
#######################################################
#                                                     #
#                        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:   147      18_A - 164_A       4.76    22.53
  LONGEST_CONTINUOUS_SEGMENT:   147      19_A - 165_A       4.73    22.50
  LONGEST_CONTINUOUS_SEGMENT:   147      20_A - 166_A       4.69    22.46
  LONGEST_CONTINUOUS_SEGMENT:   147      21_A - 167_A       4.83    22.44
  LCS_AVERAGE:     73.59

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   119      42_A - 160_A       1.99    22.65
  LCS_AVERAGE:     53.57

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    64      66_A - 129_A       0.98    22.48
  LONGEST_CONTINUOUS_SEGMENT:    64      67_A - 130_A       0.97    22.42
  LCS_AVERAGE:     19.03

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    6      3    4    4    4    4    4    5    5    5    5    5    5    5    6    6   20   20   23   23   25 
LCS_GDT     E     2_A     E     2_A      4    4   12      3    4    4    4    4    4    5    5    5    5    6   16   17   19   19   21   22   24   24   26 
LCS_GDT     Q     3_A     Q     3_A      4    4   15      3    4    4    4    4    5    5    7    7   10   13   16   17   19   21   22   27   31   39   43 
LCS_GDT     S     4_A     S     4_A      4    4   23      3    4    4    4    4    8    9   12   14   15   17   23   28   31   33   36   36   39   42   44 
LCS_GDT     S     5_A     S     5_A      6    9   23      3    3    6    7    9   11   12   15   18   21   24   25   28   31   33   36   36   39   42   46 
LCS_GDT     G     6_A     G     6_A      6    9   23      4    5    6    7    9   11   12   15   18   20   24   25   28   31   33   36   37   40   44   46 
LCS_GDT     D     7_A     D     7_A      6    9   23      4    5    6    7    9   11   12   15   18   20   24   25   28   31   33   36   36   39   44   46 
LCS_GDT     K     8_A     K     8_A      6    9   23      3    5    6    7    9   11   12   15   18   21   24   25   28   31   33   36   37   40   44   46 
LCS_GDT     D     9_A     D     9_A      6    9   23      4    5    6    7    9   11   12   15   18   21   24   25   28   31   33   36   36   39   42   46 
LCS_GDT     G    10_A     G    10_A      6    9   23      4    5    6    7    9   11   12   15   18   21   24   25   28   31   33   36   36   39   44   46 
LCS_GDT     G    11_A     G    11_A      3    9   23      3    3    5    6    8   10   12   15   18   21   24   25   28   31   33   36   36   39   42   44 
LCS_GDT     S    12_A     S    12_A      3    9   23      3    3    6    7    9   11   12   15   18   21   24   25   28   31   33   36   36   39   42   44 
LCS_GDT     D    13_A     D    13_A      3    9   23      3    3    3    4    7   10   11   14   18   21   24   25   28   31   33   36   37   40   44   46 
LCS_GDT     S    14_A     S    14_A      3    5   23      3    3    3    4    7    9   11   15   18   21   24   25   28   31   33   36   36   39   42   44 
LCS_GDT     G    15_A     G    15_A      6    8   23      3    6    7    8    9   10   11   15   18   21   24   25   28   31   33   36   37   40   44   46 
LCS_GDT     G    16_A     G    16_A      6    8   23      3    6    7    8    9   10   11   15   18   21   24   25   28   31   33   36   36   39   44   46 
LCS_GDT     A    17_A     A    17_A      6    8  145      4    6    7    8    9   10   11   15   18   21   24   24   28   31   33   36   36   39   42   44 
LCS_GDT     Q    18_A     Q    18_A      6    8  147      4    6    7    8    9   10   11   15   18   20   23   25   28   31   33   36   37   43   52   56 
LCS_GDT     D    19_A     D    19_A      6    8  147      4    6    7    8    9   10   11   15   18   21   24   25   28   31   33   36   37   47   70   73 
LCS_GDT     G    20_A     G    20_A      6    8  147      4    6    7    8    9   10   11   13   14   18   21   23   25   43   48   66   78  100  106  117 
LCS_GDT     G    21_A     G    21_A      4    8  147      3    4    5    6    9   10   11   15   18   20   29   60   94  110  119  127  133  139  140  142 
LCS_GDT     S    22_A     S    22_A      3    8  147      3    8   10   16   29   55   81  101  115  123  132  136  137  138  139  140  141  141  141  142 
LCS_GDT     L    23_A     L    23_A     12  108  147      5   11   19   32   98  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     D    24_A     D    24_A     12  108  147      4   20   59   91  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     S    25_A     S    25_A     12  108  147      4   15   37   83  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     L    26_A     L    26_A     12  108  147      6   20   64   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     K    27_A     K    27_A     12  108  147      6   20   61   91  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     K    28_A     K    28_A     12  108  147      6   14   48   80  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     Y    29_A     Y    29_A     12  108  147      6   14   59   80  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     N    30_A     N    30_A     12  108  147      6   33   59   86  