
#######################################################
#                                                     #
#                        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:   152      18_A - 169_A       4.87    16.26
  LONGEST_CONTINUOUS_SEGMENT:   152      19_A - 170_A       4.88    16.43
  LCS_AVERAGE:     79.06

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   121      40_A - 160_A       1.98    16.61
  LCS_AVERAGE:     55.51

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    78      51_A - 128_A       0.99    16.56
  LONGEST_CONTINUOUS_SEGMENT:    78      52_A - 129_A       0.98    16.59
  LCS_AVERAGE:     23.74

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    6    6    6    6    9    9    9   49 
LCS_GDT     E     2_A     E     2_A      4    4   25      3    4    4    4    4    4    5    5    5    5    5    5    7   22   25   39   42   47   48   53 
LCS_GDT     Q     3_A     Q     3_A      4    4   26      3    4    4    4    4    4    5    5    8   12   14   15   31   33   37   41   43   47   52   56 
LCS_GDT     S     4_A     S     4_A      4    4   26      3    4    4    4    6    7   10   14   15   21   27   30   35   37   43   47   50   53   56   62 
LCS_GDT     S     5_A     S     5_A      7   10   26      3    4    7    9   11   13   15   18   20   25   28   31   35   41   43   47   50   53   56   62 
LCS_GDT     G     6_A     G     6_A      7   10   26      3    5    7   11   13   18   21   25   27   29   32   35   38   41   45   47   51   55   58   62 
LCS_GDT     D     7_A     D     7_A      7   10   26      3    5    8   11   13   18   21   25   27   29   32   35   38   42   45   48   52   56   60   67 
LCS_GDT     K     8_A     K     8_A      7   10   26      3    5    7   11   13   18   21   25   27   29   32   35   39   42   45   48   52   56   60   67 
LCS_GDT     D     9_A     D     9_A      7   10   26      3    4    7   11   13   18   21   25   27   30   32   35   39   42   45   48   53   62   71   76 
LCS_GDT     G    10_A     G    10_A      7   10   26      3    5    7    9   13   16   21   25   27   30   32   35   39   42   45   48   57   71   74   77 
LCS_GDT     G    11_A     G    11_A      7   10   26      3    5    7    9   12   13   18   25   27   30   32   40   42   50   59   67   73   79   86   97 
LCS_GDT     S    12_A     S    12_A      3   10   26      3    3    5    9   10   13   16   23   27   30   32   35   39   43   50   61   71   74   82   90 
LCS_GDT     D    13_A     D    13_A      4   10   26      4    4    8   11   13   18   21   25   27   30   32   40   42   50   59   67   76   85   95  102 
LCS_GDT     S    14_A     S    14_A      4   10   26      4    4    8   11   13   18   21   25   27   30   34   40   45   54   61   74   79   90   97  105 
LCS_GDT     G    15_A     G    15_A      4    9  150      4    4    6    9   13   18   21   25   27   30   34   41   47   56   64   73   80   89   99  110 
LCS_GDT     G    16_A     G    16_A      5    9  151      4    4    5    8   10   14   21   25   27   30   38   50   60   68   80   91  105  110  123  131 
LCS_GDT     A    17_A     A    17_A      5    9  151      4    5    8   11   13   18   21   25   27   30   37   47   58   71   78   87   95  108  120  130 
LCS_GDT     Q    18_A     Q    18_A      5    9  152      4    5    6    8   11   13   21   25   27   30   37   51   67   75   84   92  112  125  132  137 
LCS_GDT     D    19_A     D    19_A      5    9  152      4    4    5    8   11   14   21   26   33   48   64   76   90  111  114  130  137  140  143  143 
LCS_GDT     G    20_A     G    20_A      5    9  152      4    5    6    8   10   13   14   20   23   29   40   70   86   98  114  123  128  133  143  143 
LCS_GDT     G    21_A     G    21_A      4    9  152      3    5    6    8   10   13   20   25   63   87  107  120  128  138  139  141  142  142  143  144 
LCS_GDT     S    22_A     S    22_A      4  114  152      3    4    7   40   72  105  112  128  135  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     L    23_A     L    23_A     12  114  152      9   17   82  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     D    24_A     D    24_A     12  114  152      5   42   89  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     S    25_A     S    25_A     12  114  152      5   23   82  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     L    26_A     L    26_A     12  114  152      5   51   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     K    27_A     K    27_A     12  114  152      7   51   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     K    28_A     K    28_A     12  114  152      7   21   77  105  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     Y    29_A     Y    29_A     12  114  152      7   37   84  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     N    30_A     N    30_A     12  114  152      5   51   89  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     G    31_A     G    31_A     12  114  152      4   48   84  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     