
#######################################################
#                                                     #
#                        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:   145      18_A - 162_A       5.00    11.84
  LCS_AVERAGE:     73.17

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   119      42_A - 160_A       1.99    12.79
  LONGEST_CONTINUOUS_SEGMENT:   119      43_A - 161_A       1.99    12.77
  LCS_AVERAGE:     48.34

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    43      87_A - 129_A       0.95    13.21
  LONGEST_CONTINUOUS_SEGMENT:    43      88_A - 130_A       0.98    13.22
  LCS_AVERAGE:     11.75

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  176
LCS_GDT     RESIDUE       RESIDUE       SEGMENT_SIZE    GLOBAL DISTANCE TEST COLUMNS: number of residues under the threshold assigned to each residue pair
LCS_GDT   NAME NUMBER   NAME NUMBER    1.0  2.0  5.0    0.5  1.0  1.5  2.0  2.5  3.0  3.5  4.0  4.5  5.0  5.5  6.0  6.5  7.0  7.5  8.0  8.5  9.0  9.5 10.0
LCS_GDT     M     1_A     M     1_A      4    5   13      3    3    4    4    4    5    5    5    5    5    6    6    6   14   14   14   14   14   15   15 
LCS_GDT     E     2_A     E     2_A      4    5   13      3    3    4    4    4    5    5    5    5    6   11   12   12   14   14   14   14   14   16   17 
LCS_GDT     Q     3_A     Q     3_A      4    5   13      3    3    4    4    4    5    5    8   10   11   11   12   12   14   14   14   14   14   16   17 
LCS_GDT     S     4_A     S     4_A      4    8   13      3    4    5    6    7    8    8    8   10   11   11   12   12   14   14   14   14   14   16   17 
LCS_GDT     S     5_A     S     5_A      5    8   13      3    5    5    6    7    8    8    8   10   11   11   12   12   14   14   14   14   14   15   15 
LCS_GDT     G     6_A     G     6_A      5    8   13      3    5    5    6    7    8    8    8   10   11   11   12   12   14   14   14   14   14   15   21 
LCS_GDT     D     7_A     D     7_A      5    8   13      3    5    5    6    7    8    8    8   10   11   11   12   12   14   14   14   14   15   18   37 
LCS_GDT     K     8_A     K     8_A      5    8   28      3    5    5    6    7    8    8    8   10   11   14   17   33   40   49   59   67   81   91  113 
LCS_GDT     D     9_A     D     9_A      5    8   31      3    5    5    6    7    8   10   10   16   23   38   47   52   62   69   82  100  103  112  122 
LCS_GDT     G    10_A     G    10_A      4    8   33      3    3    4    6   13   17   21   26   32   34   42   47   54   62   69   77   86   96  111  120 
LCS_GDT     G    11_A     G    11_A      4    8   35      3    3    5   11   13   23   29   31   35   38   43   46   52   58   63   73   76   87   95  104 
LCS_GDT     S    12_A     S    12_A      3    5   36      3    3    7   12   15   23   29   31   35   40   44   51   57   67   76   83   91  101  111  119 
LCS_GDT     D    13_A     D    13_A      3    5   36      3    4    8   11   16   23   29   31   35   38   43   51   56   63   74   80   93  103  112  122 
LCS_GDT     S    14_A     S    14_A      3    5   36      3    3    8   11   16   23   29   31   35   40   44   51   60   70   77   89   99  108  117  125 
LCS_GDT     G    15_A     G    15_A      3    5   62      3    3    3    6    6    6    8   18   31   38   45   51   66   88  104  113  125  135  142  145 
LCS_GDT     G    16_A     G    16_A      3    5   65      3    3    4    6    6    9   11   22   29   36   40   47   53   57   66   80   92  106  118  135 
LCS_GDT     A    17_A     A    17_A      3    5   69      3    3    3    6    6    9   10   13   29   36   41   50   67   77   95  103  115  127  139  144 
LCS_GDT     Q    18_A     Q    18_A      4   13  145      3    5    9   15   23   31   38   45   50   65   76   86   95  107  114  127  137  141  143  145 
LCS_GDT     D    19_A     D    19_A      4   13  145      3    4    7   14   23   31   38   45   50   61   73   84   92  102  113  124  134  141  143  145 
LCS_GDT     G    20_A     G    20_A      4   13  145      3    4    9   14   23   31   38   45   53   65   76   86   96  110  121  132  138  141  143  145 
LCS_GDT     G    21_A     G    21_A      4   13  145      3    4    5   14   23   31   38   45   50   65   76   86   96  108  121  131  138  141  143  145 
LCS_GDT     S    22_A     S    22_A      9   13  145      3    7    9   11   15   25   35   45   50   60   77   91  104  118  130  134  138  141  143  145 
LCS_GDT     L    23_A     L    23_A      9   13  145      3    7    9   12   16   23   33   45   50   56   68   91  102  110  124  133  138  141  143  145 
LCS_GDT     D    24_A     D    24_A      9   13  145      3    7    9   12   16   25   38   45   50   56   66   80   94  110  120  131  138  141  143  145 
LCS_GDT     S    25_A     S    25_A      9   13  145      6    7    9   16   22   31   41   45   62   78   93  120  124  129  131  134  138  141  143  145 
LCS_GDT     L    26_A     L    26_A      9   13  145      6    7   11   17   26   32   48   61   78  102  113  120  124  129  131  134  138  141  143  145 
LCS_GDT     K    27_A     K    27_A      9   13  145      6    7    9   15   23   31   38   45   58   70   81   94  112  123  130  134  138  141  143  145 
