0.000
LGA    K     8_A      K     8_A    24.127     0    0.681   0.900    25.917    0.000    0.000
LGA    D     9_A      D     9_A    24.639     0    0.653   1.194    25.504    0.000    0.000
LGA    G    10_A      G    10_A    25.709     0    0.237   0.237    27.703    0.000    0.000
LGA    G    11_A      G    11_A    25.856     0    0.216   0.216    25.856    0.000    0.000
LGA    S    12_A      S    12_A    22.489     0    0.055   0.647    23.743    0.000    0.000
LGA    D    13_A      D    13_A    27.185     0    0.011   0.813    29.238    0.000    0.000
LGA    S    14_A      S    14_A    28.585     0    0.182   0.639    29.412    0.000    0.000
LGA    G    15_A      G    15_A    25.588     0    0.334   0.334    26.055    0.000    0.000
LGA    G    16_A      G    16_A    23.655     0    0.658   0.658    24.405    0.000    0.000
LGA    A    17_A      A    17_A    22.420     0    0.444   0.484    24.357    0.000    0.000
LGA    Q    18_A      Q    18_A    19.360     0    0.730   1.556    24.662    0.000    0.000
LGA    D    19_A      D    19_A    19.042     0    0.064   1.045    23.543    0.000    0.000
LGA    G    20_A      G    20_A    17.631     0    0.557   0.557    17.961    0.000    0.000
LGA    G    21_A      G    21_A    18.089     0    0.137   0.137    18.089    0.000    0.000
LGA    S    22_A      S    22_A    14.663     0    0.649   0.779    15.305    0.000    0.000
LGA    L    23_A      L    23_A    14.191     0    0.491   1.475    17.031    0.000    0.000
LGA    D    24_A      D    24_A    15.338     0    0.046   1.378    19.762    0.000    0.000
LGA    S    25_A      S    25_A    10.848     0    0.611   0.551    12.270    0.000    0.238
LGA    L    26_A      L    26_A    10.785     0    0.041   0.128    12.760    0.000    2.083
LGA    K    27_A      K    27_A    14.965     0    0.038   1.100    20.018    0.000    0.000
LGA    K    28_A      K    28_A    15.263     0    0.027   0.909    15.638    0.000    0.000
LGA    Y    29_A      Y    29_A    14.198     0    0.016   0.109    15.584    0.000    0.198
LGA    N    30_A      N    30_A    17.450     0    0.351   1.330    18.889    0.000    0.000
LGA    G    31_A      G    31_A    19.206     0    0.020   0.020    19.206    0.000    0.000
LGA    K    32_A      K    32_A    16.658     0    0.591   1.052    17.314    0.000    0.000
LGA    L    33_A      L    33_A    11.944     0    0.185   0.321    13.204    0.000    0.000
LGA    P    34_A      P    34_A    12.495     0    0.078   0.125    12.579    0.000    0.000
LGA    K    35_A      K    35_A    13.330     0    0.685   1.165    16.328    0.000    0.000
LGA    H    36_A      H    36_A    11.923     0    0.511   1.159    14.165    0.000    0.000
LGA    D    37_A      D    37_A    11.088     0    0.088   1.148    14.314    0.714    0.357
LGA    P    38_A      P    38_A    10.834     0    0.029   0.275    13.481    0.476    0.272
LGA    S    39_A      S    39_A     8.713     0    0.014   0.230     9.536    6.667    5.397
LGA    F    40_A      F    40_A     6.377     0    0.579   1.171     8.493   20.000   14.935
LGA    V    41_A      V    41_A     6.589     0    0.036   1.050    10.324   15.357   10.884
LGA    Q    42_A      Q    42_A     3.857     0    0.058   1.013     5.817   35.833   36.878
LGA    P    43_A      P    43_A     3.775     0    0.608   0.579     3.775   46.667   48.095
LGA    G    44_A      G    44_A     4.605     0    0.200   0.200     4.933   31.429   31.429
LGA    N    45_A      N    45_A     4.799     0    0.498   1.274     8.759   38.929   24.345
LGA    R    46_A      R    46_A     4.318     0    0.175   0.866    12.392   38.810   18.615
LGA    H    47_A      H    47_A     3.085     0    0.032   0.232     7.306   61.548   37.429
LGA    Y    48_A      Y    48_A     2.979     0    0.203   0.333     8.967   60.952   30.079
LGA    K    49_A      K    49_A     2.430     0    0.040   0.792     5.820   59.048   46.085
LGA    Y    50_A      Y    50_A     3.118     0    0.054   1.099     5.214   53.571   53.611
LGA    Q    51_A      Q    51_A     2.088     0    0.066   0.764     4.118   68.810   60.265
LGA    C    52_A      C    52_A     1.360     0    0.018   0.219     1.624   79.286   80.000