K    32_A     K    32_A     12  114  152      5   48   84  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     L    33_A     L    33_A     12  114  152      5   58   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     P    34_A     P    34_A     12  114  152      5    8   19   61  105  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     K    35_A     K    35_A     10  114  152      6   12   32   56   86  103  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     H    36_A     H    36_A     10  114  152      6   16   35   56   92  120  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     D    37_A     D    37_A     10  114  152      6   16   35   68   92  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     P    38_A     P    38_A     10  114  152      6   16   26   68   96  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     S    39_A     S    39_A     10  114  152      6   16   26   68   96  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     F    40_A     F    40_A     10  121  152      6    8   26   68  105  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     V    41_A     V    41_A     10  121  152      6    8   26   41   96  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     Q    42_A     Q    42_A     10  121  152      6   31   63   98  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     P    43_A     P    43_A     10  121  152      3   11   54   81  110  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     G    44_A     G    44_A      5  121  152      5   16   24   37  104  119  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     N    45_A     N    45_A      5  121  152      3   19   34   50  101  120  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     R    46_A     R    46_A      5  121  152      3   17   72   98  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     H    47_A     H    47_A      5  121  152      3   20   54   94  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     Y    48_A     Y    48_A     14  121  152      3   16   56   94  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     K    49_A     K    49_A     14  121  152      3   16   53   94  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     Y    50_A     Y    50_A     44  121  152      4   10   43   85  108  119  127  131  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     Q    51_A     Q    51_A     78  121  152      6   44   84  102  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     C    52_A     C    52_A     78  121  152     24   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     T    53_A     T    53_A     78  121  152     25   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     W    54_A     W    54_A     78  121  152     25   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     Y    55_A     Y    55_A     78  121  152     25   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     A    56_A     A    56_A     78  121  152     24   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     Y    57_A     Y    57_A     78  121  152     25   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     N    58_A     N    58_A     78  121  152     25   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     R    59_A     R    59_A     78  121  152     22   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     R    60_A     R    60_A     78  121  152     12   67   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     G    61_A     G    61_A     78  121  152     22   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     Q    62_A     Q    62_A     78  121  152      7   11   57  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     L    63_A     L    63_A     78  121  152      7   12   65  106  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     G    64_A     G    64_A     78  121  152     12   67   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     I    65_A     I    65_A     78  121  152     19   62   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     P    66_A     P    66_A     78  121  152      3   45   89  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     V    67_A     V    67_A     78  121  152      4   42   89  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     P    68_A     P    68_A     78  121  152      5   54   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     L    69_A     L    69_A     78  121  152     25   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     W    70_A     W    70_A     78  121  152     23   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     G    71_A     G    71_A     78  121  152     16   59   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     D    72_A     D    72_A     78  121  152     24   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     A    73_A     A    73_A     78  121  152     24   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     A    74_A     A    74_A     78  121  152     25   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     