
#######################################################
#                                                     #
#                        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  218 ( 1732),  selected  189 , name one
# Molecule2: number of CA atoms  189 ( 1470),  selected  189 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:C  -ch2:B  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   108      12_B - 119_B       4.83     6.11
  LCS_AVERAGE:     48.63

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    70      15_B - 84_B        1.96     7.00
  LONGEST_CONTINUOUS_SEGMENT:    70      16_B - 85_B        1.99     7.05
  LCS_AVERAGE:     22.86

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    38      38_B - 75_B        0.99     6.94
  LCS_AVERAGE:      9.86

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  189
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     E    12_C     E    12_B      4   22  108      3   14   41   65   89  106  127  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     Q    13_C     Q    13_B      4   22  108      3   13   41   74   97  120  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     L    14_C     L    14_B      4   22  108      3    4   17   59  101  121  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     F    15_C     F    15_B      4   70  108      3    4   29   71  107  122  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     Q    16_C     Q    16_B     17   70  108     17   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  176 
LCS_GDT     V    17_C     V    17_B     17   70  108     14   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     S    18_C     S    18_B     17   70  108     14   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     F    19_C     F    19_B     17   70  108     14   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     V    20_C     V    20_B     17   70  108     14   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     L    21_C     L    21_B     17   70  108     17   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     A    22_C     A    22_B     17   70  108     14   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     R    23_C     R    23_B     17   70  108     14   47   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     V    24_C     V    24_B     17   70  108     14   47   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     L    25_C     L    25_B     17   70  108     14   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     T    26_C     T    26_B     17   70  108     14   47   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     S    27_C     S    27_B     17   70  108     14   37   77  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     G    28_C     G    28_B     17   70  108      4   29   78  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     I    29_C     I    29_B     17   70  108     14   43   80  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     I    30_C     I    30_B     17   70  108      6   45   81  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     M    31_C     M    31_B     17   70  108      3   26   64   94  117  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     S    32_C     S    32_B     17   70  108      6   47   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     I    33_C     I    33_B      3   70  108      3   34   78  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     E    34_C     E    34_B      3   70  108      3    3    4   24   62  108  127  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     K    35_C     K    35_B      3   70  108      3    3    4    6   13   16   28   40   69   84  126  150  161  166  171  171  172  173  175  177 
LCS_GDT     N    36_C     N    36_B      3   70  108      3    3    4    6   10   16   20   26   45   75   85  125  161  166  171  171  172  173  175  177 
LCS_GDT     E    37_C     E    37_B     35   70  108      3   22   77  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     N    38_C     N    38_B     38   70  108     16   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     E    39_C     E    39_B     38   70  108     17   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     L    40_C     L    40_B     38   70  108     17   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     K    41_C     K    41_B     38   70  108     17   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     G    42_C     G    42_B     38   70  108     14   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     L    43_C     L    43_B     38   70  108     17   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     E    44_C     E    44_B     38   70  108     13   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     N    45_C     N    45_B     38   70  108     11   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     I    46_C     I    46_B     38   70  108     17   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     L    47_C     L    47_B     38   70  108      9   42   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     K    48_C     K    48_B     38   70  108      8   41   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     K    49_C     K    49_B     38   70  108      8   46   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     T    50_C     T    50_B     38   70  108      8   45   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     S    51_C     S    51_B     38   70  108      9   41   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     S    52_C     S    52_B     38   70  108     14   46   82  104  119  125  131  138  141  143  150  154  158  166  171  171  172  173  175  177 
