
#######################################################
#                                                     #
#                        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  222 ( 1696),  selected  222 , name one
# Molecule2: number of CA atoms  222 ( 1696),  selected  222 , 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:   150      64_A - 213_A       4.91    16.49
  LONGEST_CONTINUOUS_SEGMENT:   150      65_A - 214_A       4.95    16.28
  LONGEST_CONTINUOUS_SEGMENT:   150      66_A - 215_A       4.98    16.17
  LONGEST_CONTINUOUS_SEGMENT:   150      67_A - 216_A       4.92    16.03
  LONGEST_CONTINUOUS_SEGMENT:   150      68_A - 217_A       4.91    15.82
  LCS_AVERAGE:     60.53

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   132      75_A - 206_A       1.98    17.67
  LCS_AVERAGE:     42.30

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   126      74_A - 199_A       0.99    18.34
  LONGEST_CONTINUOUS_SEGMENT:   126      75_A - 200_A       0.83    18.11
  LCS_AVERAGE:     35.97

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  222
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     G     1_A     G     1_A      3   36   84      2    3    3    3    7   34   42   53   58   64   69   73   79   80   86   88   93   96  100  122 
LCS_GDT     P     2_A     P     2_A      3   40   84      3    3    3   26   34   41   48   53   58   65   73   74   79   80   86   89   93   96  100  104 
LCS_GDT     H     3_A     H     3_A     18   40   84      3    3    3    8   15   34   42   45   58   63   67   72   79   79   87   89   93   96  101  104 
LCS_GDT     M     4_A     M     4_A     22   40   84      7   15   21   28   30   40   47   53   58   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     E     5_A     E     5_A     23   40   84      7   15   21   28   30   40   48   52   59   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     Q     6_A     Q     6_A     23   40   84      7   16   24   28   33   40   48   53   59   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     L     7_A     L     7_A     23   40   84      8   18   24   28   33   41   48   53   59   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     E     8_A     E     8_A     23   40   84      8   18   24   28   33   41   48   53   59   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     G     9_A     G     9_A     23   40   84      8   18   24   28   34   41   48   53   59   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     I    10_A     I    10_A     23   40   84      7   18   24   28   34   41   48   53   59   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     M    11_A     M    11_A     23   40   84      6   13   21   28   34   41   48   53   59   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     L    12_A     L    12_A     23   40   84      7   18   24   28   34   41   48   53   59   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     S    13_A     S    13_A     23   40   84      8   18   24   28   34   41   48   53   59   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     P    14_A     P    14_A     23   40   84     10   18   24   28   34   41   48   53   59   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     A    15_A     A    15_A     23   40   84     10   18   24   28   34   41   48   53   59   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     F    16_A     F    16_A     23   40   84     10   18   24   28   34   41   48   53   59   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     Q    17_A     Q    17_A     23   40   84     10   18   24   28   34   41   48   53   59   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     E    18_A     E    18_A     23   40   84     10   18   24   28   34   41   48   53   59   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     Q    19_A     Q    19_A     23   40   84     10   18   24   28   34   41   48   53   59   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     M    20_A     M    20_A     23   40   84     10   18   24   28   34   41   48   53   59   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     N    21_A     N    21_A     23   40   84     10   18   24   28   34   41   48   53   59   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     A    22_A     A    22_A     23   40   84     10   18   24   28   34   41   48   53   59   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     L    23_A     L    23_A     23   40   84     10   18   24   28   34   41   48   53   59   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     M    24_A     M    24_A     23   40   84      8   18   24   28   34   41   48   53   59   66   73   78   85   87   88   93   97  100  116  133 
LCS_GDT     L    25_A     L    25_A     23   40   84      7   18   24   28   34   41   48   53   59   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     D    26_A     D    26_A     23   40   84      3   16   24   28   34   41   48   53   59   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     P    27_A     P    27_A     23   40   84      3   18   24   28   34   41   48   53   59   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     R    28_A     R    28_A     23   40   84      8   18   24   28   34   41   48   53   59   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     M    29_A     M    29_A     21   40   84      8   12   23   28   34   41   48   53   59   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     L    30_A     L    30_A     19   40   84      8   12   19   28   34   41   48   53   59   66   73   78   85   87   88   93   97  100  102  112 