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     G    31_A     G    31_A     12  108  147      4   33   59   89  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     K    32_A     K    32_A     12  108  147      5   29   59   83  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     L    33_A     L    33_A     12  108  147      3   35   74   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     P    34_A     P    34_A     12  108  147      3    6   16   44   76  117  126  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     K    35_A     K    35_A     10  108  147      3    8   26   44   73   97  122  131  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     H    36_A     H    36_A     10  108  147      6   13   32   54   83  119  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     D    37_A     D    37_A     10  108  147      6   13   32   54   89  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     P    38_A     P    38_A     10  108  147      6   13   23   45   87  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     S    39_A     S    39_A     10  108  147      6   13   22   59   93  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     F    40_A     F    40_A     10  108  147      6   13   22   59  103  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     V    41_A     V    41_A     10  108  147      6   12   22   44   87  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     Q    42_A     Q    42_A     10  119  147      5   36   68   95  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     P    43_A     P    43_A     10  119  147      4   16   58   86  104  119  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     G    44_A     G    44_A      6  119  147      4    9   23   43   88  115  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     N    45_A     N    45_A      5  119  147      3   21   36   63   97  114  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     R    46_A     R    46_A      5  119  147      3   20   67   96  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     H    47_A     H    47_A      5  119  147      3    9   58   94  109  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     Y    48_A     Y    48_A     14  119  147      3   21   74   96  109  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     K    49_A     K    49_A     14  119  147      3   17   58   96  109  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     Y    50_A     Y    50_A     14  119  147      4    9   54   93  104  114  126  131  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     Q    51_A     Q    51_A     43  119  147      9   51   83   96  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     C    52_A     C    52_A     43  119  147     26   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     T    53_A     T    53_A     43  119  147     27   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     W    54_A     W    54_A     43  119  147     27   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     Y    55_A     Y    55_A     43  119  147     27   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     A    56_A     A    56_A     43  119  147     27   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     Y    57_A     Y    57_A     43  119  147     27   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     N    58_A     N    58_A     43  119  147     27   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     R    59_A     R    59_A     43  119  147     18   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     R    60_A     R    60_A     43  119  147      8   51   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     G    61_A     G    61_A     43  119  147     20   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     Q    62_A     Q    62_A     43  119  147      8   18   61   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     L    63_A     L    63_A     43  119  147      8   18   26   89  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     G    64_A     G    64_A     53  119  147      8   38   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     I    65_A     I    65_A     53  119  147      8   42   83   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     P    66_A     P    66_A     64  119  147     10   41   72   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     V    67_A     V    67_A     64  119  147     10   41   78   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     P    68_A     P    68_A     64  119  147     10   47   83   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     L    69_A     L    69_A     64  119  147     10   64   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     W    70_A     W    70_A     64  119  147     12   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     G    71_A     G    71_A     64  119  147     10   54   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     D    72_A     D    72_A     64  119  147     25   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     A    73_A     A    73_A     64  119  147     26   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     