LCS_GDT     K    28_A     K    28_A      9   13  145      6    7    9   15   23   31   38   45   58   70   84   98  114  125  131  134  138  141  143  145 
LCS_GDT     Y    29_A     Y    29_A      9   13  145      6    7    9   15   23   31   39   53   64   76   97  112  124  129  131  134  138  141  143  145 
LCS_GDT     N    30_A     N    30_A      9   13  145      6    7    9   11   16   31   36   43   50   65   76   86   96  110  120  131  138  141  143  145 
LCS_GDT     G    31_A     G    31_A      3   12  145      3    3    4    8   14   22   38   45   50   56   63   76   87   97  110  123  129  139  143  145 
LCS_GDT     K    32_A     K    32_A      5   12  145      4    5    5   11   14   24   30   45   50   66   76   90  109  121  130  134  138  141  143  145 
LCS_GDT     L    33_A     L    33_A      5   12  145      4    5    9   15   23   31   38   53   64   78   98  112  124  129  131  134  138  141  143  145 
LCS_GDT     P    34_A     P    34_A      5   12  145      4    5    9   15   23   31   38   52   64   74   96  112  124  129  131  134  138  141  143  145 
LCS_GDT     K    35_A     K    35_A      6   12  145      4    6    9   15   23   31   38   47   60   70   88  110  120  129  131  134  138  141  143  145 
LCS_GDT     H    36_A     H    36_A      6   12  145      4    6    9   15   23   31   38   52   62   86   95  112  123  129  131  134  138  141  143  145 
LCS_GDT     D    37_A     D    37_A      6   12  145      4    6    9   15   23   34   45   57   70   90  114  119  124  129  131  134  138  141  143  145 
LCS_GDT     P    38_A     P    38_A      6   12  145      4    6    9   15   23   31   41   55   70   89  104  119  124  129  131  134  138  141  143  145 
LCS_GDT     S    39_A     S    39_A      6   12  145      4    6    9   15   23   31   39   55   70  104  114  119  124  129  131  134  138  141  143  145 
LCS_GDT     F    40_A     F    40_A      6   12  145      4    6    9   14   19   29   45   55   70  104  114  119  123  129  131  134  138  141  143  145 
LCS_GDT     V    41_A     V    41_A      5   96  145      3    9   40   58   85  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     Q    42_A     Q    42_A      5  119  145      3    6   43   77  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     P    43_A     P    43_A      5  119  145      4   22   52   83  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     G    44_A     G    44_A      5  119  145      4   26   51   69  102  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     N    45_A     N    45_A      5  119  145      4    5   13   21   30   78  110  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     R    46_A     R    46_A      5  119  145      4   10   23   30   73  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     H    47_A     H    47_A     12  119  145      3    7   17   44   96  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     Y    48_A     Y    48_A     17  119  145      4    7   64   89  103  109  113  117  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     K    49_A     K    49_A     21  119  145      8   33   81   92  103  109  113  118  121  121  121  122  123  129  131  134  138  141  143  145 
LCS_GDT     Y    50_A     Y    50_A     21  119  145      8   33   77   90  103  109  113  117  121  121  121  122  122  125  131  134  138  141  143  145 
LCS_GDT     Q    51_A     Q    51_A     21  119  145      8   53   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     C    52_A     C    52_A     21  119  145     18   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     T    53_A     T    53_A     21  119  145     20   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     W    54_A     W    54_A     21  119  145     18   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     Y    55_A     Y    55_A     21  119  145     18   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     A    56_A     A    56_A     21  119  145      6   54   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     Y    57_A     Y    57_A     21  119  145     14   54   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     N    58_A     N    58_A     21  119  145     27   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     R    59_A     R    59_A     21  119  145     17   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     R    60_A     R    60_A     21  119  145      7   51   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     G    61_A     G    61_A     21  119  145     20   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     Q    62_A     Q    62_A     21  119  145      7   17   63   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     L    63_A     L    63_A     21  119  145      7   17   57   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     G    64_A     G    64_A     21  119  145      7   45   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     I    65_A     I    65_A     21  119  145     17   54   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     P    66_A     P    66_A     21  119  145      7   50   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     V    67_A     V    67_A     21  119  145      8   45   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     P    68_A     P    68_A     21  119  145      5   17   40   90  