LCS_GDT     K    53_C     K    53_B     38   70  108     14   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     Q    54_C     Q    54_B     38   70  108     14   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     Y    55_C     Y    55_B     38   70  108     14   41   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     A    56_C     A    56_B     38   70  108     14   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     V    57_C     V    57_B     38   70  108     14   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     T    58_C     T    58_B     38   70  108     17   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     F    59_C     F    59_B     38   70  108     14   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     N    60_C     N    60_B     38   70  108      4   47   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     S    61_C     S    61_B     38   70  108     12   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     I    62_C     I    62_B     38   70  108     10   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     S    63_C     S    63_B     38   70  108     10   37   77  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     G    64_C     G    64_B     38   70  108     10   43   81  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     A    65_C     A    65_B     38   70  108     17   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     V    66_C     V    66_B     38   70  108     10   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     I    67_C     I    67_B     38   70  108     10   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     G    68_C     G    68_B     38   70  108     11   45   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     S    69_C     S    69_B     38   70  108     10   45   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     L    70_C     L    70_B     38   70  108     17   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     W    71_C     W    71_B     38   70  108     17   48   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     G    72_C     G    72_B     38   70  108      8   45   79  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     Q    73_C     Q    73_B     38   70  108      4   45   80  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     D    74_C     D    74_B     38   70  108      9   45   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     I    75_C     I    75_B     38   70  108     17   47   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     V    76_C     V    76_B     23   70  108      6   47   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     Y    77_C     Y    77_B     22   70  108      6   18   73   99  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     G    78_C     G    78_B     22   70  108      6   24   62  101  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     E    79_C     E    79_B     22   70  108     10   47   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     A    80_C     A    80_B     22   70  108     13   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     T    81_C     T    81_B     16   70  108      6   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     N    82_C     N    82_B     16   70  108      8   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     Q    83_C     Q    83_B     16   70  108      3   45   80  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     Q    84_C     Q    84_B     14   70  108      4   26   72  104  119  125  130  137  141  143  148  153  157  166  171  171  172  173  175  176 
LCS_GDT     S    85_C     S    85_B      4   70  108      4    4   14   17   54   76  101  124  137  142  146  152  161  166  171  171  172  173  175  177 
LCS_GDT     L    86_C     L    86_B      4   69  108      4    4   29   45   66   88  112  127  136  140  145  150  156  162  171  171  172  173  175  177 
LCS_GDT     D    87_C     D    87_B     14   69  108      4   27   75  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     E    88_C     E    88_B     15   69  108      5   14   70  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     Q    89_C     Q    89_B     15   69  108      3   14   18   84  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     Q    90_C     Q    90_B     15   69  108      5   33   68  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     E    91_C     E    91_B     15   69  108      6   14   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     K    92_C     K    92_B     15   69  108      6   14   18   30  116  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     L    93_C     L    93_B     15   69  108      6   14   18   61  110  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     F    94_C     F    94_B     15   69  108      6   31   72  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     K    95_C     K    95_B     15   69  108      6   14   46  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     W    96_C     W    96_B     15   69  108      6   14   18   30   95  124  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     L    97_C     L    97_B     15   69  108      5   15   71  101  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     G    98_C     G    98_B     15   69  108      5   39   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     I    99_C     I    99_B     15   69  108     14   44   