A    74_A     A    74_A     64  119  147     27   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     D    75_A     D    75_A     64  119  147     27   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     W    76_A     W    76_A     64  119  147     27   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     I    77_A     I    77_A     64  119  147     27   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     G    78_A     G    78_A     64  119  147     27   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     G    79_A     G    79_A     64  119  147     27   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     A    80_A     A    80_A     64  119  147     25   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     K    81_A     K    81_A     64  119  147     20   67   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     G    82_A     G    82_A     64  119  147     27   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     A    83_A     A    83_A     64  119  147     27   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     G    84_A     G    84_A     64  119  147     27   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     Y    85_A     Y    85_A     64  119  147     27   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     G    86_A     G    86_A     64  119  147     20   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     V    87_A     V    87_A     64  119  147     27   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     G    88_A     G    88_A     64  119  147     27   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     R    89_A     R    89_A     64  119  147     27   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     T    90_A     T    90_A     64  119  147     27   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     P    91_A     P    91_A     64  119  147     26   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     K    92_A     K    92_A     64  119  147     25   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     Q    93_A     Q    93_A     64  119  147     25   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     G    94_A     G    94_A     64  119  147     26   55   87   96  106  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     A    95_A     A    95_A     64  119  147     24   60   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     C    96_A     C    96_A     64  119  147     26   60   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     V    97_A     V    97_A     64  119  147     27   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     I    98_A     I    98_A     64  119  147     26   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     W    99_A     W    99_A     64  119  147     26   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     Q   100_A     Q   100_A     64  119  147     26   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     R   101_A     R   101_A     64  119  147     26   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     G   102_A     G   102_A     64  119  147     27   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     V   103_A     V   103_A     64  119  147     27   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     Q   104_A     Q   104_A     64  119  147     27   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     G   105_A     G   105_A     64  119  147     25   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     G   106_A     G   106_A     64  119  147     24   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     S   107_A     S   107_A     64  119  147     10   57   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     P   108_A     P   108_A     64  119  147     10   51   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     Q   109_A     Q   109_A     64  119  147     12   60   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     Y   110_A     Y   110_A     64  119  147     26   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     G   111_A     G   111_A     64  119  147     26   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     H   112_A     H   112_A     64  119  147     26   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     V   113_A     V   113_A     64  119  147     26   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     A   114_A     A   114_A     64  119  147     26   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     F   115_A     F   115_A     64  119  147     26   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     V   116_A     V   116_A     64  119  147     26   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     E   117_A     E   117_A     64  119  147     26   64   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     K   118_A     K   118_A     64  119  147     26   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     V   119_A     V   119_A     64  119  147     26   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     L   120_A     L   120_A     64  119  147     26   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     D   121_A     D   121_A     64  119  147     25   