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     L    69_A     L    69_A     21  119  145      6   16   25   47   91  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     W    70_A     W    70_A     24  119  145      3    4   19   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     G    71_A     G    71_A     24  119  145     14   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     D    72_A     D    72_A     24  119  145     21   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     A    73_A     A    73_A     24  119  145     21   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     A    74_A     A    74_A     24  119  145     21   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     D    75_A     D    75_A     24  119  145     18   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     W    76_A     W    76_A     24  119  145     18   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     I    77_A     I    77_A     24  119  145     17   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     G    78_A     G    78_A     24  119  145     18   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     G    79_A     G    79_A     24  119  145     18   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     A    80_A     A    80_A     24  119  145     14   54   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     K    81_A     K    81_A     24  119  145     12   43   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     G    82_A     G    82_A     24  119  145     15   54   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     A    83_A     A    83_A     24  119  145     17   56   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     G    84_A     G    84_A     24  119  145     12   51   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     Y    85_A     Y    85_A     24  119  145     12   51   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     G    86_A     G    86_A     24  119  145     12   45   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     V    87_A     V    87_A     43  119  145     19   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     G    88_A     G    88_A     43  119  145     28   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     R    89_A     R    89_A     43  119  145     28   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     T    90_A     T    90_A     43  119  145     28   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     P    91_A     P    91_A     43  119  145      3    4   70   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     K    92_A     K    92_A     43  119  145     24   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     Q    93_A     Q    93_A     43  119  145     22   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     G    94_A     G    94_A     43  119  145      4   43   73   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     A    95_A     A    95_A     43  119  145     17   56   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     C    96_A     C    96_A     43  119  145     18   56   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     V    97_A     V    97_A     43  119  145     28   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     I    98_A     I    98_A     43  119  145     28   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     W    99_A     W    99_A     43  119  145     28   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     Q   100_A     Q   100_A     43  119  145     28   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     R   101_A     R   101_A     43  119  145     28   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     G   102_A     G   102_A     43  119  145     28   56   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     V   103_A     V   103_A     43  119  145     28   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     Q   104_A     Q   104_A     43  119  145      3   50   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     G   105_A     G   105_A     43  119  145      3   19   51   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     G   106_A     G   106_A     43  119  145      3    6   40   89  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     S   107_A     S   107_A     43  119  145      5   11   30   88  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     P   108_A     P   108_A     43  119  145      5   11   54   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     Q   109_A     Q   109_A     43  119  145      5   45   78   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     Y   110_A     Y   110_A     43  119  145     14   46   78   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     G   111_A     G   111_A     43  119  145     18   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     H   112_A     H   112_A     43  119  145     20   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     V   113_A     V   113_A     43  119  145     28   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     A   114_A     A   114_A     43  119  145     18   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     F   115_A     F   115_A     43  119  145     28   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     V   116_A     V   116_A     43  119  145     28   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     E   117_A     E   117_A     43  119  145     28   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     K   118_A     K   118_A     43  119  145     28   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     V   119_A     V   119_A     43  119  145     27   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     L   120_A     L   120_A     43  119  145      9   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     D   121_A     D   121_A     43  119  145     28   59   81   92  103  109  113  118  121  121  121  122  123  129  131  134  137  141  143  145 