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     G   100_C     G   100_B     15   69  108      4   45   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     H   101_C     H   101_B     15   69  108      4    8   17  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     S   102_C     S   102_B     15   69  108      4   18   35   79  117  125  130  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     S   103_C     S   103_B      8   69  108      3   29   65  100  118  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     L   104_C     L   104_B      5   69  108      3   27   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     L   105_C     L   105_B      4   69  108      3    4   12   17   24   49   83  129  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     P   106_C     P   106_B      4   13  108      3    3    6    9   17   21   28   44   65   97  136  154  161  166  171  171  172  173  175  177 
LCS_GDT     E   107_C     E   107_B      4   10  108      3    5    5    9   17   21   29   40   55   72  100  121  140  164  171  171  172  173  175  177 
LCS_GDT     P   108_C     P   108_B      3   10  108      3    3    3    8   13   20   26   38   56   79  134  154  161  166  171  171  172  173  175  177 
LCS_GDT     Y   109_C     Y   109_B      5   10  108      3    4    6    9   17   21   29   40   55   72  100  130  161  166  171  171  172  173  175  177 
LCS_GDT     T   110_C     T   110_B      6   10  108      3    4    6   13   16   23   30   44   70  109  133  153  161  166  171  171  172  173  175  177 
LCS_GDT     L   111_C     L   111_B      6   10  108      3    5    6    9   17   21   30   40   56   77  111  134  161  166  171  171  172  173  175  177 
LCS_GDT     H   112_C     H   112_B      6   10  108      3    5    6   13   16   23   30   42   60   84  112  143  156  166  171  171  172  173  175  177 
LCS_GDT     A   113_C     A   113_B      6   10  108      3    5    6    9   17   21   41   52   65   82  111  128  152  166  171  171  172  173  175  177 
LCS_GDT     I   114_C     I   114_B      6   10  108      3    5    8   13   17   23   30   40   59   76  100  128  141  164  171  171  172  173  175  177 
LCS_GDT     N   115_C     N   115_B      6   10  108      3    5    6   13   19   35   44   58   67   91  112  136  161  166  171  171  172  173  175  177 
LCS_GDT     W   116_C     W   116_B      3    9  108      2    4    4    6   13   21   29   39   47   57   71   83  106  121  143  154  163  173  175  177 
LCS_GDT     G   117_C     G   117_B      3    6  108      3    3    4    7   14   21   29   35   45   54   62   77   96  114  131  144  161  170  175  177 
LCS_GDT     N   118_C     N   118_B      5    6  108      3    4    5   10   14   21   29   36   55   67   78   89  110  123  139  156  168  173  175  177 
LCS_GDT     I   119_C     I   119_B      5    6  108      3    4    5    9   14   21   29   36   45   54   60   72   77   90  109  124  135  148  165  175 
LCS_GDT     S   120_C     S   120_B      5    9   54      3    4    5    9   11   20   26   36   45   51   57   67   70   78   93  105  121  130  138  152 
LCS_GDT     N   121_C     N   121_B      8    9   54      3    6    7    9   14   21   29   36   45   51   58   67   75   83   98  115  127  134  144  158 
LCS_GDT     L   122_C     L   122_B      8    9   54      3    6    7    9   11   18   28   36   45   51   59   67   77   87   99  120  129  138  154  167 
LCS_GDT     Q   123_C     Q   123_B      8    9   54      4    6    7    8   14   21   29   36   45   54   62   72   84   93  115  125  139  154  169  177 
LCS_GDT     K   124_C     K   124_B      8    9   54      4    6    7   10   14   21   29   36   45   54   64   74   84   98  116  125  141  155  169  177 
LCS_GDT     I   125_C     I   125_B      8    9   54      4    6    7    8   14   21   29   36   45   51   60   67   77   85   99  120  129  138  152  172 
LCS_GDT     T   126_C     T   126_B      8    9   54      4    6    7    8   14   21   29   36   45   54   60   72   80   91  106  121  131  148  164  175 
LCS_GDT     H   127_C     H   127_B      8    9   72      3    6    7   10   14   21   29   36   45   54   64   74   86   97  115  125  139  155  169  177 
LCS_GDT     E   128_C     E   128_B      8    9   72      3    6    7    9   14   21   29   36   45   54   64   74   84   96  110  125  135  155  169  177 
LCS_GDT     E   129_C     E   129_B      3   10   72      3    3    8   10   14   21   29   36   50   63   72   80   91  115  131  152  168  173  175  177 
LCS_GDT     A   130_C     A   130_B      3   10   72      3    3    4    9   17   21   29   40   56   68   83  105  128  158  171  171  172  173  175  177 
LCS_GDT     H   131_C     H   131_B      8   10   72      3    5    8    9   12   19   29   44   57   81  113  133  161  166  171  171  172  173  175  177 
LCS_GDT     V   132_C     V   132_B      8   10   72      3    7    8   15   18   28   43   60  101  138  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     T   133_C     T   133_B      8   10   72      4    7    8   10   19   26   43   59  101  138  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     L   134_C     L   134_B      8   10   72      4    7    8   13   19   29   57   97  135  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     L   135_C     L   135_B      8   10   72      4    7    8   13   19   26   41   63  101  138  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     D   136_C     D   136_B      8   10   72      3    7    8   16   29   41   57   91  123  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     F   137_C     F   137_B      8   10   72      4    7    8   13   20   34   44   59   84  118  146  154  161  166  171  171  172  173  175  177 