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     G   122_A     G   122_A     64  119  147     21   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     G   123_A     G   123_A     64  119  147     26   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     K   124_A     K   124_A     64  119  147     25   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     K   125_A     K   125_A     64  119  147     26   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     I   126_A     I   126_A     64  119  147     26   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     F   127_A     F   127_A     64  119  147     26   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     I   128_A     I   128_A     64  119  147     26   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     S   129_A     S   129_A     64  119  147     25   58   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     E   130_A     E   130_A     64  119  147      5   33   66   93  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     H   131_A     H   131_A     60  119  147      5   11   29   47   79   99  125  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     N   132_A     N   132_A      8  119  147      6   13   23   41   64   97  125  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     Y   133_A     Y   133_A      7  119  147      6    8   19   34   87  112  126  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     A   134_A     A   134_A      7  119  147      5    8   33   93  109  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     T   135_A     T   135_A      7  119  147      7   32   75   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     P   136_A     P   136_A      7  119  147      4   11   36   58   82  105  119  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     N   137_A     N   137_A      8  119  147      4    7   10   11   22   39   57   72   85  115  127  130  138  139  139  140  141  141  141  142 
LCS_GDT     G   138_A     G   138_A     18  119  147      4    9   21   42   63   76  112  119  127  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     Y   139_A     Y   139_A     21  119  147      6   34   58   81   95  107  120  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     G   140_A     G   140_A     21  119  147      6   42   63   92  103  114  125  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     T   141_A     T   141_A     21  119  147     19   57   87   96  109  119  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     R   142_A     R   142_A     21  119  147     26   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     T   143_A     T   143_A     21  119  147     26   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     I   144_A     I   144_A     21  119  147     27   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     D   145_A     D   145_A     21  119  147     24   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     M   146_A     M   146_A     21  119  147     27   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     S   147_A     S   147_A     21  119  147     24   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     S   148_A     S   148_A     21  119  147     26   60   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     A   149_A     A   149_A     21  119  147     24   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     I   150_A     I   150_A     21  119  147     27   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     G   151_A     G   151_A     21  119  147     27   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     K   152_A     K   152_A     21  119  147     23   65   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     N   153_A     N   153_A     21  119  147     19   64   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     A   154_A     A   154_A     21  119  147     19   66   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     Q   155_A     Q   155_A     21  119  147     26   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     F   156_A     F   156_A     21  119  147     27   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     I   157_A     I   157_A     21  119  147     27   68   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     Y   158_A     Y   158_A     21  119  147     19   66   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     D   159_A     D   159_A     21  119  147      3   51   87   97  110  120  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     K   160_A     K   160_A     21  119  147      5   31   83   96  105  118  127  132  136  136  137  137  138  139  139  140  141  141  141  142 
LCS_GDT     K   161_A     K   161_A      4  113  147      5   16   34   57   63   75   90  102  112  120  128  134  137  139  139  140  141  141  141  142 
LCS_GDT     K   162_A     K   162_A      5    7  147      3    5   19   23   42   60   72   83   94  102  113  120  127  131  136  140  141  141  141  142 
LCS_GDT     N   163_A     N   163_A      5    7  147      3    4    6    7    9   24   45   59   65   71   86   97  102  107  117  128  131  134  138  141 