LGA    T    53_A      T    53_A     0.901     0    0.014   1.012     2.681   88.214   80.748
LGA    W    54_A      W    54_A     1.166     0    0.026   1.451     6.308   81.429   60.068
LGA    Y    55_A      Y    55_A     1.130     0    0.076   1.362     9.515   81.429   48.095
LGA    A    56_A      A    56_A     1.427     0    0.022   0.025     1.598   81.429   79.714
LGA    Y    57_A      Y    57_A     1.130     0    0.022   1.475     8.406   81.429   53.373
LGA    N    58_A      N    58_A     0.878     0    0.036   0.958     4.276   90.476   75.476
LGA    R    59_A      R    59_A     1.332     0    0.107   1.108     4.515   77.143   69.394
LGA    R    60_A      R    60_A     1.710     0    0.051   1.031     3.540   77.143   70.563
LGA    G    61_A      G    61_A     0.789     0    0.063   0.063     1.107   85.952   85.952
LGA    Q    62_A      Q    62_A     1.745     0    0.119   1.123     5.780   75.000   59.630
LGA    L    63_A      L    63_A     1.979     0    0.018   0.193     2.137   70.833   68.810
LGA    G    64_A      G    64_A     1.640     0    0.090   0.090     1.780   77.143   77.143
LGA    I    65_A      I    65_A     1.220     0    0.054   0.972     3.110   81.429   72.321
LGA    P    66_A      P    66_A     0.629     0    0.103   0.242     2.049   84.167   85.714
LGA    V    67_A      V    67_A     1.222     0    0.152   1.114     2.876   81.548   76.803
LGA    P    68_A      P    68_A     1.142     0    0.071   0.271     1.738   77.143   77.755
LGA    L    69_A      L    69_A     2.356     0    0.500   0.544     5.514   69.048   51.369
LGA    W    70_A      W    70_A     2.424     0    0.568   1.118    11.529   65.595   29.354
LGA    G    71_A      G    71_A     0.600     0    0.381   0.381     1.614   86.071   86.071
LGA    D    72_A      D    72_A     0.370     0    0.042   0.525     1.411   95.238   90.595
LGA    A    73_A      A    73_A     0.723     0    0.053   0.051     0.786   90.476   90.476
LGA    A    74_A      A    74_A     0.728     0    0.087   0.092     0.904   90.476   90.476
LGA    D    75_A      D    75_A     0.490     0    0.030   0.371     1.382   92.857   92.917
LGA    W    76_A      W    76_A     1.083     0    0.021   1.565     5.397   83.690   67.245
LGA    I    77_A      I    77_A     1.363     0    0.019   0.653     1.869   79.286   79.286
LGA    G    78_A      G    78_A     1.273     0    0.012   0.012     1.470   81.429   81.429
LGA    G    79_A      G    79_A     1.281     0    0.090   0.090     1.409   81.429   81.429
LGA    A    80_A      A    80_A     1.972     0    0.014   0.024     2.350   72.857   71.238
LGA    K    81_A      K    81_A     2.178     0    0.021   1.085     3.229   66.786   65.238
LGA    G    82_A      G    82_A     1.507     0    0.012   0.012     1.676   77.143   77.143
LGA    A    83_A      A    83_A     1.399     0    0.019   0.028     1.520   81.429   79.714
LGA    G    84_A      G    84_A     1.183     0    0.013   0.013     1.226   81.429   81.429
LGA    Y    85_A      Y    85_A     1.141     0    0.045   0.239     2.006   81.429   78.651
LGA    G    86_A      G    86_A     1.222     0    0.032   0.032     1.222   85.952   85.952
LGA    V    87_A      V    87_A     0.419     0    0.041   1.131     2.949   97.619   87.279
LGA    G    88_A      G    88_A     0.899     0    0.042   0.042     0.899   95.238   95.238
LGA    R    89_A      R    89_A     1.029     0    0.059   1.495     7.058   81.429   58.225
LGA    T    90_A      T    90_A     1.017     0    0.028   0.047     1.874   81.429   80.204
LGA    P    91_A      P    91_A     1.666     0    0.146   0.178     2.254   79.286   74.218
LGA    K    92_A      K    92_A     0.331     0    0.062   0.678     2.417   92.857   89.735
LGA    Q    93_A      Q    93_A     0.752     0    0.028   0.512     1.593   88.333   84.550
LGA    G    94_A      G    94_A     1.749     0    0.223   0.223     2.910   71.071   71.071
LGA    A    95_A      A    95_A     1.195     0    0.041   0.052     1.424   85.952   85.048
LGA    C    96_A      C    96_A     1.148     0    0.043   0.847     1.527   85.952   83.016