LCS_GDT     G   122_A     G   122_A     43  119  145     27   59   81   92  103  109  113  118  121  121  121  122  122  128  131  134  137  141  143  145 
LCS_GDT     G   123_A     G   123_A     43  119  145     14   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     K   124_A     K   124_A     43  119  145     28   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     K   125_A     K   125_A     43  119  145     28   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     I   126_A     I   126_A     43  119  145     28   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     F   127_A     F   127_A     43  119  145     28   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     I   128_A     I   128_A     43  119  145     18   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     S   129_A     S   129_A     43  119  145     17   47   77   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     E   130_A     E   130_A     43  119  145      4   26   52   90  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     H   131_A     H   131_A     19  119  145      4   17   30   52   88  107  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     N   132_A     N   132_A     18  119  145      3   17   30   52   85  107  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     Y   133_A     Y   133_A      9  119  145      3    8   13   47   73  100  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     A   134_A     A   134_A      9  119  145      3    8   23   89  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     T   135_A     T   135_A      6  119  145      3   29   56   90  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     P   136_A     P   136_A      6  119  145      3   13   33   49   72   99  110  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     N   137_A     N   137_A      7  119  145      3    6    8   12   33   44   61   85  111  117  120  122  122  124  131  134  138  141  143  145 
LCS_GDT     G   138_A     G   138_A     19  119  145      3   11   33   48   67   99  110  117  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     Y   139_A     Y   139_A     19  119  145     11   29   51   79  102  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     G   140_A     G   140_A     19  119  145     10   34   69   90  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     T   141_A     T   141_A     20  119  145     17   52   79   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     R   142_A     R   142_A     20  119  145     23   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     T   143_A     T   143_A     20  119  145     28   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     I   144_A     I   144_A     20  119  145     28   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     D   145_A     D   145_A     20  119  145     28   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     M   146_A     M   146_A     20  119  145     28   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     S   147_A     S   147_A     20  119  145     28   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     S   148_A     S   148_A     20  119  145     28   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     A   149_A     A   149_A     20  119  145     19   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     I   150_A     I   150_A     20  119  145     14   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     G   151_A     G   151_A     20  119  145     28   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     K   152_A     K   152_A     20  119  145     17   53   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     N   153_A     N   153_A     20  119  145      8   31   52   91  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     A   154_A     A   154_A     20  119  145      4   40   75   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     Q   155_A     Q   155_A     20  119  145     23   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     F   156_A     F   156_A     20  119  145     28   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     I   157_A     I   157_A     20  119  145     18   59   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     Y   158_A     Y   158_A     20  119  145     12   40   81   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     D   159_A     D   159_A     20  119  145      4   22   76   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     K   160_A     K   160_A     20  119  145      6   41   79   92  103  109  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     K   161_A     K   161_A     16  119  145      4   10   56   85  102  108  113  118  121  121  121  122  124  129  131  134  138  141  143  145 