LCS_GDT     S   164_A     S   164_A      5    7  147      3    5    6    7    9   12   14   15   16   26   35   40   69   73   86   93   98  105  110  118 
LCS_GDT     S   165_A     S   165_A      5    7  147      3    5    6    7    9   12   14   15   16   18   24   27   29   31   40   43   50   75   95  103 
LCS_GDT     S   166_A     S   166_A      5    7  147      3    5    6    7    9   10   14   15   16   44   59   66   73   79   81   93   98  106  116  125 
LCS_GDT     V   167_A     V   167_A      4    7  147      3    4    6    7    8   10   13   21   25   31   37   42   50   62   66   72   80   91  100  113 
LCS_GDT     D   168_A     D   168_A      6    7  133      4    5    6    7    7    9   11   13   17   20   31   36   43   48   56   63   69   76   88   96 
LCS_GDT     K   169_A     K   169_A      6    7   22      4    5    6    7    8    9   11   12   15   22   31   36   43   48   56   63   69   76   87   96 
LCS_GDT     L   170_A     L   170_A      6    7   16      4    5    6    7    8    9   11   12   15   15   17   19   21   24   27   29   38   44   52   55 
LCS_GDT     A   171_A     A   171_A      6    7   16      4    5    6    7    8    9   11   12   15   15   17   19   23   24   27   29   32   35   38   40 
LCS_GDT     A   172_A     A   172_A      6    7   16      4    5    6    7    8    9   11   13   17   18   18   21   23   26   28   31   36   38   40   42 
LCS_GDT     A   173_A     A   173_A      6    7   16      4    5    6    7    8    9   11   12   15   15   17   19   21   24   27   29   30   35   38   50 
LCS_GDT     L   174_A     L   174_A      5    7   16      3    4    5    7    8    9   11   12   15   15   17   19   21   23   26   28   30   32   33   35 
LCS_GDT     E   175_A     E   175_A      4    5   16      3    4    4    4    5    9   10   12   15   15   17   19   21   24   27   29   30   35   38   40 
LCS_GDT     H   176_A     H   176_A      4    5   16      0    4    4    4    5    9    9   12   13   13   15   16   19   24   27   29   30   44   47   50 
LCS_AVERAGE  LCS_A:  48.73  (  19.03   53.57   73.59 )

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     27     68     87     97    110    120    127    132    136    136    137    137    138    139    139    140    141    141    141    142 
GDT PERCENT_AT  15.34  38.64  49.43  55.11  62.50  68.18  72.16  75.00  77.27  77.27  77.84  77.84  78.41  78.98  78.98  79.55  80.11  80.11  80.11  80.68
GDT RMS_LOCAL    0.31   0.66   0.84   1.09   1.46   1.72   1.84   1.98   2.11   2.11   2.17   2.17   2.29   2.40   2.39   2.50   2.66   2.66   2.66   2.89
GDT RMS_ALL_AT  22.65  22.40  22.37  22.59  22.82  23.07  23.06  23.07  23.09  23.09  23.06  23.06  23.03  22.99  23.00  22.97  22.92  22.92  22.92  22.88

# Checking swapping
#   possible swapping detected:  E     2_A      E     2_A
#   possible swapping detected:  D     7_A      D     7_A
#   possible swapping detected:  D    13_A      D    13_A
#   possible swapping detected:  Y    48_A      Y    48_A
#   possible swapping detected:  Y    55_A      Y    55_A
#   possible swapping detected:  Y    57_A      Y    57_A
#   possible swapping detected:  D    72_A      D    72_A
#   possible swapping detected:  Y    85_A      Y    85_A
#   possible swapping detected:  Y   110_A      Y   110_A
#   possible swapping detected:  F   115_A      F   115_A
#   possible swapping detected:  E   117_A      E   117_A
#   possible swapping detected:  F   127_A      F   127_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:  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    97.088     0    0.044   0.998   103.812    0.000    0.000
LGA    E     2_A      E     2_A    92.126     0    0.207   1.182    95.954    0.000    0.000
LGA    Q     3_A      Q     3_A    88.803     0    0.462   0.901    89.540    0.000    0.000
LGA    S     4_A      S     4_A    84.206     0    0.575   0.664    85.884    0.000    0.000
LGA    S     5_A      S     5_A    82.141     0    0.589   0.937    82.797    0.000    0.000
LGA    G     6_A      G     6_A    76.956     0    0.493   0.493    78.711    0.000    0.000
LGA    D     7_A      D     7_A    74.487     0    0.034   1.084    78.173    0.000    0.000
LGA    K     8_A      K     8_A    67.213     0    0.144   0.902    69.913    0.000    0.000
LGA    D     9_A      D     9_A    63.863     0    0.069   1.225    65.662    0.000    0.000
LGA    G    10_A      G    10_A    58.064     0    0.381   0.381    60.610    0.000    0.000
LGA    G    11_A      G    11_A    55.962     0    0.621   0.621    56.788    0.000    0.000
LGA    S    12_A      S    12_A    51.804     0    0.592   0.708    53.664    0.000    0.000
LGA    D    13_A      D    13_A    45.815     0    0.477   0.792    48.359    0.000    0.000
LGA    S    14_A      S    14_A    45.132     0    0.367   0.732    46.625    0.000    0.000
LGA    G    15_A      G    15_A    41.807     0    0.102   0.102    43.069    0.000    0.000
LGA    G    16_A      G    16_A    37.337     0    0.131   0.131    39.089    0.000    0.000
LGA    A    17_A      A    17_A    33.205     0    0.120   0.147    34.872    0.000    0.000
LGA    Q    18_A      Q    18_A    26.389     0    0.263   1.415    29.571    0.000    0.000