LGA    V    97_A      V    97_A     0.262     0    0.040   1.108     2.502   97.619   88.639
LGA    I    98_A      I    98_A     0.246     0    0.040   0.659     2.093  100.000   93.214
LGA    W    99_A      W    99_A     0.334     0    0.035   0.138     0.954   95.238   95.918
LGA    Q   100_A      Q   100_A     0.951     0    0.061   0.290     1.962   85.952   85.503
LGA    R   101_A      R   101_A     1.389     0    0.108   1.010     6.867   75.119   55.195
LGA    G   102_A      G   102_A     2.502     0    0.181   0.181     4.057   56.071   56.071
LGA    V   103_A      V   103_A     2.654     0    0.126   1.112     4.641   59.048   57.891
LGA    Q   104_A      Q   104_A     3.881     0    0.366   1.187     8.773   36.310   21.534
LGA    G   105_A      G   105_A     4.284     0    0.076   0.076     4.284   40.238   40.238
LGA    G   106_A      G   106_A     2.219     0    0.540   0.540     3.917   57.500   57.500
LGA    S   107_A      S   107_A     2.198     0    0.171   0.699     4.038   66.786   60.238
LGA    P   108_A      P   108_A     2.169     0    0.039   0.256     2.329   64.762   64.762
LGA    Q   109_A      Q   109_A     1.667     0    0.057   0.822     3.872   75.000   71.587
LGA    Y   110_A      Y   110_A     1.764     0    0.612   0.437     3.857   65.476   64.683
LGA    G   111_A      G   111_A     0.845     0    0.085   0.085     1.407   88.214   88.214
LGA    H   112_A      H   112_A     0.762     0    0.061   0.391     2.143   92.857   85.429
LGA    V   113_A      V   113_A     0.870     0    0.026   0.148     1.341   85.952   85.306
LGA    A   114_A      A   114_A     1.193     0    0.054   0.082     1.215   81.429   81.429
LGA    F   115_A      F   115_A     1.129     0    0.034   0.134     1.350   81.429   82.251
LGA    V   116_A      V   116_A     1.133     0    0.014   0.061     1.230   81.429   82.721
LGA    E   117_A      E   117_A     1.252     0    0.057   0.727     1.664   85.952   84.603
LGA    K   118_A      K   118_A     0.661     0    0.137   0.984     5.009   95.238   77.989
LGA    V   119_A      V   119_A     0.463     0    0.063   0.082     0.775   95.238   95.918
LGA    L   120_A      L   120_A     0.811     0    0.414   0.530     3.218   80.476   85.476
LGA    D   121_A      D   121_A     0.882     0    0.309   1.252     5.268   81.786   66.845
LGA    G   122_A      G   122_A     1.275     0    0.271   0.271     2.838   75.476   75.476
LGA    G   123_A      G   123_A     0.454     0    0.202   0.202     0.663   97.619   97.619
LGA    K   124_A      K   124_A     0.529     0    0.082   0.628     2.500   95.238   82.063
LGA    K   125_A      K   125_A     0.112     0    0.080   0.972     2.788  100.000   90.053
LGA    I   126_A      I   126_A     0.392     0    0.095   1.299     4.515   95.238   79.107
LGA    F   127_A      F   127_A     0.688     0    0.057   0.062     1.537   92.857   85.628
LGA    I   128_A      I   128_A     1.186     0    0.130   1.209     4.496   81.548   70.119
LGA    S   129_A      S   129_A     1.598     0    0.140   0.231     2.174   75.000   72.937
LGA    E   130_A      E   130_A     2.221     0    0.083   0.674     5.145   62.976   53.228
LGA    H   131_A      H   131_A     3.855     0    0.415   1.006     7.286   34.524   30.905
LGA    N   132_A      N   132_A     4.191     0    0.399   1.276     9.996   37.500   22.143
LGA    Y   133_A      Y   133_A     3.706     0    0.054   0.219     9.289   46.667   25.476
LGA    A   134_A      A   134_A     2.643     0    0.053   0.054     3.965   66.905   62.190
LGA    T   135_A      T   135_A     3.491     0    0.127   1.082     7.422   52.024   40.136
LGA    P   136_A      P   136_A     5.618     0    0.083   0.384     6.626   20.833   20.544
LGA    N   137_A      N   137_A     8.057     0    0.251   0.979    13.241    8.690    4.524
LGA    G   138_A      G   138_A     5.376     0    0.076   0.076     6.218   26.548   26.548
LGA    Y   139_A      Y   139_A     2.975     0    0.029   1.131     9.665   51.905   32.778
LGA    G   140_A      G   140_A     2.231     0    0.092   0.092     2.470   68.810   68.810
LGA    T   141_A      T   141_A     1.480     0    0.059   0.120     1.736   79.286   80.204