LCS_GDT     T   138_C     T   138_B      8   10   72      3    7    8   21   32   47   80  107  126  141  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     K   139_C     K   139_B      3   26   72      2   10   18   36   61   77  118  127  137  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     L   140_C     L   140_B      3   26   72      0   11   20   51   92  114  128  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     G   141_C     G   141_B      5   26   72      0    9   23   51   92  116  128  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     F   142_C     F   142_B     23   26   72      6   31   71  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     G   143_C     G   143_B     23   26   72     17   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     P   144_C     P   144_B     23   26   72     12   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     C   145_C     C   145_B     23   26   72     13   47   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     A   146_C     A   146_B     23   26   72     13   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     V   147_C     V   147_B     23   26   72     11   45   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     L   148_C     L   148_B     23   26   72     17   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     L   149_C     L   149_B     23   26   72     17   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     T   150_C     T   150_B     23   26   72     12   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     N   151_C     N   151_B     23   26   72     14   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     N   152_C     N   152_B     23   26   72     14   37   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     E   153_C     E   153_B     23   26   72     14   34   78  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     T   154_C     T   154_B     23   26   72     14   34   69  102  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     I   155_C     I   155_B     23   26   72     12   37   78  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     Y   156_C     Y   156_B     23   26   72     14   45   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     K   157_C     K   157_B     23   26   72     14   34   72  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     K   158_C     K   158_B     23   26   72     14   34   72  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     S   159_C     S   159_B     23   26   72     14   40   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     E   160_C     E   160_B     23   26   72     14   39   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     R   161_C     R   161_B     23   26   72     14   34   78  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     L   162_C     L   162_B     23   26   72     10   41   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     K   163_C     K   163_B     23   26   72      4   17   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     I   164_C     I   164_B     23   26   72      3   20   75  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     F   165_C     F   165_B      3   26   72      3    8   14   22   28   81  111  131  137  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     G   166_C     G   166_B      3    6   72      3    3    4    6    9   13   31   87  105  130  148  154  161  166  171  171  172  173  175  177 
LCS_GDT     A   167_C     A   167_B      3    6   72      1    3    4   20   28   47   95  128  134  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     F   168_C     F   168_B      3    6   72      3   21   64   94  115  124  131  137  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     D   169_C     D   169_B      3    6   72      3    3   11   37   72  104  118  131  135  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     L   170_C     L   170_B      3    6   72      3    3   11   16   31   72   94  115  125  136  144  149  156  166  171  171  172  173  175  177 
LCS_GDT     E   182_C     E   182_B      5    5   72      1    5    5    5   11   13   14   26   30   44   60   64   83  101  122  138  157  166  170  172 
LCS_GDT     I   183_C     I   183_B      5   19   72      3    5   10   13   19   26   36   46   72  102  117  124  142  151  157  168  172  173  175  177 
LCS_GDT     K   184_C     K   184_B      5   26   72      3    5    6   10   33   47   94  120  131  140  145  153  158  166  171  171  172  173  175  177 
LCS_GDT     P   185_C     P   185_B     21   26   72      3   12   45   71   96  114  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     G   186_C     G   186_B     21   26   72      3    9   42   81   98  124  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     L   187_C     L   187_B     21   26   72     10   27   60   89  113  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     Q   188_C     Q   188_B     21   26   72      5   31   80  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     F   189_C     F   189_B     21   26   72      4   37   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     N   190_C     N   190_B     21   26   72      7   47   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     F   191_C     F   191_B     21   26   72     14   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     R   192_C     R   192_B     21   26   72      