D    75_A     D    75_A     78  121  152     25   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     W    76_A     W    76_A     78  121  152     25   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     I    77_A     I    77_A     78  121  152     25   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     G    78_A     G    78_A     78  121  152     25   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     G    79_A     G    79_A     78  121  152     25   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     A    80_A     A    80_A     78  121  152     25   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     K    81_A     K    81_A     78  121  152     14   67   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     G    82_A     G    82_A     78  121  152     25   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     A    83_A     A    83_A     78  121  152     25   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     G    84_A     G    84_A     78  121  152     25   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     Y    85_A     Y    85_A     78  121  152     24   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     G    86_A     G    86_A     78  121  152     13   67   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     V    87_A     V    87_A     78  121  152     24   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     G    88_A     G    88_A     78  121  152     31   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     R    89_A     R    89_A     78  121  152     31   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     T    90_A     T    90_A     78  121  152     31   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     P    91_A     P    91_A     78  121  152     31   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     K    92_A     K    92_A     78  121  152     31   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     Q    93_A     Q    93_A     78  121  152     26   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     G    94_A     G    94_A     78  121  152     22   54   89  102  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     A    95_A     A    95_A     78  121  152     25   63   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     C    96_A     C    96_A     78  121  152     31   63   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     V    97_A     V    97_A     78  121  152     25   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     I    98_A     I    98_A     78  121  152     24   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     W    99_A     W    99_A     78  121  152     25   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     Q   100_A     Q   100_A     78  121  152     31   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     R   101_A     R   101_A     78  121  152     31   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     G   102_A     G   102_A     78  121  152     25   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     V   103_A     V   103_A     78  121  152     31   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     Q   104_A     Q   104_A     78  121  152     25   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     G   105_A     G   105_A     78  121  152     25   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     G   106_A     G   106_A     78  121  152     25   67   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     S   107_A     S   107_A     78  121  152     13   59   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     P   108_A     P   108_A     78  121  152     13   48   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     Q   109_A     Q   109_A     78  121  152     19   63   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     Y   110_A     Y   110_A     78  121  152     24   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     G   111_A     G   111_A     78  121  152     31   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     H   112_A     H   112_A     78  121  152     31   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     V   113_A     V   113_A     78  121  152     31   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     A   114_A     A   114_A     78  121  152     31   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     F   115_A     F   115_A     78  121  152     31   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     V   116_A     V   116_A     78  121  152     31   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     E   117_A     E   117_A     78  121  152     31   65   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     K   118_A     K   118_A     78  121  152     31   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     V   119_A     V   119_A     78  121  152     31   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     L   120_A     L   120_A     78  121  152     31   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     D   121_A     D   121_A     78  121  