LGA    R   142_A      R   142_A     1.381     0    0.040   1.299     6.248   83.690   60.433
LGA    T   143_A      T   143_A     0.817     0    0.024   0.086     1.027   88.214   89.184
LGA    I   144_A      I   144_A     0.650     0    0.026   0.568     1.620   90.476   88.274
LGA    D   145_A      D   145_A     0.417     0    0.055   0.931     3.120  100.000   83.810
LGA    M   146_A      M   146_A     0.319     0    0.024   0.474     1.804  100.000   94.286
LGA    S   147_A      S   147_A     0.387     0    0.099   0.557     2.134   97.619   92.540
LGA    S   148_A      S   148_A     0.644     0    0.044   0.794     3.505   92.857   84.206
LGA    A   149_A      A   149_A     1.045     0    0.053   0.052     1.354   88.214   86.857
LGA    I   150_A      I   150_A     0.590     0    0.166   1.459     3.425   92.857   79.345
LGA    G   151_A      G   151_A     0.780     0    0.070   0.070     0.956   90.476   90.476
LGA    K   152_A      K   152_A     0.757     0    0.048   1.187     5.754   85.952   73.598
LGA    N   153_A      N   153_A     1.712     0    0.113   0.107     2.737   75.000   68.929
LGA    A   154_A      A   154_A     1.776     0    0.115   0.144     1.820   72.857   72.857
LGA    Q   155_A      Q   155_A     0.954     0    0.033   1.053     4.130   90.595   76.825
LGA    F   156_A      F   156_A     0.297     0    0.008   0.141     2.166  100.000   87.576
LGA    I   157_A      I   157_A     0.635     0    0.071   0.687     2.452   92.857   88.512
LGA    Y   158_A      Y   158_A     1.089     0    0.057   0.427     3.108   83.690   71.310
LGA    D   159_A      D   159_A     1.414     0    0.686   1.153     6.404   81.548   60.595
LGA    K   160_A      K   160_A     2.707     0    0.160   0.791     4.624   51.905   44.021
LGA    K   161_A      K   161_A     3.600     0    0.586   0.998     6.719   43.810   31.958
LGA    K   162_A      K   162_A     4.605     0    0.193   1.160     9.886   21.429   16.878
LGA    N   163_A      N   163_A    11.542     0    0.648   1.177    14.858    0.714    0.357
LGA    S   164_A      S   164_A    14.156     0    0.072   0.803    16.775    0.000    0.000
LGA    S   165_A      S   165_A    14.764     0    0.148   0.690    15.242    0.000    0.000
LGA    S   166_A      S   166_A    14.006     0    0.102   0.211    16.731    0.000    0.000
LGA    V   167_A      V   167_A    18.871     0    0.628   0.966    21.133    0.000    0.000
LGA    D   168_A      D   168_A    21.096     0    0.628   0.901    24.844    0.000    0.000
LGA    K   169_A      K   169_A    24.617     0    0.583   1.067    28.373    0.000    0.000
LGA    L   170_A      L   170_A    28.408     0    0.034   0.119    31.428    0.000    0.000
LGA    A   171_A      A   171_A    28.473     0    0.125   0.128    31.571    0.000    0.000
LGA    A   172_A      A   172_A    30.289     0    0.040   0.048    34.499    0.000    0.000
LGA    A   173_A      A   173_A    36.308     0    0.388   0.408    37.737    0.000    0.000
LGA    L   174_A      L   174_A    39.222     0    0.283   0.307    41.440    0.000    0.000
LGA    E   175_A      E   175_A    43.519     0    0.549   1.263    44.249    0.000    0.000
LGA    H   176_A      H   176_A    44.356     0    0.524   0.955    46.392    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):    10.766         10.807                 10.835           51.996   47.294

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  176  176    4.0    115    1.81    56.676    56.524     6.018

LGA_LOCAL      RMSD:   1.811  Number of atoms:  115  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  12.677  Number of assigned atoms:  176 
Std_ASGN_ATOMS RMSD:  10.766  Standard rmsd on all 176 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.760425 * X  +   0.422762 * Y  +  -0.492977 * Z  + -20.940145
  Y_new =   0.240288 * X  +  -0.888382 * Y  +  -0.391201 * Z  +  -2.442762
  Z_new =  -0.603337 * X  +   0.179022 * Y  +  -0.777133 * Z  +   2.627808 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  0.306063  0.647679  2.915180   [DEG:   17.5361   37.1093  167.0275 ]
ZXZ: -0.900002  2.460894 -1.282351   [DEG:  -51.5663  140.9988  -73.4733 ]
 
# END of job