3   40   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     L   193_C     L   193_B     21   26   72      8   40   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     S   194_C     S   194_B     21   26   72     14   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     P   195_C     P   195_B     21   26   72     17   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     L   196_C     L   196_B     21   26   72     17   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     V   197_C     V   197_B     21   26   72     15   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     G   198_C     G   198_B     21   26   72     17   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     A   199_C     A   199_B     21   26   72     17   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     C   200_C     C   200_B     21   26   72     17   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     I   201_C     I   201_B     21   26   72     17   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     K   202_C     K   202_B     21   26   72     12   49   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     M   203_C     M   203_B     21   26   72      7   40   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     A   204_C     A   204_B     21   26   72      7   39   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     L   205_C     L   205_B     21   26   72      6   39   82  104  119  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     I   206_C     I   206_B     21   26   72      5   30   65  100  117  125  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     K   207_C     K   207_B     15   26   72      5   12   41   68  100  120  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     M   208_C     M   208_B     14   26   72      5   10   17   50   80  117  131  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     G   209_C     G   209_B     12   26   72      3    8   33   48   83  107  129  138  141  143  150  154  161  166  171  171  172  173  175  177 
LCS_GDT     L   210_C     L   210_B      3    4   72      3    3    3    4   16   23   33   75   87  124  133  139  144  147  153  157  165  169  173  173 
LCS_GDT     N   211_C     N   211_B      3    4   72      0    3    3    4    5    5   22   26   33   57   70   77  104  120  134  147  153  159  169  172 
LCS_AVERAGE  LCS_A:  27.12  (   9.86   22.86   48.63 )

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     17     49     82    104    119    125    131    138    141    143    150    154    161    166    171    171    172    173    175    177 
GDT PERCENT_AT   8.99  25.93  43.39  55.03  62.96  66.14  69.31  73.02  74.60  75.66  79.37  81.48  85.19  87.83  90.48  90.48  91.01  91.53  92.59  93.65
GDT RMS_LOCAL    0.35   0.73   1.02   1.23   1.40   1.51   1.73   1.99   2.07   2.17   2.67   2.96   3.49   3.64   3.95   3.95   4.02   4.15   4.37   4.90
GDT RMS_ALL_AT   6.83   7.05   7.00   7.01   7.05   7.02   6.88   6.79   6.78   6.76   6.59   6.49   6.33   6.31   6.22   6.22   6.20   6.17   6.11   5.99

# Checking swapping
#   possible swapping detected:  F    19_C      F    19_B
#   possible swapping detected:  E    37_C      E    37_B
#   possible swapping detected:  E    44_C      E    44_B
#   possible swapping detected:  F    59_C      F    59_B
#   possible swapping detected:  E    79_C      E    79_B
#   possible swapping detected:  E    88_C      E    88_B
#   possible swapping detected:  E   129_C      E   129_B
#   possible swapping detected:  F   137_C      F   137_B
#   possible swapping detected:  E   153_C      E   153_B
#   possible swapping detected:  E   160_C      E   160_B
#   possible swapping detected:  F   189_C      F   189_B

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    E    12_C      E    12_B     5.078     4    0.064   0.076     5.449   28.810   15.714
LGA    Q    13_C      Q    13_B     4.195     0    0.042   1.030     5.210   37.143   34.709
LGA    L    14_C      L    14_B     4.091     0    0.629   0.848     6.399   40.238   34.762
LGA    F    15_C      F    15_B     3.721     0    0.608   0.599     4.751   42.262   39.091
LGA    Q    16_C      Q    16_B     1.062     0    0.216   0.535     4.263   83.690   64.656
LGA    V    17_C      V    17_B     1.326     0    0.094   0.929     3.049   81.429   75.714
LGA    S    18_C      S    18_B     1.362     0    0.035   0.683     3.569   81.429   73.651
LGA    F    19_C      F    19_B     1.612     0    0.021   0.353     3.687   77.143   63.939
LGA    V    20_C      V    20_B     1.171     0    0.070   1.309     2.502   83.690   76.871
LGA    L    21_C      L    21_B     0.474     0    0.031   1.438     3.933   92.857   77.500
LGA    A    22_C      A    22_B     1.246     0    0.027   0.046     1.661   79.286   78.000
LGA    R    23_C      R    23_B     1.804     0    0.053   0.836     2.885   72.857   70.909
LGA    V    24_C      V    24_B     1.606     0    0.015   1.070     3.436   75.000   72.041
LGA    L    25_C      L    25_B     1.195     0    0.034   0.914     2.258   79.286   78.333
LGA    T    26_C      T    26_B     1.881     0    0.060   0.951     3.853   66.905   60.816
LGA    S    27_C      S    27_B     2.429     0    0.647   0.750     4.138   55.952   58.889
LGA    G    28_C      G    28_B     2.575     0    0.212   0.212     2.645   60.952   60.952
LGA    I    29_C      I    29_B     2.145     0    0.191   0.637     3.861   68.810   61.310
LGA    I    30_C      I    30_B     1.879     0    0.592   1.146     5.569   68.810   56.726