152     31   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     G   122_A     G   122_A     78  121  152     21   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     G   123_A     G   123_A     78  121  152     31   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     K   124_A     K   124_A     78  121  152     31   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     K   125_A     K   125_A     78  121  152     31   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     I   126_A     I   126_A     78  121  152     31   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     F   127_A     F   127_A     78  121  152     31   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     I   128_A     I   128_A     78  121  152     31   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     S   129_A     S   129_A     78  121  152     27   60   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     E   130_A     E   130_A     67  121  152      7   38   75  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     H   131_A     H   131_A     60  121  152      5   10   30   51   86  114  127  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     N   132_A     N   132_A      8  121  152      5   12   22   44   79  105  127  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     Y   133_A     Y   133_A      8  121  152      5   16   23   41   96  118  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     A   134_A     A   134_A      8  121  152      5    8   36   93  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     T   135_A     T   135_A      8  121  152     18   60   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     P   136_A     P   136_A      8  121  152      4   18   46   71  107  114  124  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     N   137_A     N   137_A      9  121  152      5    7   10   14   25   46   67   78  110  118  125  137  139  140  141  141  142  142  143  144 
LCS_GDT     G   138_A     G   138_A     19  121  152      5   13   29   50   66   96  111  120  125  136  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     Y   139_A     Y   139_A     22  121  152      9   50   63   90  112  114  123  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     G   140_A     G   140_A     22  121  152      9   50   70  100  112  117  125  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     T   141_A     T   141_A     22  121  152     24   56   91  107  114  119  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     R   142_A     R   142_A     22  121  152     31   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     T   143_A     T   143_A     22  121  152     31   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     I   144_A     I   144_A     22  121  152     24   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     D   145_A     D   145_A     22  121  152     21   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     M   146_A     M   146_A     22  121  152     25   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     S   147_A     S   147_A     22  121  152     25   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     S   148_A     S   148_A     22  121  152     25   63   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     A   149_A     A   149_A     22  121  152     25   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     I   150_A     I   150_A     22  121  152     31   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     G   151_A     G   151_A     22  121  152     25   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     K   152_A     K   152_A     22  121  152     25   63   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     N   153_A     N   153_A     22  121  152     25   64   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     A   154_A     A   154_A     22  121  152     24   65   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     Q   155_A     Q   155_A     22  121  152     31   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     F   156_A     F   156_A     22  121  152     31   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     I   157_A     I   157_A     22  121  152     25   70   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     Y   158_A     Y   158_A     22  121  152      4   62   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     D   159_A     D   159_A     22  121  152     19   67   91  107  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     K   160_A     K   160_A     22  121  152      3   64   91  106  114  121  128  133  136  137  137  138  139  140  141  141  142  142  143  144 
LCS_GDT     K   161_A     K   161_A      3  118  152      3   16   33   59   65   75   90  106  120  127  133  138  139  140  141  141  142  142  143  144 
LCS_GDT     K   162_A     K   162_A      3  112  152      3   15   30   40   55   64   76   86  102  113  123  131  134  139  141  141  142  142  143  144 