LCS_GDT     K   162_A     K   162_A      7  118  145      3   15   23   62   95  106  111  118  121  121  121  122  122  125  131  134  138  141  143  145 
LCS_GDT     N   163_A     N   163_A      4    5  144      3    4    7    9   11   13   33   40   64   73  108  115  121  122  123  123  124  125  130  137 
LCS_GDT     S   164_A     S   164_A      4    5  143      3    4    5    6    7    9    9   13   17   20   34   64  102  106  118  123  124  125  125  125 
LCS_GDT     S   165_A     S   165_A      4    5  141      3    4    4    5    5    5    9   13   20   36   63   91  102  108  117  120  124  125  125  125 
LCS_GDT     S   166_A     S   166_A      4    5  138      3    4    4    5    5    6    9   13   13   14   21   24   28   58   79   97  115  118  120  121 
LCS_GDT     V   167_A     V   167_A      3    5  136      3    4    4    5    5    6    8   14   16   20   22   24   31   34   40   57   73   87   96  107 
LCS_GDT     D   168_A     D   168_A      6    7  135      5    5    6    7    9   12   17   21   27   34   39   45   55   67   79   91  103  117  119  121 
LCS_GDT     K   169_A     K   169_A      6    7  132      5    5    6    7    8   11   14   15   23   29   36   43   45   48   53   61   65   77   86   93 
LCS_GDT     L   170_A     L   170_A      6    7   23      5    5    6    7    8   11   12   15   19   29   31   36   41   44   51   53   59   64   68   79 
LCS_GDT     A   171_A     A   171_A      6    7   23      5    5    6    7    8    9    9   13   13   17   26   28   34   38   39   44   47   61   65   69 
LCS_GDT     A   172_A     A   172_A      6    7   23      5    5    6    7    8    9    9   13   14   17   19   21   26   28   39   41   43   47   57   67 
LCS_GDT     A   173_A     A   173_A      6    7   23      4    5    6    7    8    9   10   13   14   17   19   21   25   28   31   35   43   47   49   58 
LCS_GDT     L   174_A     L   174_A      5    7   23      3    4    5    7    8   11   12   14   16   17   19   21   34   38   39   41   47   50   56   58 
LCS_GDT     E   175_A     E   175_A      4    4   17      3    4    4    4    4   11   12   14   17   22   26   28   34   38   39   43   57   61   65   67 
LCS_GDT     H   176_A     H   176_A      4    4   17      0    4    4    4    7   11   12   14   16   22   26   28   34   38   39   51   57   61   65   67 
LCS_AVERAGE  LCS_A:  44.42  (  11.75   48.34   73.17 )

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     28     59     81     92    103    109    113    118    121    121    121    122    124    129    131    134    138    141    143    145 
GDT PERCENT_AT  15.91  33.52  46.02  52.27  58.52  61.93  64.20  67.05  68.75  68.75  68.75  69.32  70.45  73.30  74.43  76.14  78.41  80.11  81.25  82.39
GDT RMS_LOCAL    0.33   0.69   0.92   1.08   1.28   1.46   1.59   1.87   1.95   1.95   1.95   2.07   3.28   3.57   3.50   3.89   4.56   4.59   4.79   5.00
GDT RMS_ALL_AT  13.31  13.15  13.07  13.03  13.05  13.01  12.96  12.80  12.80  12.80  12.80  12.75  12.37  12.35  12.39  12.24  11.91  11.96  11.89  11.84

# Checking swapping
#   possible swapping detected:  E     2_A      E     2_A
#   possible swapping detected:  D     9_A      D     9_A
#   possible swapping detected:  D    24_A      D    24_A
#   possible swapping detected:  Y    29_A      Y    29_A
#   possible swapping detected:  F    40_A      F    40_A
#   possible swapping detected:  Y    50_A      Y    50_A
#   possible swapping detected:  D    72_A      D    72_A
#   possible swapping detected:  E   130_A      E   130_A
#   possible swapping detected:  Y   139_A      Y   139_A
#   possible swapping detected:  D   145_A      D   145_A
#   possible swapping detected:  D   159_A      D   159_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    25.040     0    0.025   0.809    26.620    0.000    0.000
LGA    E     2_A      E     2_A    24.798     0    0.123   1.227    27.758    0.000    0.000
LGA    Q     3_A      Q     3_A    26.214     0    0.648   1.167    27.381    0.000    0.000
LGA    S     4_A      S     4_A    30.041     0    0.556   0.830    30.620    0.000    0.000
LGA    S     5_A      S     5_A    27.438     0    0.163   0.706    28.859    0.000    0.000
LGA    G     6_A      G     6_A    26.738     0    0.302   0.302    28.019    0.000    0.000
LGA    D     7_A      D     7_A    27.649     0    0.226   1.217    29.545    0.000    0.000
LGA    K     8_A      K     8_A    25.428     0    0.652   0.683    28.236    0.000    0.000
LGA    D     9_A      D     9_A    26.797     0    0.193   0.735    28.452    0.000    0.000
LGA    G    10_A      G    10_A    28.812     0    0.117   0.117    31.370    0.000    0.000
LGA    G    11_A      G    11_A    31.997     0    0.163   0.163    32.110    0.000    0.000
LGA    S    12_A      S    12_A    27.053     0    0.601   0.609    28.370    0.000    0.000
LGA    D    13_A      D    13_A    24.973     0    0.027   0.683    26.506    0.000    0.000
LGA    S    14_A      S    14_A    24.954     0    0.545   0.720    26.186    0.000    0.000
LGA    G    15_A      G    15_A    19.142     0    0.555   0.555    20.872    0.000    0.000