LGA    M    31_C      M    31_B     2.696     0    0.140   0.425     9.281   65.000   41.845
LGA    S    32_C      S    32_B     1.042     0    0.568   0.822     2.973   77.619   78.968
LGA    I    33_C      I    33_B     1.712     0    0.182   1.333     6.542   83.810   56.786
LGA    E    34_C      E    34_B     4.869     0    0.179   0.776     9.866   36.548   19.735
LGA    K    35_C      K    35_B     8.218     0    0.569   0.849    15.884    5.357    2.540
LGA    N    36_C      N    36_B     8.564     0    0.702   1.156    13.608   10.476    5.238
LGA    E    37_C      E    37_B     2.019     0    0.246   1.221     4.562   57.976   52.540
LGA    N    38_C      N    38_B     0.803     0    0.170   0.914     5.021   88.214   68.452
LGA    E    39_C      E    39_B     0.545     0    0.064   0.367     1.694   90.476   88.519
LGA    L    40_C      L    40_B     0.773     0    0.041   1.469     3.711   90.476   76.310
LGA    K    41_C      K    41_B     1.214     0    0.556   1.374     3.473   73.571   65.556
LGA    G    42_C      G    42_B     1.234     0    0.084   0.084     1.368   85.952   85.952
LGA    L    43_C      L    43_B     0.679     0    0.073   1.156     2.797   90.476   82.976
LGA    E    44_C      E    44_B     1.011     0    0.049   0.740     2.026   83.690   81.693
LGA    N    45_C      N    45_B     1.301     0    0.059   0.837     1.908   81.429   80.417
LGA    I    46_C      I    46_B     1.244     0    0.027   1.360     4.144   81.429   72.738
LGA    L    47_C      L    47_B     1.623     0    0.054   1.446     3.339   75.000   72.143
LGA    K    48_C      K    48_B     1.507     0    0.037   1.443     7.722   75.000   58.307
LGA    K    49_C      K    49_B     1.332     0    0.028   0.525     3.786   81.429   68.413
LGA    T    50_C      T    50_B     1.473     0    0.034   1.152     3.412   79.286   72.245
LGA    S    51_C      S    51_B     1.512     0    0.035   0.648     2.166   77.143   75.794
LGA    S    52_C      S    52_B     1.418     0    0.068   0.722     2.329   81.429   77.222
LGA    K    53_C      K    53_B     0.730     0    0.072   0.561     1.420   90.476   88.519
LGA    Q    54_C      Q    54_B     0.935     0    0.111   1.291     3.654   83.810   73.810
LGA    Y    55_C      Y    55_B     1.270     0    0.053   0.149     2.219   85.952   74.524
LGA    A    56_C      A    56_B     0.891     0    0.044   0.076     1.144   85.952   85.048
LGA    V    57_C      V    57_B     0.874     0    0.032   0.085     1.324   90.476   86.599
LGA    T    58_C      T    58_B     0.522     0    0.036   1.075     3.073   92.857   82.381
LGA    F    59_C      F    59_B     0.441     0    0.087   0.275     1.483   95.238   90.606
LGA    N    60_C      N    60_B     1.150     0    0.248   1.075     3.611   85.952   73.690
LGA    S    61_C      S    61_B     1.017     0    0.096   0.550     1.866   88.214   86.032
LGA    I    62_C      I    62_B     1.340     0    0.034   1.387     4.424   77.143   65.893
LGA    S    63_C      S    63_B     2.243     0    0.071   0.688     2.532   66.786   67.619
LGA    G    64_C      G    64_B     1.907     0    0.049   0.049     1.907   72.857   72.857
LGA    A    65_C      A    65_B     0.798     0    0.033   0.042     1.149   88.214   88.667
LGA    V    66_C      V    66_B     0.953     0    0.042   0.179     2.288   90.476   81.769
LGA    I    67_C      I    67_B     1.560     0    0.058   1.283     4.839   79.286   70.952
LGA    G    68_C      G    68_B     1.743     0    0.077   0.077     1.758   75.000   75.000
LGA    S    69_C      S    69_B     1.301     0    0.024   0.654     3.007   81.429   76.190
LGA    L    70_C      L    70_B     0.482     0    0.084   0.225     1.078   92.857   92.917
LGA    W    71_C      W    71_B     1.372     0    0.090   1.563     4.649   79.405   63.265
LGA    G    72_C      G    72_B     1.893     0    0.051   0.051     2.059   70.833   70.833
LGA    Q    73_C      Q    73_B     1.726     0    0.230   1.252     3.787   72.857   68.677
LGA    D    74_C      D    74_B     1.540     0    0.076   0.260     2.513   79.405   72.143
LGA    I    75_C      I    75_B     0.664     0    0.248   0.232     1.300   85.952   87.143
LGA    V    76_C      V    76_B     1.803     0    0.033   1.169     3.642   75.000   66.599
LGA    Y    77_C      Y    77_B     2.657     0    0.079   1.337     5.076   59.048   57.421
LGA    G    78_C      G    78_B     2.680     0    0.050   0.050     2.680   59.048   59.048
LGA    E    79_C      E    79_B     1.843     0    0.075   1.067     2.420   72.976   71.164
LGA    A    80_C      A    80_B     1.705     0    0.036   0.070     2.075   70.833   69.619
LGA    T    81_C      T    81_B     1.863     0    0.174   1.069     3.316   68.929   68.571
LGA    N    82_C      N    82_B     1.784     0    0.138   0.495     3.655   75.000   66.250
LGA    Q    83_C      Q    83_B     2.295     0    0.651   0.734     6.005   68.810   45.185
LGA    Q    84_C      Q    84_B     3.077     0    0.623   0.675     9.839   53.571   29.894
LGA    S    85_C      S    85_B     5.777     0    0.562   0.750    10.177   26.548   18.175
LGA    L    86_C      L    86_B     5.548     0    0.278   0.395     9.670   30.476   18.512
LGA    D    87_C      D    87_B     2.636     0    0.035   1.215     5.346   61.548   50.060
LGA    E    88_C      E    88_B     2.320     0    0.617   0.796     6.206   56.548   40.794
LGA    Q    89_C      Q    89_B     2.396     0    0.109   0.844     3.710   64.881   58.307
LGA    Q    90_C      Q    90_B     2.275     0    0.049   1.433     7.334   64.881   46.984