LCS_GDT     N   163_A     N   163_A      4    7  152      3    4    5    7    9   12   56   62   66   76   80  101  106  117  125  132  134  139  143  144 
LCS_GDT     S   164_A     S   164_A      4    7  152      3    4    5    6    9   12   15   16   19   27   70   73   80   90  103  115  129  133  137  140 
LCS_GDT     S   165_A     S   165_A      4    7  152      3    4    5    6    9   12   15   20   48   66   70   78   84   97  111  121  129  133  137  140 
LCS_GDT     S   166_A     S   166_A      4    7  152      3    4    5    7    9   12   14   36   53   66   70   76   84   94  108  122  129  133  137  140 
LCS_GDT     V   167_A     V   167_A      3    7  152      3    4    4    6    9   12   14   17   25   30   38   59   70   79   85   97  114  125  129  134 
LCS_GDT     D   168_A     D   168_A      6    7  152      5    5    6    7   14   27   43   58   62   68   73   82   93  107  122  127  133  136  138  143 
LCS_GDT     K   169_A     K   169_A      6    7  152      5    5    6    7    7    9   10   18   40   52   77   85   98  113  122  127  134  136  142  144 
LCS_GDT     L   170_A     L   170_A      6    7  152      5    5    6    7    7    9   11   12   15   16   17   23   31   48   64   77   89   96  104  121 
LCS_GDT     A   171_A     A   171_A      6    7  151      5    5    6    7    7    9   11   12   15   16   17   20   30   41   51   66   75   91   96  106 
LCS_GDT     A   172_A     A   172_A      6    7  133      5    5    6    7    7    9   11   12   16   21   28   35   48   60   72   80   89   96  105  115 
LCS_GDT     A   173_A     A   173_A      6    7  104      4    5    6    7    7    9   11   12   15   16   17   24   30   44   55   66   81   91   97  106 
LCS_GDT     L   174_A     L   174_A      5    7   17      3    4    6    7    7    9   11   12   15   16   17   17   20   24   32   37   45   56   63   77 
LCS_GDT     E   175_A     E   175_A      4    5   17      3    4    4    4    6    8   11   12   15   16   17   23   37   48   55   72   81   91   98  106 
LCS_GDT     H   176_A     H   176_A      4    5   17      2    4    4    4    5    7   11   12   15   16   17   17   18   31   34   62   80   88   96  106 
LCS_AVERAGE  LCS_A:  52.77  (  23.74   55.51   79.06 )

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     31     70     91    107    114    121    128    133    136    137    137    138    139    140    141    141    142    142    143    144 
GDT PERCENT_AT  17.61  39.77  51.70  60.80  64.77  68.75  72.73  75.57  77.27  77.84  77.84  78.41  78.98  79.55  80.11  80.11  80.68  80.68  81.25  81.82
GDT RMS_LOCAL    5.69   0.68   0.88   1.12   1.25   1.48   1.69   1.85   1.95   2.00   2.00   2.07   2.17   2.29   2.44   2.44   2.58   2.58   2.86   3.12
GDT RMS_ALL_AT  16.62  16.58  16.66  16.81  16.78  16.69  16.66  16.71  16.68  16.65  16.65  16.67  16.64  16.67  16.63  16.63  16.57  16.57  16.53  16.56

# 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:  D    19_A      D    19_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:  F   156_A      F   156_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    71.991     0    0.047   0.969    73.642    0.000    0.000
LGA    E     2_A      E     2_A    68.658     0    0.121   0.981    71.563    0.000    0.000
LGA    Q     3_A      Q     3_A    64.323     0    0.504   0.995    66.000    0.000    0.000
LGA    S     4_A      S     4_A    63.218     0    0.565   0.667    66.035    0.000    0.000
LGA    S     5_A      S     5_A    64.549     0    0.605   0.906    66.158    0.000    0.000
LGA    G     6_A      G     6_A    59.573     0    0.273   0.273    61.200    0.000    0.000
LGA    D     7_A      D     7_A    54.093     0    0.144   1.134    56.854    0.000    0.000
LGA    K     8_A      K     8_A    49.882     0    0.307   0.771    51.484    0.000    0.000
LGA    D     9_A      D     9_A    44.890     0    0.258   1.183    46.954    0.000    0.000
LGA    G    10_A      G    10_A    40.649     0    0.276   0.276    42.208    0.000    0.000
LGA    G    11_A      G    11_A    35.277     0    0.510   0.510    37.340    0.000    0.000
LGA    S    12_A      S    12_A    33.420     0    0.638   0.566    35.409    0.000    0.000
LGA    D    13_A      D    13_A    30.502     0    0.444   1.066    31.672    0.000    0.000
LGA    S    14_A      S    14_A    29.165     0    0.068   0.585    32.285    0.000    0.000
LGA    G    15_A      G    15_A    27.287     0    0.421   0.421    28.000    0.000    0.000
LGA    G    16_A      G    16_A    21.976     0    0.415   0.415    23.745    0.000    0.000
LGA    A    17_A      A    17_A    22.008     0    0.082   0.103    22.008    0.000    0.000
LGA    Q    18_A      Q    18_A    19.484     0    0.211   1.262    24.221    0.000    0.000
LGA    D    19_A      D    19_A    15.464     0    0.171   1.326    16.369    0.000    0.000
LGA    G    20_A      G    20_A    16.403     0    0.438   0.438    16.403    0.000    0.000
LGA    G    21_A      G    21_A    10.801     0    0.192   0.192    12.906    4.524    4.524
LGA    S    22_A      S    22_A     5.962     0    0.660   0.706     9.824   32.143   22.302