LGA    G    16_A      G    16_A    20.104     0    0.274   0.274    20.134    0.000    0.000
LGA    A    17_A      A    17_A    19.644     0    0.672   0.606    21.867    0.000    0.000
LGA    Q    18_A      Q    18_A    18.086     0    0.715   1.466    23.159    0.000    0.000
LGA    D    19_A      D    19_A    17.579     0    0.145   1.355    19.268    0.000    0.000
LGA    G    20_A      G    20_A    16.696     0    0.554   0.554    16.751    0.000    0.000
LGA    G    21_A      G    21_A    16.543     0    0.395   0.395    16.895    0.000    0.000
LGA    S    22_A      S    22_A    13.895     0    0.501   0.613    14.558    0.000    0.000
LGA    L    23_A      L    23_A    13.979     0    0.488   1.427    16.882    0.000    0.000
LGA    D    24_A      D    24_A    15.856     0    0.090   1.358    20.104    0.000    0.000
LGA    S    25_A      S    25_A    11.441     0    0.189   0.689    12.836    0.000    0.079
LGA    L    26_A      L    26_A    10.661     0    0.121   0.168    12.643    0.000    3.452
LGA    K    27_A      K    27_A    15.260     0    0.049   0.781    20.216    0.000    0.000
LGA    K    28_A      K    28_A    15.370     0    0.018   0.554    15.546    0.000    0.159
LGA    Y    29_A      Y    29_A    13.855     0    0.027   0.211    15.327    0.000    0.476
LGA    N    30_A      N    30_A    17.762     0    0.392   0.914    19.143    0.000    0.000
LGA    G    31_A      G    31_A    19.135     0    0.043   0.043    19.135    0.000    0.000
LGA    K    32_A      K    32_A    15.648     0    0.470   1.050    16.606    0.000    0.000
LGA    L    33_A      L    33_A    12.894     0    0.057   1.364    15.149    0.000    0.000
LGA    P    34_A      P    34_A    12.668     0    0.067   0.117    12.668    0.000    0.000
LGA    K    35_A      K    35_A    13.546     0    0.025   1.326    18.280    0.000    0.000
LGA    H    36_A      H    36_A    12.410     0    0.320   1.173    14.420    0.000    0.000
LGA    D    37_A      D    37_A    11.215     0    0.041   0.900    13.958    0.000    0.000
LGA    P    38_A      P    38_A    11.806     0    0.094   0.308    12.919    0.000    0.000
LGA    S    39_A      S    39_A    11.259     0    0.039   0.230    11.569    0.000    0.000
LGA    F    40_A      F    40_A    10.941     0    0.411   1.103    17.779    1.429    0.519
LGA    V    41_A      V    41_A     4.621     0    0.621   0.908     6.914   28.333   41.905
LGA    Q    42_A      Q    42_A     2.992     0    0.192   0.848     4.689   50.119   47.407
LGA    P    43_A      P    43_A     2.648     0    0.181   0.216     2.652   57.143   61.565
LGA    G    44_A      G    44_A     3.109     0    0.141   0.141     3.973   48.452   48.452
LGA    N    45_A      N    45_A     4.443     0    0.433   1.195     9.023   45.238   27.321
LGA    R    46_A      R    46_A     3.688     0    0.052   0.811    11.243   46.905   23.680
LGA    H    47_A      H    47_A     3.255     0    0.044   0.117     7.559   61.548   36.143
LGA    Y    48_A      Y    48_A     3.334     0    0.205   0.378     9.584   55.476   26.389
LGA    K    49_A      K    49_A     2.796     0    0.026   0.784     5.886   57.143   43.228
LGA    Y    50_A      Y    50_A     3.325     0    0.086   1.081     5.117   53.571   53.056
LGA    Q    51_A      Q    51_A     2.335     0    0.044   0.771     4.545   66.905   55.608
LGA    C    52_A      C    52_A     1.322     0    0.017   0.183     1.672   79.286   81.508
LGA    T    53_A      T    53_A     1.095     0    0.059   0.138     1.184   83.690   82.721
LGA    W    54_A      W    54_A     1.276     0    0.044   1.460     7.100   81.429   57.721
LGA    Y    55_A      Y    55_A     1.361     0    0.071   1.538    11.199   81.429   43.452
LGA    A    56_A      A    56_A     1.566     0    0.032   0.030     1.819   79.286   78.000
LGA    Y    57_A      Y    57_A     1.170     0    0.038   1.264     6.323   81.429   61.389
LGA    N    58_A      N    58_A     0.797     0    0.012   0.987     4.218   90.476   75.476
LGA    R    59_A      R    59_A     1.411     0    0.115   0.924     5.000   75.119   57.143
LGA    R    60_A      R    60_A     1.842     0    0.045   1.076     3.817   72.857   66.710
LGA    G    61_A      G    61_A     0.900     0    0.060   0.060     1.300   83.690   83.690
LGA    Q    62_A      Q    62_A     2.138     0    0.172   1.155     8.132   66.786   44.762
LGA    L    63_A      L    63_A     2.426     0    0.029   0.232     3.788   64.762   58.333
LGA    G    64_A      G    64_A     1.616     0    0.083   0.083     1.907   77.143   77.143
LGA    I    65_A      I    65_A     1.439     0    0.085   0.924     2.681   79.286   72.143
LGA    P    66_A      P    66_A     1.670     0    0.090   0.220     3.598   68.929   62.993
LGA    V    67_A      V    67_A     1.790     0    0.099   1.026     3.928   77.143   70.068
LGA    P    68_A      P    68_A     2.335     0    0.009   0.188     2.841   60.952   59.320
LGA    L    69_A      L    69_A     2.927     0    0.493   0.508     6.382   61.071   43.274
LGA    W    70_A      W    70_A     2.263     0    0.552   1.129    10.569   69.524   32.551
LGA    G    71_A      G    71_A     0.639     0    0.372   0.372     1.469   85.952   85.952
LGA    D    72_A      D    72_A     0.547     0    0.043   0.414     1.661   92.857   87.202