LGA    E    91_C      E    91_B     1.653     0    0.031   1.155     5.442   68.810   57.354
LGA    K    92_C      K    92_B     2.793     0    0.030   1.111     9.134   57.262   38.360
LGA    L    93_C      L    93_B     3.145     0    0.027   0.921     3.804   55.357   51.845
LGA    F    94_C      F    94_B     1.978     0    0.076   0.866     4.875   70.833   59.091
LGA    K    95_C      K    95_B     2.063     0    0.033   0.926     5.822   66.786   49.788
LGA    W    96_C      W    96_B     3.168     0    0.080   0.267     4.980   55.357   42.415
LGA    L    97_C      L    97_B     2.212     0    0.027   0.892     4.618   69.048   62.024
LGA    G    98_C      G    98_B     1.132     0    0.316   0.316     1.549   83.929   83.929
LGA    I    99_C      I    99_B     0.426     0    0.145   1.100     2.111   88.333   82.857
LGA    G   100_C      G   100_B     1.754     0    0.104   0.104     1.754   81.667   81.667
LGA    H   101_C      H   101_B     2.776     0    0.046   1.082     7.951   50.357   34.143
LGA    S   102_C      S   102_B     3.576     0    0.216   0.596     4.258   53.690   49.206
LGA    S   103_C      S   103_B     2.420     0    0.642   0.576     4.542   52.619   56.667
LGA    L   104_C      L   104_B     2.112     0    0.597   0.489     5.769   48.571   44.405
LGA    L   105_C      L   105_B     5.967     0    0.074   1.369     7.696   22.024   17.083
LGA    P   106_C      P   106_B    10.422     0    0.645   0.694    12.363    0.833    0.476
LGA    E   107_C      E   107_B    11.953     0    0.650   0.676    18.565    0.000    0.000
LGA    P   108_C      P   108_B     9.149     0    0.618   0.545    10.790    0.476    0.476
LGA    Y   109_C      Y   109_B    10.635     0    0.615   1.168    16.203    0.238    0.079
LGA    T   110_C      T   110_B    10.192     0    0.130   0.168    12.146    0.000    0.000
LGA    L   111_C      L   111_B    10.628     0    0.048   1.007    14.792    0.119    0.060
LGA    H   112_C      H   112_B    10.869     0    0.047   1.440    12.006    0.000    0.190
LGA    A   113_C      A   113_B    11.394     0    0.253   0.307    11.852    0.000    0.000
LGA    I   114_C      I   114_B    11.583     0    0.128   1.253    15.420    0.000    0.000
LGA    N   115_C      N   115_B    11.370     0    0.522   1.274    12.858    0.000    2.083
LGA    W   116_C      W   116_B    16.115     0    0.679   0.708    18.684    0.000    0.000
LGA    G   117_C      G   117_B    17.534     0    0.684   0.684    17.534    0.000    0.000
LGA    N   118_C      N   118_B    16.292     0    0.637   0.713    18.588    0.000    0.000
LGA    I   119_C      I   119_B    19.045     0    0.094   0.112    21.449    0.000    0.000
LGA    S   120_C      S   120_B    22.917     0    0.680   0.685    23.919    0.000    0.000
LGA    N   121_C      N   121_B    22.218     0    0.511   0.957    22.527    0.000    0.000
LGA    L   122_C      L   122_B    19.643     0    0.129   0.225    20.375    0.000    0.000
LGA    Q   123_C      Q   123_B    18.886     0    0.030   1.545    21.218    0.000    0.000
LGA    K   124_C      K   124_B    19.764     4    0.066   0.065    20.558    0.000    0.000
LGA    I   125_C      I   125_B    20.078     0    0.068   0.978    23.021    0.000    0.000
LGA    T   126_C      T   126_B    18.196     0    0.109   1.208    18.965    0.000    0.000
LGA    H   127_C      H   127_B    18.458     0    0.552   1.289    19.674    0.000    0.000
LGA    E   128_C      E   128_B    18.227     0    0.575   0.565    20.707    0.000    0.000
LGA    E   129_C      E   129_B    15.906     0    0.055   0.896    16.629    0.000    0.000
LGA    A   130_C      A   130_B    13.009     0    0.380   0.400    15.207    0.000    0.000
LGA    H   131_C      H   131_B    10.437     0    0.702   1.481    11.205    0.476    0.190
LGA    V   132_C      V   132_B     7.990     0    0.219   1.132     8.734    5.476    7.891
LGA    T   133_C      T   133_B     8.320     0    0.031   1.059     9.064    5.952    4.694
LGA    L   134_C      L   134_B     6.849     0    0.049   1.234     7.439   10.833   14.524
LGA    L   135_C      L   135_B     8.054     0    0.103   0.879    10.439    6.548    5.119
LGA    D   136_C      D   136_B     7.418     0    0.074   0.215     7.997    7.857   12.083
LGA    F   137_C      F   137_B     8.881     0    0.437   1.403    10.332    2.976    1.688
LGA    T   138_C      T   138_B     7.453     0    0.619   0.992     8.310    7.976   11.769
LGA    K   139_C      K   139_B     6.204     0    0.526   1.113     9.533   14.048   13.492
LGA    L   140_C      L   140_B     4.513     0    0.720   1.221     5.868   28.929   31.845
LGA    G   141_C      G   141_B     4.362     0    0.559   0.559     5.298   35.952   35.952
LGA    F   142_C      F   142_B     1.774     0    0.677   1.038     6.200   61.905   56.190
LGA    G   143_C      G   143_B     0.828     0    0.152   0.152     0.828   92.857   92.857
LGA    P   144_C      P   144_B     1.200     0    0.058   0.132     1.456   81.429   81.429
LGA    C   145_C      C   145_B     1.189     0    0.105   0.659     2.646   81.429   77.381
LGA    A   146_C      A   146_B     1.045     0    0.117   0.157     1.068   81.429   83.238
LGA    V   147_C      V   147_B     1.303     0    0.055   1.144     3.131   81.429   75.714
LGA    L   148_C      L   148_B     0.985     0    0.078   1.204     2.717   88.214   81.964
LGA    L   149_C      L   149_B     0.963     0    0.073   1.167     3.629   85.952   79.107
LGA    T   150_C      T   150_B     1.155     0    0.041   0.113     1.387   81.429   81.429
LGA    N   151_C      N   151_B     0.930     0    0.116   1.116     3.029   81.548   77.619