LGA    D    19_A      D    19_A    22.888     0    0.596   0.949    24.081    0.000    0.000
LGA    G    20_A      G    20_A    18.618     0    0.500   0.500    20.055    0.000    0.000
LGA    G    21_A      G    21_A    13.876     0    0.428   0.428    15.876    0.000    0.000
LGA    S    22_A      S    22_A     8.552     0    0.034   0.727    10.317   12.619    8.730
LGA    L    23_A      L    23_A     3.074     0    0.276   0.319     5.372   39.405   58.750
LGA    D    24_A      D    24_A     1.936     0    0.086   0.829     3.538   68.810   60.357
LGA    S    25_A      S    25_A     2.583     0    0.125   0.684     3.831   62.857   57.460
LGA    L    26_A      L    26_A     1.696     0    0.031   0.080     1.942   72.857   77.143
LGA    K    27_A      K    27_A     1.932     0    0.018   1.040     4.211   68.810   60.265
LGA    K    28_A      K    28_A     3.008     0    0.051   0.560     4.564   53.571   48.148
LGA    Y    29_A      Y    29_A     2.705     0    0.041   0.171     4.196   57.143   52.619
LGA    N    30_A      N    30_A     2.375     0    0.086   0.920     2.428   64.762   73.274
LGA    G    31_A      G    31_A     2.175     0    0.038   0.038     2.246   64.762   64.762
LGA    K    32_A      K    32_A     2.490     0    0.249   1.059     4.411   61.071   51.270
LGA    L    33_A      L    33_A     1.261     0    0.025   0.167     2.762   71.190   77.560
LGA    P    34_A      P    34_A     4.090     0    0.061   0.147     4.840   48.810   43.061
LGA    K    35_A      K    35_A     5.291     0    0.010   0.957    15.258   28.810   14.444
LGA    H    36_A      H    36_A     3.900     0    0.053   0.787     6.075   37.262   34.857
LGA    D    37_A      D    37_A     3.954     0    0.029   0.900     5.883   43.333   36.845
LGA    P    38_A      P    38_A     3.872     0    0.080   0.319     4.443   43.333   41.565
LGA    S    39_A      S    39_A     3.797     0    0.037   0.246     3.900   43.333   44.444
LGA    F    40_A      F    40_A     3.399     0    0.070   0.159     3.503   48.333   49.394
LGA    V    41_A      V    41_A     3.277     0    0.064   1.083     5.747   57.381   46.531
LGA    Q    42_A      Q    42_A     2.321     0    0.057   1.304     5.156   62.857   52.698
LGA    P    43_A      P    43_A     3.117     0    0.576   0.562     4.649   47.143   44.762
LGA    G    44_A      G    44_A     3.358     0    0.118   0.118     3.753   50.119   50.119
LGA    N    45_A      N    45_A     3.472     0    0.544   1.271     8.541   50.119   33.155
LGA    R    46_A      R    46_A     2.297     0    0.207   1.462     6.489   64.762   54.199
LGA    H    47_A      H    47_A     2.765     0    0.145   0.609     6.054   62.857   44.524
LGA    Y    48_A      Y    48_A     2.603     0    0.137   0.251     5.520   62.857   45.556
LGA    K    49_A      K    49_A     2.551     0    0.654   1.015     5.627   62.976   45.503
LGA    Y    50_A      Y    50_A     4.156     0    0.068   1.278    10.481   43.452   21.111
LGA    Q    51_A      Q    51_A     2.204     0    0.039   1.127     7.019   66.905   48.677
LGA    C    52_A      C    52_A     1.034     0    0.083   0.130     1.341   85.952   87.460
LGA    T    53_A      T    53_A     0.483     0    0.025   0.067     0.639   92.857   95.918
LGA    W    54_A      W    54_A     0.478     0    0.018   1.479     6.469   95.238   71.565
LGA    Y    55_A      Y    55_A     1.044     0    0.076   1.515    10.616   83.690   45.913
LGA    A    56_A      A    56_A     0.981     0    0.026   0.035     1.034   88.214   88.667
LGA    Y    57_A      Y    57_A     0.936     0    0.053   1.373     7.119   85.952   61.627
LGA    N    58_A      N    58_A     1.244     0    0.038   1.106     3.928   81.429   76.726
LGA    R    59_A      R    59_A     1.029     0    0.102   1.270     6.940   79.286   52.944
LGA    R    60_A      R    60_A     1.330     0    0.052   0.863     3.554   81.429   70.649
LGA    G    61_A      G    61_A     1.262     0    0.118   0.118     1.628   77.143   77.143
LGA    Q    62_A      Q    62_A     2.327     0    0.102   0.954     5.184   66.786   53.386
LGA    L    63_A      L    63_A     2.251     0    0.047   0.130     3.955   68.810   60.417
LGA    G    64_A      G    64_A     1.393     0    0.072   0.072     1.633   81.548   81.548
LGA    I    65_A      I    65_A     1.214     0    0.264   0.285     2.112   79.524   76.190
LGA    P    66_A      P    66_A     1.549     0    0.108   0.243     1.886   75.000   77.823
LGA    V    67_A      V    67_A     1.458     0    0.017   0.084     1.527   79.286   78.980
LGA    P    68_A      P    68_A     1.221     0    0.045   0.284     1.398   83.690   82.721
LGA    L    69_A      L    69_A     0.988     0    0.033   0.238     1.189   83.690   82.560
LGA    W    70_A      W    70_A     0.985     0    0.647   0.493     3.369   78.095   83.707
LGA    G    71_A      G    71_A     1.201     0    0.295   0.295     2.396   77.262   77.262
LGA    D    72_A      D    72_A     0.920     0    0.084   0.817     2.603   90.476   81.845
LGA    A    73_A      A    73_A     0.576     0    0.058   0.055     0.815   92.857   92.381
LGA    A    74_A      A    74_A     0.632     0    0.016   0.029     0.983   90.476   90.476