LGA    L    23_A      L    23_A     1.830     0    0.530   0.464     4.510   56.548   66.131
LGA    D    24_A      D    24_A     1.347     0    0.085   0.860     2.829   79.286   71.131
LGA    S    25_A      S    25_A     1.716     0    0.129   0.621     2.311   77.143   73.016
LGA    L    26_A      L    26_A     1.163     0    0.032   0.069     1.332   83.690   82.560
LGA    K    27_A      K    27_A     1.167     0    0.018   1.018     4.223   81.429   72.063
LGA    K    28_A      K    28_A     1.908     0    0.036   0.526     3.400   70.833   63.333
LGA    Y    29_A      Y    29_A     1.570     0    0.051   0.177     3.214   75.000   68.413
LGA    N    30_A      N    30_A     1.190     0    0.093   0.924     2.302   81.429   77.262
LGA    G    31_A      G    31_A     1.398     0    0.054   0.054     1.418   81.429   81.429
LGA    K    32_A      K    32_A     1.513     0    0.262   1.045     3.998   72.976   59.630
LGA    L    33_A      L    33_A     0.688     0    0.022   0.159     2.066   82.024   81.905
LGA    P    34_A      P    34_A     3.333     0    0.067   0.124     4.062   59.405   53.605
LGA    K    35_A      K    35_A     4.934     0    0.015   0.955    14.639   34.286   17.037
LGA    H    36_A      H    36_A     4.155     0    0.068   1.237     5.872   34.405   33.952
LGA    D    37_A      D    37_A     4.270     0    0.016   0.903     5.880   38.690   34.524
LGA    P    38_A      P    38_A     4.161     0    0.073   0.314     4.691   37.143   35.510
LGA    S    39_A      S    39_A     4.090     0    0.041   0.249     4.195   38.690   40.317
LGA    F    40_A      F    40_A     3.721     0    0.076   0.153     3.817   43.333   46.970
LGA    V    41_A      V    41_A     3.651     0    0.060   1.083     6.090   50.238   39.524
LGA    Q    42_A      Q    42_A     2.427     0    0.064   1.303     4.935   62.857   54.762
LGA    P    43_A      P    43_A     3.179     0    0.591   0.576     4.843   48.571   44.626
LGA    G    44_A      G    44_A     3.215     0    0.132   0.132     3.432   53.571   53.571
LGA    N    45_A      N    45_A     3.219     0    0.562   1.272     8.589   53.571   34.405
LGA    R    46_A      R    46_A     2.390     0    0.192   0.586     2.527   60.952   70.909
LGA    H    47_A      H    47_A     3.018     0    0.145   0.601     6.011   55.357   41.524
LGA    Y    48_A      Y    48_A     3.063     0    0.140   0.214     5.870   55.357   39.643
LGA    K    49_A      K    49_A     2.992     0    0.658   1.026     6.144   59.286   41.481
LGA    Y    50_A      Y    50_A     4.322     0    0.070   1.258    10.454   40.238   19.643
LGA    Q    51_A      Q    51_A     2.356     0    0.039   1.138     7.541   66.905   47.302
LGA    C    52_A      C    52_A     0.918     0    0.100   0.130     1.327   88.214   90.556
LGA    T    53_A      T    53_A     0.358     0    0.022   0.063     0.532   97.619   98.639
LGA    W    54_A      W    54_A     0.332     0    0.013   1.480     6.796  100.000   69.626
LGA    Y    55_A      Y    55_A     0.862     0    0.085   1.513    10.564   88.214   47.976
LGA    A    56_A      A    56_A     0.851     0    0.020   0.037     0.876   90.476   90.476
LGA    Y    57_A      Y    57_A     0.620     0    0.045   1.389     6.752   90.476   64.008
LGA    N    58_A      N    58_A     0.953     0    0.027   1.105     3.559   88.214   81.190
LGA    R    59_A      R    59_A     0.912     0    0.105   1.226     6.790   85.952   56.883
LGA    R    60_A      R    60_A     1.023     0    0.050   0.971     4.704   88.214   71.299
LGA    G    61_A      G    61_A     1.124     0    0.113   0.113     1.574   81.548   81.548
LGA    Q    62_A      Q    62_A     2.213     0    0.077   1.027     5.275   66.786   55.661
LGA    L    63_A      L    63_A     2.050     0    0.044   0.144     3.636   70.833   63.214
LGA    G    64_A      G    64_A     1.316     0    0.064   0.064     1.515   83.810   83.810
LGA    I    65_A      I    65_A     0.759     0    0.246   0.223     1.628   86.071   82.679
LGA    P    66_A      P    66_A     1.356     0    0.100   0.238     1.655   81.548   81.565
LGA    V    67_A      V    67_A     1.390     0    0.017   0.057     1.634   83.690   81.497
LGA    P    68_A      P    68_A     0.993     0    0.055   0.313     1.232   88.214   87.891
LGA    L    69_A      L    69_A     0.756     0    0.017   0.297     0.888   90.476   90.476
LGA    W    70_A      W    70_A     0.975     0    0.658   0.526     3.454   78.095   86.939
LGA    G    71_A      G    71_A     1.142     0    0.279   0.279     2.321   79.524   79.524
LGA    D    72_A      D    72_A     0.935     0    0.084   0.817     2.294   90.476   82.798
LGA    A    73_A      A    73_A     0.737     0    0.049   0.046     0.916   90.476   90.476
LGA    A    74_A      A    74_A     0.529     0    0.014   0.030     0.775   90.476   90.476
LGA    D    75_A      D    75_A     0.653     0    0.037   0.513     2.397   90.476   86.131
LGA    W    76_A      W    76_A     0.486     0    0.010   0.070     0.554   92.857   97.959
LGA    I    77_A      I    77_A     0.586     0    0.012   0.141     0.744   90.476   91.667