LGA    N   152_C      N   152_B     1.520     0    0.054   0.124     2.570   75.000   69.940
LGA    E   153_C      E   153_B     1.747     0    0.055   1.133     3.867   72.857   67.037
LGA    T   154_C      T   154_B     2.284     0    0.051   1.105     3.115   64.762   62.653
LGA    I   155_C      I   155_B     1.633     0    0.037   0.180     2.064   77.143   72.976
LGA    Y   156_C      Y   156_B     0.920     0    0.024   0.161     2.294   83.690   79.405
LGA    K   157_C      K   157_B     1.735     0    0.031   0.205     3.110   72.857   65.026
LGA    K   158_C      K   158_B     1.723     0    0.061   0.147     1.840   72.857   75.714
LGA    S   159_C      S   159_B     1.103     0    0.054   0.079     1.336   83.690   84.444
LGA    E   160_C      E   160_B     1.212     0    0.044   0.964     4.081   81.429   66.085
LGA    R   161_C      R   161_B     1.680     0    0.126   1.559     7.129   70.833   53.506
LGA    L   162_C      L   162_B     1.012     0    0.081   1.387     4.905   85.952   74.286
LGA    K   163_C      K   163_B     1.496     0    0.623   0.483     3.843   69.762   75.291
LGA    I   164_C      I   164_B     1.739     0    0.272   1.081     8.738   67.143   44.762
LGA    F   165_C      F   165_B     5.781     0    0.180   0.519     9.074   20.714   15.584
LGA    G   166_C      G   166_B     7.012     0    0.435   0.435     9.527    9.762    9.762
LGA    A   167_C      A   167_B     6.677     0    0.673   0.672     9.058   19.524   15.905
LGA    F   168_C      F   168_B     3.598     0    0.454   1.124     8.034   41.786   29.481
LGA    D   169_C      D   169_B     6.555     0    0.142   1.144     8.360   13.571   11.071
LGA    L   170_C      L   170_B     8.690     0    0.547   1.087    12.352    4.405    2.560
LGA    E   182_C      E   182_B    15.449     4    0.549   0.558    16.641    0.000    0.000
LGA    I   183_C      I   183_B    11.552     0    0.248   1.490    13.105    2.143    1.071
LGA    K   184_C      K   184_B     7.347     4    0.083   0.115     9.127   11.548    5.450
LGA    P   185_C      P   185_B     3.894     0    0.653   0.871     4.065   48.452   46.327
LGA    G   186_C      G   186_B     3.366     0    0.299   0.299     3.704   51.905   51.905
LGA    L   187_C      L   187_B     2.715     0    0.117   0.167     4.151   67.143   56.131
LGA    Q   188_C      Q   188_B     1.364     0    0.155   1.178     6.432   77.143   56.138
LGA    F   189_C      F   189_B     1.176     0    0.118   0.435     3.343   85.952   75.844
LGA    N   190_C      N   190_B     0.815     0    0.085   0.090     1.064   88.214   89.345
LGA    F   191_C      F   191_B     0.354     0    0.399   0.413     1.463   92.976   88.918
LGA    R   192_C      R   192_B     1.281     0    0.113   0.741     2.139   79.286   80.779
LGA    L   193_C      L   193_B     0.976     0    0.088   0.266     1.576   88.214   84.881
LGA    S   194_C      S   194_B     0.425     0    0.113   0.135     0.634   97.619   96.825
LGA    P   195_C      P   195_B     0.317     0    0.063   0.513     2.479  100.000   89.728
LGA    L   196_C      L   196_B     0.328     0    0.019   1.400     3.581  100.000   80.119
LGA    V   197_C      V   197_B     0.457     0    0.061   1.169     2.904  100.000   88.639
LGA    G   198_C      G   198_B     0.555     0    0.036   0.036     0.626   92.857   92.857
LGA    A   199_C      A   199_B     0.463     0    0.065   0.067     0.675  100.000   98.095
LGA    C   200_C      C   200_B     0.340     0    0.033   0.810     3.105  100.000   91.667
LGA    I   201_C      I   201_B     0.534     0    0.087   0.603     2.692   92.857   87.500
LGA    K   202_C      K   202_B     0.565     0    0.035   0.798     1.878   95.238   88.624
LGA    M   203_C      M   203_B     0.916     0    0.049   1.179     3.172   88.214   77.857
LGA    A   204_C      A   204_B     1.077     0    0.052   0.078     1.784   81.548   81.524
LGA    L   205_C      L   205_B     1.103     0    0.084   0.206     2.017   79.524   81.607
LGA    I   206_C      I   206_B     2.282     0    0.036   1.396     7.358   57.738   46.607
LGA    K   207_C      K   207_B     3.771     0    0.048   1.271    11.287   40.476   27.725
LGA    M   208_C      M   208_B     4.227     0    0.395   1.148     9.481   38.690   27.202
LGA    G   209_C      G   209_B     5.253     0    0.065   0.065     8.810   18.452   18.452
LGA    L   210_C      L   210_B     9.405     0    0.563   1.239    12.299    3.690    1.905
LGA    N   211_C      N   211_B    14.750     0    0.620   1.127    18.147    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      189     756    756  100.00    1470   1470  100.00               189
SUMMARY(RMSD_GDC):     5.935          5.931                  6.447           56.119   50.954

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  218  189    4.0    138    1.99    61.111    54.672     6.591

LGA_LOCAL      RMSD:   1.994  Number of atoms:  138  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   6.794  Number of assigned atoms:  189 
Std_ASGN_ATOMS RMSD:   5.935  Standard rmsd on all 189 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.346339 * X  +   0.400777 * Y  +   0.848190 * Z  +  12.909617
  Y_new =   0.521963 * X  +   0.833597 * Y  +  -0.180750 * Z  +  -0.205879
  Z_new =  -0.779489 * X  +   0.380124 * Y  +  -0.497898 * Z  +  -0.412092 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  2.156625  0.893850  2.489535   [DEG:  123.5655   51.2138  142.6398 ]
ZXZ:  1.360836  2.091970 -1.117072   [DEG:   77.9702  119.8610  -64.0035 ]
 
# END of job