LGA    A    73_A      A    73_A     1.101     0    0.047   0.060     1.198   85.952   85.048
LGA    A    74_A      A    74_A     1.146     0    0.030   0.035     1.334   83.690   83.238
LGA    D    75_A      D    75_A     0.785     0    0.109   0.452     1.702   88.214   88.333
LGA    W    76_A      W    76_A     1.177     0    0.046   1.441     5.205   81.429   66.463
LGA    I    77_A      I    77_A     1.331     0    0.099   1.478     3.473   81.429   73.393
LGA    G    78_A      G    78_A     1.359     0    0.068   0.068     1.388   81.429   81.429
LGA    G    79_A      G    79_A     1.326     0    0.062   0.062     1.326   81.429   81.429
LGA    A    80_A      A    80_A     1.498     0    0.014   0.021     1.754   81.429   79.714
LGA    K    81_A      K    81_A     1.676     0    0.010   0.794     2.026   72.857   75.873
LGA    G    82_A      G    82_A     1.065     0    0.019   0.019     1.222   85.952   85.952
LGA    A    83_A      A    83_A     0.972     0    0.039   0.039     1.130   83.690   85.048
LGA    G    84_A      G    84_A     1.331     0    0.050   0.050     1.400   81.429   81.429
LGA    Y    85_A      Y    85_A     1.292     0    0.032   0.572     2.775   81.429   75.952
LGA    G    86_A      G    86_A     1.395     0    0.103   0.103     1.400   81.429   81.429
LGA    V    87_A      V    87_A     0.632     0    0.040   0.053     1.673   88.214   84.082
LGA    G    88_A      G    88_A     1.351     0    0.077   0.077     1.351   85.952   85.952
LGA    R    89_A      R    89_A     1.039     0    0.056   1.572     7.211   81.429   59.870
LGA    T    90_A      T    90_A     1.043     0    0.043   0.085     1.387   81.429   82.721
LGA    P    91_A      P    91_A     1.975     0    0.159   0.185     2.511   72.857   69.456
LGA    K    92_A      K    92_A     0.724     0    0.052   0.649     3.335   88.214   83.968
LGA    Q    93_A      Q    93_A     0.990     0    0.042   0.529     1.390   85.952   85.450
LGA    G    94_A      G    94_A     2.085     0    0.211   0.211     3.122   63.095   63.095
LGA    A    95_A      A    95_A     1.232     0    0.018   0.045     1.601   83.690   81.524
LGA    C    96_A      C    96_A     1.158     0    0.033   0.731     1.798   85.952   81.587
LGA    V    97_A      V    97_A     0.098     0    0.027   1.112     2.799  100.000   88.639
LGA    I    98_A      I    98_A     0.468     0    0.043   0.682     2.449   95.238   89.643
LGA    W    99_A      W    99_A     0.837     0    0.021   0.669     4.063   90.476   72.891
LGA    Q   100_A      Q   100_A     1.139     0    0.075   0.332     1.879   81.429   81.481
LGA    R   101_A      R   101_A     1.310     0    0.099   1.006     6.456   81.429   63.766
LGA    G   102_A      G   102_A     1.668     0    0.153   0.153     2.361   70.833   70.833
LGA    V   103_A      V   103_A     1.019     0    0.088   0.214     2.167   85.952   80.408
LGA    Q   104_A      Q   104_A     1.309     0    0.353   1.070     9.137   75.833   41.270
LGA    G   105_A      G   105_A     2.352     0    0.188   0.188     3.844   63.929   63.929
LGA    G   106_A      G   106_A     2.556     0    0.104   0.104     2.556   62.857   62.857
LGA    S   107_A      S   107_A     2.306     0    0.113   0.712     4.943   64.762   59.206
LGA    P   108_A      P   108_A     2.077     0    0.070   0.169     2.456   66.786   65.918
LGA    Q   109_A      Q   109_A     1.437     0    0.024   0.806     3.145   79.286   75.079
LGA    Y   110_A      Y   110_A     1.557     0    0.639   0.435     4.005   63.929   63.611
LGA    G   111_A      G   111_A     1.168     0    0.088   0.088     1.884   79.286   79.286
LGA    H   112_A      H   112_A     0.952     0    0.035   1.170     5.107   90.476   70.238
LGA    V   113_A      V   113_A     0.551     0    0.070   0.908     2.620   90.476   84.422
LGA    A   114_A      A   114_A     1.187     0    0.066   0.101     1.250   83.690   83.238
LGA    F   115_A      F   115_A     1.115     0    0.045   0.210     1.669   81.429   79.870
LGA    V   116_A      V   116_A     1.154     0    0.019   0.073     1.315   81.429   82.721
LGA    E   117_A      E   117_A     1.337     0    0.068   0.758     1.924   83.690   83.704
LGA    K   118_A      K   118_A     0.891     0    0.080   0.905     4.299   90.595   75.185
LGA    V   119_A      V   119_A     0.562     0    0.099   1.154     2.846   88.214   81.905
LGA    L   120_A      L   120_A     1.224     0    0.420   0.578     3.438   73.690   80.952
LGA    D   121_A      D   121_A     0.925     0    0.322   0.853     2.120   83.810   80.595
LGA    G   122_A      G   122_A     1.188     0    0.265   0.265     1.934   79.286   79.286
LGA    G   123_A      G   123_A     0.877     0    0.156   0.156     1.464   88.214   88.214
LGA    K   124_A      K   124_A     0.843     0    0.081   0.643     1.944   90.476   84.550
LGA    K   125_A      K   125_A     0.510     0    0.111   0.771     2.332   92.857   88.836
LGA    I   126_A      I   126_A     0.528     0    0.108   1.318     4.469   92.857   79.821
LGA    F   127_A      F   127_A     0.880     0    0.050   0.032     1.557   90.476   83.983
LGA    I   128_A      I   128_A     1.047     0    0.125   1.192     4.191   81.548   70.119
LGA    S   129_A      S   129_A     1.467     0    0.122   0.689     3.756   77.143   70.794