LGA    G    78_A      G    78_A     0.827     0    0.063   0.063     0.846   90.476   90.476
LGA    G    79_A      G    79_A     0.795     0    0.029   0.029     0.803   90.476   90.476
LGA    A    80_A      A    80_A     0.584     0    0.032   0.039     0.685   90.476   90.476
LGA    K    81_A      K    81_A     0.972     0    0.031   0.778     2.830   85.952   78.836
LGA    G    82_A      G    82_A     1.491     0    0.017   0.017     1.633   79.286   79.286
LGA    A    83_A      A    83_A     1.215     0    0.086   0.080     1.215   81.429   81.429
LGA    G    84_A      G    84_A     1.003     0    0.030   0.030     1.060   85.952   85.952
LGA    Y    85_A      Y    85_A     0.578     0    0.077   0.666     2.219   92.857   85.476
LGA    G    86_A      G    86_A     0.543     0    0.102   0.102     0.543   97.619   97.619
LGA    V    87_A      V    87_A     0.361     0    0.033   0.086     0.781   95.238   95.918
LGA    G    88_A      G    88_A     0.971     0    0.072   0.072     0.983   90.476   90.476
LGA    R    89_A      R    89_A     0.831     0    0.123   1.298     6.331   90.476   68.312
LGA    T    90_A      T    90_A     0.662     0    0.031   0.050     1.066   88.214   87.891
LGA    P    91_A      P    91_A     1.060     0    0.102   0.138     1.334   83.690   85.306
LGA    K    92_A      K    92_A     1.083     0    0.031   0.846     5.424   81.429   70.688
LGA    Q    93_A      Q    93_A     1.406     0    0.045   0.210     2.022   77.143   73.915
LGA    G    94_A      G    94_A     2.676     0    0.238   0.238     3.791   55.595   55.595
LGA    A    95_A      A    95_A     1.918     0    0.013   0.030     2.021   75.000   72.952
LGA    C    96_A      C    96_A     1.808     0    0.058   0.796     2.441   77.143   77.302
LGA    V    97_A      V    97_A     0.334     0    0.036   1.124     2.240   97.619   88.571
LGA    I    98_A      I    98_A     0.773     0    0.033   0.083     1.066   88.214   88.214
LGA    W    99_A      W    99_A     0.782     0    0.071   0.165     1.018   88.214   93.231
LGA    Q   100_A      Q   100_A     0.812     0    0.046   0.481     1.567   90.476   87.513
LGA    R   101_A      R   101_A     0.614     0    0.055   1.311     3.892   88.214   77.792
LGA    G   102_A      G   102_A     1.426     0    0.130   0.130     2.532   75.476   75.476
LGA    V   103_A      V   103_A     1.156     0    0.032   0.069     1.410   85.952   85.306
LGA    Q   104_A      Q   104_A     1.377     0    0.025   1.009     3.995   83.690   77.302
LGA    G   105_A      G   105_A     1.035     0    0.030   0.030     1.130   85.952   85.952
LGA    G   106_A      G   106_A     0.758     0    0.068   0.068     0.825   90.476   90.476
LGA    S   107_A      S   107_A     1.157     0    0.108   0.672     3.757   83.690   75.159
LGA    P   108_A      P   108_A     1.208     0    0.046   0.109     1.523   83.690   81.497
LGA    Q   109_A      Q   109_A     0.919     0    0.028   1.163     3.452   90.476   81.111
LGA    Y   110_A      Y   110_A     0.448     0    0.106   0.176     2.598   95.238   81.944
LGA    G   111_A      G   111_A     0.485     0    0.073   0.073     0.584   95.238   95.238
LGA    H   112_A      H   112_A     0.360     0    0.032   0.494     2.282   95.238   87.286
LGA    V   113_A      V   113_A     0.756     0    0.032   1.240     2.451   88.214   80.544
LGA    A   114_A      A   114_A     1.210     0    0.045   0.070     1.427   83.690   83.238
LGA    F   115_A      F   115_A     1.707     0    0.031   0.223     2.443   72.857   70.649
LGA    V   116_A      V   116_A     1.671     0    0.091   0.089     1.883   72.857   74.082
LGA    E   117_A      E   117_A     2.088     0    0.045   0.153     2.647   68.810   65.714
LGA    K   118_A      K   118_A     1.954     0    0.064   0.630     3.019   75.000   68.677
LGA    V   119_A      V   119_A     1.597     0    0.059   0.095     2.135   70.833   72.925
LGA    L   120_A      L   120_A     1.847     0    0.065   0.108     2.243   72.857   69.821
LGA    D   121_A      D   121_A     1.477     0    0.173   1.262     5.007   77.143   64.524
LGA    G   122_A      G   122_A     1.228     0    0.292   0.292     1.882   79.286   79.286
LGA    G   123_A      G   123_A     1.039     0    0.206   0.206     1.317   85.952   85.952
LGA    K   124_A      K   124_A     0.621     0    0.109   0.630     1.235   90.476   89.471
LGA    K   125_A      K   125_A     1.318     0    0.073   0.937     3.766   81.429   74.339
LGA    I   126_A      I   126_A     1.203     0    0.057   0.058     1.306   81.429   85.952
LGA    F   127_A      F   127_A     1.592     0    0.024   0.160     3.176   75.000   65.801
LGA    I   128_A      I   128_A     1.553     0    0.028   0.106     1.888   72.857   77.143
LGA    S   129_A      S   129_A     2.225     0    0.093   0.665     4.510   66.786   59.286
LGA    E   130_A      E   130_A     2.476     0    0.084   0.671     4.938   59.167   52.963
LGA    H   131_A      H   131_A     4.160     0    0.414   0.792     6.917   31.667   40.095