LGA    D    75_A      D    75_A     0.725     0    0.037   0.522     2.468   90.476   86.131
LGA    W    76_A      W    76_A     0.558     0    0.009   0.063     0.651   90.476   97.279
LGA    I    77_A      I    77_A     0.734     0    0.018   0.132     0.978   90.476   92.857
LGA    G    78_A      G    78_A     1.021     0    0.069   0.069     1.021   88.214   88.214
LGA    G    79_A      G    79_A     0.931     0    0.048   0.048     1.012   88.214   88.214
LGA    A    80_A      A    80_A     0.825     0    0.047   0.052     0.967   90.476   90.476
LGA    K    81_A      K    81_A     1.074     0    0.026   0.799     3.229   83.690   76.138
LGA    G    82_A      G    82_A     1.795     0    0.039   0.039     2.069   70.833   70.833
LGA    A    83_A      A    83_A     1.605     0    0.069   0.064     1.617   72.857   74.571
LGA    G    84_A      G    84_A     1.643     0    0.049   0.049     1.694   72.857   72.857
LGA    Y    85_A      Y    85_A     1.140     0    0.096   0.660     1.863   81.429   80.833
LGA    G    86_A      G    86_A     0.624     0    0.125   0.125     0.846   90.476   90.476
LGA    V    87_A      V    87_A     0.860     0    0.031   0.076     1.246   85.952   89.252
LGA    G    88_A      G    88_A     1.438     0    0.085   0.085     1.438   81.429   81.429
LGA    R    89_A      R    89_A     0.826     0    0.087   1.361     6.716   90.476   62.987
LGA    T    90_A      T    90_A     0.725     0    0.027   0.065     1.127   88.214   89.184
LGA    P    91_A      P    91_A     1.094     0    0.097   0.345     1.755   81.548   81.565
LGA    K    92_A      K    92_A     1.350     0    0.032   0.655     5.105   81.429   70.688
LGA    Q    93_A      Q    93_A     1.762     0    0.037   0.160     2.351   70.952   68.413
LGA    G    94_A      G    94_A     2.914     0    0.221   0.221     3.904   55.595   55.595
LGA    A    95_A      A    95_A     2.129     0    0.017   0.035     2.138   68.810   68.000
LGA    C    96_A      C    96_A     2.066     0    0.065   0.792     2.695   73.095   71.825
LGA    V    97_A      V    97_A     0.475     0    0.039   1.122     2.182   95.357   85.918
LGA    I    98_A      I    98_A     0.702     0    0.037   0.093     1.075   88.214   88.214
LGA    W    99_A      W    99_A     0.758     0    0.086   0.185     1.269   88.214   91.258
LGA    Q   100_A      Q   100_A     0.761     0    0.048   0.530     1.875   90.476   86.508
LGA    R   101_A      R   101_A     0.627     0    0.061   1.295     3.804   86.071   76.190
LGA    G   102_A      G   102_A     1.730     0    0.136   0.136     2.838   71.071   71.071
LGA    V   103_A      V   103_A     1.334     0    0.032   0.058     1.554   81.429   81.497
LGA    Q   104_A      Q   104_A     1.634     0    0.026   0.532     4.074   77.143   61.693
LGA    G   105_A      G   105_A     1.293     0    0.025   0.025     1.411   81.429   81.429
LGA    G   106_A      G   106_A     0.852     0    0.055   0.055     0.942   90.476   90.476
LGA    S   107_A      S   107_A     1.061     0    0.113   0.671     3.711   85.952   78.095
LGA    P   108_A      P   108_A     1.217     0    0.048   0.274     1.525   85.952   82.857
LGA    Q   109_A      Q   109_A     0.888     0    0.021   0.934     2.761   90.476   79.947
LGA    Y   110_A      Y   110_A     0.637     0    0.115   0.207     3.055   88.214   77.619
LGA    G   111_A      G   111_A     0.551     0    0.075   0.075     0.652   90.476   90.476
LGA    H   112_A      H   112_A     0.427     0    0.036   0.461     2.427   97.619   88.238
LGA    V   113_A      V   113_A     0.880     0    0.031   1.243     2.443   85.952   79.252
LGA    A   114_A      A   114_A     1.436     0    0.037   0.058     1.666   77.143   78.000
LGA    F   115_A      F   115_A     1.984     0    0.034   0.232     2.603   72.857   66.320
LGA    V   116_A      V   116_A     1.949     0    0.103   0.106     2.149   68.810   70.544
LGA    E   117_A      E   117_A     2.404     0    0.058   0.184     2.998   64.762   60.529
LGA    K   118_A      K   118_A     2.295     0    0.077   0.897     3.696   68.810   60.847
LGA    V   119_A      V   119_A     1.925     0    0.067   0.117     2.418   66.786   69.388
LGA    L   120_A      L   120_A     2.155     0    0.057   0.121     2.418   64.762   64.762
LGA    D   121_A      D   121_A     1.825     0    0.173   1.262     4.936   72.857   61.964
LGA    G   122_A      G   122_A     1.667     0    0.308   0.308     2.136   70.833   70.833
LGA    G   123_A      G   123_A     1.414     0    0.181   0.181     1.714   79.286   79.286
LGA    K   124_A      K   124_A     0.922     0    0.113   0.632     1.414   85.952   88.519
LGA    K   125_A      K   125_A     1.546     0    0.067   0.932     3.929   75.000   70.529
LGA    I   126_A      I   126_A     1.453     0    0.049   0.053     1.532   77.143   80.417
LGA    F   127_A      F   127_A     1.869     0    0.023   0.161     3.617   72.857   60.996
LGA    I   128_A      I   128_A     1.824     0    0.031   0.098     2.114   68.810   71.905
LGA    S   129_A      S   129_A     2.447     0    0.093   0.693     4.795   64.762   57.937
LGA    E   130_A      E   130_A     2.665     0    0.068   0.715     5.392   55.476   48.413