LGA    E   130_A      E   130_A     2.118     0    0.099   0.684     4.948   62.976   54.550
LGA    H   131_A      H   131_A     3.753     0    0.421   1.358     6.948   34.524   31.952
LGA    N   132_A      N   132_A     4.125     0    0.410   1.302     9.835   35.952   22.202
LGA    Y   133_A      Y   133_A     3.878     0    0.092   0.091     9.446   48.333   25.635
LGA    A   134_A      A   134_A     2.720     0    0.467   0.437     3.647   59.286   56.095
LGA    T   135_A      T   135_A     2.203     0    0.057   0.193     4.624   64.881   54.014
LGA    P   136_A      P   136_A     5.002     0    0.105   0.373     6.207   27.024   28.231
LGA    N   137_A      N   137_A     7.977     0    0.230   1.001    13.137   10.119    5.238
LGA    G   138_A      G   138_A     5.172     0    0.046   0.046     6.017   27.976   27.976
LGA    Y   139_A      Y   139_A     3.025     0    0.094   0.928     7.727   51.905   36.587
LGA    G   140_A      G   140_A     2.460     0    0.126   0.126     2.462   68.810   68.810
LGA    T   141_A      T   141_A     1.382     0    0.074   0.064     1.744   79.286   77.755
LGA    R   142_A      R   142_A     1.024     0    0.029   1.573     8.074   85.952   55.065
LGA    T   143_A      T   143_A     0.777     0    0.022   0.085     1.156   90.476   89.184
LGA    I   144_A      I   144_A     0.420     0    0.039   0.578     1.590   97.619   94.226
LGA    D   145_A      D   145_A     0.312     0    0.033   0.922     3.064  100.000   83.810
LGA    M   146_A      M   146_A     0.154     0    0.024   0.452     1.934  100.000   93.095
LGA    S   147_A      S   147_A     0.303     0    0.105   0.559     2.143   97.619   92.540
LGA    S   148_A      S   148_A     0.525     0    0.031   0.749     3.462   97.619   88.492
LGA    A   149_A      A   149_A     0.315     0    0.034   0.034     0.534   97.619   98.095
LGA    I   150_A      I   150_A     0.670     0    0.025   0.619     1.354   90.476   88.214
LGA    G   151_A      G   151_A     0.270     0    0.108   0.108     0.460  100.000  100.000
LGA    K   152_A      K   152_A     0.731     0    0.062   1.204     6.282   88.333   72.593
LGA    N   153_A      N   153_A     1.722     0    0.093   0.091     3.086   75.000   66.131
LGA    A   154_A      A   154_A     1.618     0    0.127   0.162     1.691   77.143   76.286
LGA    Q   155_A      Q   155_A     1.035     0    0.051   1.274     3.080   85.952   77.143
LGA    F   156_A      F   156_A     0.625     0    0.026   0.134     2.353   95.238   82.684
LGA    I   157_A      I   157_A     0.681     0    0.044   0.113     1.077   90.595   91.726
LGA    Y   158_A      Y   158_A     1.599     0    0.096   1.456     5.004   75.000   63.532
LGA    D   159_A      D   159_A     2.064     0    0.179   0.991     5.273   70.833   54.405
LGA    K   160_A      K   160_A     1.707     0    0.066   0.858     5.337   66.905   54.762
LGA    K   161_A      K   161_A     3.119     0    0.560   1.197     6.478   50.476   35.344
LGA    K   162_A      K   162_A     4.372     0    0.218   1.120     9.253   25.238   21.587
LGA    N   163_A      N   163_A    11.168     0    0.581   0.967    15.364    1.190    0.595
LGA    S   164_A      S   164_A    13.887     0    0.094   0.178    16.849    0.000    0.000
LGA    S   165_A      S   165_A    15.369     0    0.538   0.483    17.391    0.000    0.000
LGA    S   166_A      S   166_A    19.415     0    0.622   0.929    21.611    0.000    0.000
LGA    V   167_A      V   167_A    23.612     0    0.604   0.627    26.378    0.000    0.000
LGA    D   168_A      D   168_A    21.799     0    0.625   0.927    26.092    0.000    0.000
LGA    K   169_A      K   169_A    26.332     0    0.016   0.915    30.368    0.000    0.000
LGA    L   170_A      L   170_A    28.616     0    0.053   1.400    31.917    0.000    0.000
LGA    A   171_A      A   171_A    29.430     0    0.025   0.028    33.654    0.000    0.000
LGA    A   172_A      A   172_A    32.736     0    0.112   0.123    37.307    0.000    0.000
LGA    A   173_A      A   173_A    37.080     0    0.615   0.567    38.780    0.000    0.000
LGA    L   174_A      L   174_A    40.455     0    0.097   0.249    42.137    0.000    0.000
LGA    E   175_A      E   175_A    42.235     0    0.632   1.290    42.505    0.000    0.000
LGA    H   176_A      H   176_A    42.809     0    0.534   1.167    46.007    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):    10.757         10.788                 10.899           52.197   47.325

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  176  176    4.0    118    1.87    57.244    57.303     6.000

LGA_LOCAL      RMSD:   1.867  Number of atoms:  118  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  12.796  Number of assigned atoms:  176 
Std_ASGN_ATOMS RMSD:  10.757  Standard rmsd on all 176 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.739831 * X  +   0.210051 * Y  +   0.639163 * Z  + -18.842461
  Y_new =  -0.672538 * X  +   0.257059 * Y  +   0.693984 * Z  +  -3.512346
  Z_new =  -0.018531 * X  +  -0.943292 * Y  +   0.331447 * Z  +   4.520078 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -0.737789  0.018532 -1.232899   [DEG:  -42.2722    1.0618  -70.6399 ]
ZXZ:  2.397293  1.232959 -3.121950   [DEG:  137.3548   70.6434 -178.8746 ]
 
# END of job