LGA    N   132_A      N   132_A     4.537     0    0.271   1.297     9.883   31.905   19.107
LGA    Y   133_A      Y   133_A     4.274     0    0.069   0.281     9.605   41.786   22.262
LGA    A   134_A      A   134_A     2.690     0    0.030   0.027     3.653   67.143   62.381
LGA    T   135_A      T   135_A     1.445     0    0.050   0.079     3.859   75.833   66.939
LGA    P   136_A      P   136_A     4.258     0    0.137   0.415     6.238   33.214   39.524
LGA    N   137_A      N   137_A     8.813     0    0.337   1.023    14.187    5.595    2.798
LGA    G   138_A      G   138_A     6.209     0    0.106   0.106     7.035   19.881   19.881
LGA    Y   139_A      Y   139_A     3.923     0    0.115   1.031     6.864   40.357   34.325
LGA    G   140_A      G   140_A     3.325     0    0.013   0.013     3.484   51.786   51.786
LGA    T   141_A      T   141_A     2.450     0    0.034   0.113     2.791   62.857   60.408
LGA    R   142_A      R   142_A     1.916     0    0.034   0.907     4.602   72.857   62.684
LGA    T   143_A      T   143_A     1.702     0    0.018   0.074     2.108   72.857   71.701
LGA    I   144_A      I   144_A     1.171     0    0.021   0.580     1.791   81.429   82.619
LGA    D   145_A      D   145_A     1.380     0    0.019   1.161     3.556   81.429   76.726
LGA    M   146_A      M   146_A     0.922     0    0.031   0.613     1.775   85.952   86.012
LGA    S   147_A      S   147_A     1.554     0    0.057   0.557     3.647   72.976   69.444
LGA    S   148_A      S   148_A     2.070     0    0.040   0.753     3.751   72.976   66.667
LGA    A   149_A      A   149_A     1.653     0    0.012   0.032     1.841   77.143   76.286
LGA    I   150_A      I   150_A     0.725     0    0.010   0.598     2.554   90.595   85.238
LGA    G   151_A      G   151_A     0.680     0    0.081   0.081     0.861   90.476   90.476
LGA    K   152_A      K   152_A     1.472     0    0.040   1.245     7.687   79.286   58.730
LGA    N   153_A      N   153_A     1.215     0    0.037   0.063     1.544   81.429   80.357
LGA    A   154_A      A   154_A     0.887     0    0.044   0.053     1.215   85.952   86.857
LGA    Q   155_A      Q   155_A     0.909     0    0.040   0.943     2.282   88.214   83.757
LGA    F   156_A      F   156_A     0.744     0    0.025   0.191     1.387   90.476   88.009
LGA    I   157_A      I   157_A     0.418     0    0.018   0.096     0.785   92.857   94.048
LGA    Y   158_A      Y   158_A     0.740     0    0.349   0.489     2.842   79.881   85.437
LGA    D   159_A      D   159_A     0.666     0    0.120   1.171     6.678   75.952   53.155
LGA    K   160_A      K   160_A     2.360     0    0.636   1.085     3.916   58.214   64.656
LGA    K   161_A      K   161_A     8.336     0    0.040   0.917    16.421    6.548    2.910
LGA    K   162_A      K   162_A    10.527     0    0.156   1.062    13.421    0.119   11.323
LGA    N   163_A      N   163_A    15.529     0    0.664   1.322    16.866    0.000    0.000
LGA    S   164_A      S   164_A    18.171     0    0.199   0.301    18.958    0.000    0.000
LGA    S   165_A      S   165_A    18.945     0    0.478   0.650    19.686    0.000    0.000
LGA    S   166_A      S   166_A    19.649     0    0.646   0.929    21.300    0.000    0.000
LGA    V   167_A      V   167_A    22.250     0    0.617   0.808    24.735    0.000    0.000
LGA    D   168_A      D   168_A    17.464     0    0.646   0.962    19.020    0.000    0.000
LGA    K   169_A      K   169_A    16.323     0    0.094   0.828    19.648    0.000    0.159
LGA    L   170_A      L   170_A    20.659     0    0.021   0.551    24.188    0.000    0.000
LGA    A   171_A      A   171_A    24.017     0    0.017   0.033    26.758    0.000    0.000
LGA    A   172_A      A   172_A    24.219     0    0.048   0.044    25.783    0.000    0.000
LGA    A   173_A      A   173_A    24.940     0    0.597   0.545    26.187    0.000    0.000
LGA    L   174_A      L   174_A    28.136     0    0.293   1.007    33.595    0.000    0.000
LGA    E   175_A      E   175_A    25.480     0    0.621   1.051    26.324    0.000    0.000
LGA    H   176_A      H   176_A    23.740     0    0.642   0.949    25.018    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):    12.844         12.858                 12.912           59.236   55.600

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  176  176    4.0    133    1.85    64.062    64.519     6.824

LGA_LOCAL      RMSD:   1.849  Number of atoms:  133  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  16.708  Number of assigned atoms:  176 
Std_ASGN_ATOMS RMSD:  12.844  Standard rmsd on all 176 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.125173 * X  +  -0.093443 * Y  +  -0.987725 * Z  +   1.928539
  Y_new =  -0.581585 * X  +  -0.813479 * Y  +   0.003255 * Z  +  -2.992177
  Z_new =  -0.803797 * X  +   0.574039 * Y  +  -0.156171 * Z  +   1.471078 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -1.358802  0.933651  1.836424   [DEG:  -77.8536   53.4943  105.2194 ]
ZXZ: -1.574092  1.727609 -0.950631   [DEG:  -90.1888   98.9847  -54.4672 ]
 
# END of job