LGA    H   131_A      H   131_A     4.244     0    0.409   0.468     7.037   29.167   39.524
LGA    N   132_A      N   132_A     4.705     0    0.265   1.281    10.292   30.357   18.036
LGA    Y   133_A      Y   133_A     4.194     0    0.068   0.115     9.717   43.452   22.817
LGA    A   134_A      A   134_A     2.500     0    0.050   0.045     3.509   69.286   64.095
LGA    T   135_A      T   135_A     2.012     0    0.028   0.078     4.455   67.381   59.116
LGA    P   136_A      P   136_A     5.012     0    0.134   0.419     6.844   25.000   29.456
LGA    N   137_A      N   137_A     9.254     0    0.276   1.024    14.741    4.048    2.024
LGA    G   138_A      G   138_A     6.316     0    0.143   0.143     7.199   18.690   18.690
LGA    Y   139_A      Y   139_A     4.358     0    0.057   1.003     6.920   34.405   30.913
LGA    G   140_A      G   140_A     3.574     0    0.026   0.026     3.794   46.667   46.667
LGA    T   141_A      T   141_A     2.661     0    0.038   0.111     3.008   57.262   57.211
LGA    R   142_A      R   142_A     2.145     0    0.035   0.550     3.590   66.786   60.173
LGA    T   143_A      T   143_A     1.948     0    0.017   0.084     2.474   70.833   69.388
LGA    I   144_A      I   144_A     1.303     0    0.026   0.523     1.947   81.429   82.619
LGA    D   145_A      D   145_A     1.421     0    0.020   0.898     3.039   79.286   72.202
LGA    M   146_A      M   146_A     0.839     0    0.022   0.590     1.789   85.952   86.012
LGA    S   147_A      S   147_A     1.477     0    0.057   0.553     3.594   75.119   70.873
LGA    S   148_A      S   148_A     2.108     0    0.039   0.756     3.803   72.976   66.667
LGA    A   149_A      A   149_A     1.720     0    0.013   0.041     1.879   77.143   76.286
LGA    I   150_A      I   150_A     0.896     0    0.013   0.603     2.855   90.595   83.036
LGA    G   151_A      G   151_A     0.635     0    0.055   0.055     0.835   90.476   90.476
LGA    K   152_A      K   152_A     1.455     0    0.024   1.266     7.695   77.143   58.995
LGA    N   153_A      N   153_A     1.271     0    0.035   0.067     1.784   81.429   80.357
LGA    A   154_A      A   154_A     0.923     0    0.061   0.082     1.568   83.810   85.143
LGA    Q   155_A      Q   155_A     0.973     0    0.039   0.951     2.478   88.214   81.746
LGA    F   156_A      F   156_A     0.817     0    0.031   0.142     1.298   90.476   88.009
LGA    I   157_A      I   157_A     0.607     0    0.033   0.095     0.793   90.476   91.667
LGA    Y   158_A      Y   158_A     0.434     0    0.334   0.454     1.954   93.214   88.373
LGA    D   159_A      D   159_A     1.685     0    0.035   1.081     7.228   61.905   44.048
LGA    K   160_A      K   160_A     3.162     0    0.635   0.970     4.580   47.857   58.201
LGA    K   161_A      K   161_A     8.837     0    0.061   0.898    17.082    4.167    1.852
LGA    K   162_A      K   162_A    11.526     0    0.577   0.962    15.910    0.000    8.042
LGA    N   163_A      N   163_A    16.259     0    0.130   1.208    17.842    0.000    0.000
LGA    S   164_A      S   164_A    21.985     0    0.356   0.370    25.006    0.000    0.000
LGA    S   165_A      S   165_A    26.063     0    0.413   0.633    27.282    0.000    0.000
LGA    S   166_A      S   166_A    23.461     0    0.681   0.614    25.114    0.000    0.000
LGA    V   167_A      V   167_A    25.619     0    0.605   0.590    27.520    0.000    0.000
LGA    D   168_A      D   168_A    26.309     0    0.660   0.996    29.814    0.000    0.000
LGA    K   169_A      K   169_A    26.569     0    0.100   0.851    29.654    0.000    0.000
LGA    L   170_A      L   170_A    28.405     0    0.018   0.437    33.034    0.000    0.000
LGA    A   171_A      A   171_A    33.162     0    0.015   0.033    37.717    0.000    0.000
LGA    A   172_A      A   172_A    36.988     0    0.040   0.037    39.885    0.000    0.000
LGA    A   173_A      A   173_A    36.668     0    0.608   0.550    37.582    0.000    0.000
LGA    L   174_A      L   174_A    40.169     0    0.245   0.570    41.702    0.000    0.000
LGA    E   175_A      E   175_A    42.335     0    0.697   1.064    45.425    0.000    0.000
LGA    H   176_A      H   176_A    39.975     0    0.671   0.855    41.475    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):    17.109         17.037                 17.296           56.395   52.967

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  176  176    4.0    132    1.98    62.074    62.998     6.339

LGA_LOCAL      RMSD:   1.982  Number of atoms:  132  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  23.074  Number of assigned atoms:  176 
Std_ASGN_ATOMS RMSD:  17.109  Standard rmsd on all 176 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.452928 * X  +   0.037032 * Y  +  -0.890778 * Z  +   1.834891
  Y_new =  -0.334848 * X  +  -0.933056 * Y  +   0.131469 * Z  +  -3.418354
  Z_new =  -0.826277 * X  +   0.357821 * Y  +   0.435007 * Z  +   1.038469 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -2.504977  0.972465  0.688349   [DEG: -143.5246   55.7181   39.4395 ]
ZXZ: -1.717327  1.120750 -1.162125   [DEG:  -98.3956   64.2143  -66.5849 ]
 
# END of job