LCS_GDT     D    31_A     D    31_A     19   40   84      8   18   24   28   34   41   48   53   59   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     M    32_A     M    32_A     15   40   84      8   15   23   28   34   41   48   53   59   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     M    33_A     M    33_A     15   40   84      8   12   20   26   34   39   48   53   59   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     I    34_A     I    34_A     15   40   84      8   18   24   28   34   41   48   53   59   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     D    35_A     D    35_A     15   40   84      8   12   23   28   34   41   48   53   58   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     Q    36_A     Q    36_A     15   40   84      8   12   19   26   34   39   48   53   58   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     N    37_A     N    37_A     15   40   84      5   12   20   26   34   39   48   53   58   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     P    38_A     P    38_A     15   40   84      5   12   19   26   34   39   48   53   58   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     Q    39_A     Q    39_A     15   40   84      5   15   23   26   34   41   48   53   58   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     L    40_A     L    40_A     15   40   84      7   18   23   28   34   41   48   53   58   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     R    41_A     R    41_A     15   40   84      4   12   23   28   34   41   48   53   58   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     N    42_A     N    42_A     13   40   84      4   11   19   23   29   41   48   53   58   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     M    43_A     M    43_A     13   40   84      8   12   19   23   31   41   48   53   58   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     G    44_A     G    44_A     13   40   84      8   12   19   23   29   41   48   53   58   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     P    45_A     P    45_A     13   37   84      8   12   19   23   29   41   48   53   58   66   73   78   85   87   88   93   97  100  102  104 
LCS_GDT     E    46_A     E    46_A     13   30   84      8   12   19   23   29   37   48   53   58   66   73   78   85   87   88   93   97  143  145  147 
LCS_GDT     A    47_A     A    47_A     12   30   84      8   12   19   23   29   35   48   53   58   66   73   78   85   87   88   93  139  144  145  147 
LCS_GDT     R    48_A     R    48_A     11   30   84      8   10   19   23   29   41   48   53   58   66   73   78   85  125  141  142  144  146  147  148 
LCS_GDT     Q    49_A     Q    49_A     12   30   84      8   10   19   23   29   41   48   55   76   97  120  133  137  139  141  142  144  146  147  148 
LCS_GDT     M    50_A     M    50_A     12   30   84      8   11   19   23   27   33   42   51   58  116  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     L    51_A     L    51_A     12   30   84      7   11   13   21   27   32   39   47   67  119  128  135  137  139  141  142  144  146  147  148 
LCS_GDT     R    52_A     R    52_A     12   30  148      8   11   13   16   22   31   39   65   85  106  113  126  130  136  140  142  142  146  147  148 
LCS_GDT     P    53_A     P    53_A     12   30  149      8   11   13   17   29   41   48   53   58  116  127  127  128  131  132  136  140  143  146  148 
LCS_GDT     M    54_A     M    54_A     12   30  149      8   11   14   23   29   41   48   53   58   83  127  127  128  132  133  136  140  143  146  148 
LCS_GDT     F    55_A     F    55_A     12   30  149      8   11   13   16   22   34   47   53   88  104  111  127  128  129  133  135  138  143  146  148 
LCS_GDT     R    56_A     R    56_A     12   21  149      8   11   13   16   22   26   35   45   58   66   88  111  118  132  133  134  135  139  140  142 
LCS_GDT     E    57_A     E    57_A     12   21  149      8   11   16   20   22   36   48   53   67   83  119  128  132  132  135  135  137  139  140  142 
LCS_GDT     M    58_A     M    58_A     12   21  149      8   11   13   23   29   41   48   53   59   78  103  128  132  132  135  135  137  139  140  142 
LCS_GDT     M    59_A     M    59_A     12   21  149      8   11   13   16   22   26   35   45   52   66   73   78   90  105  117  123  130  132  133  138 
LCS_GDT     S    60_A     S    60_A     12   21  149      8   11   13   16   22   24   29   33   41   56   71   78   85   87   88   93  100  129  132  134 
LCS_GDT     N    61_A     N    61_A     12   21  149      5   11   13   16   22   24   38   50   59   66   73   78   85   87   95  116  132  138  139  141 
LCS_GDT     P    62_A     P    62_A     16   23  149      9   14   17   23   27   34   44   50   59   66   73   78   85   87   88   93   97  114  136  141 
LCS_GDT     E    63_A     E    63_A     16   23  149      9   15   17   23   27   34   44   50   59   65   73   78   85   94  121  132  137  138  139  141 
LCS_GDT     S    64_A     S    64_A     16   23  150      9   15   17   23   38   54   82   99  115  123  129  130  132  132  135  135  137  139  140  142 
LCS_GDT     M    65_A     M    65_A     16   23  150      9   15   17   23   27   36   45   57   71  106  124  130  132  132  135  135  137  139  140  142 
LCS_GDT     R    66_A     R    66_A     16   23  150      9   15   17   23   27   36   48   53   59   66   73   78   85  115  129  134  137  138  139  142 
LCS_GDT     S    67_A     S    67_A     16   23  150      9   15   18   23   27   35   44   51   59   85  113  126  130  132  135  135  137  138  140  142 
LCS_GDT     M    68_A     M    68_A     16   23  150      9   15   17   40   73  106  120  126  127  128  129  130  132  132  135  135  137  140  142  145 
LCS_GDT     M    69_A     M    69_A     16   23  150      9   15   17   23   28   37   52   86  108  118  126  130  132  132  135  135  137  139  140  142 
LCS_GDT     N    70_A     N    70_A     16  130  150      9   15   17   23   27   36   45   52   59   66   96  114  127  132  135  135  137  138  140  142 
LCS_GDT     M    71_A     M    71_A     16  131  150      9   15   17   23   27   34   92  113  127  128  129  130  131  132  135  135  137  139  140  142 
LCS_GDT     G    72_A     G    72_A     16  131  150      6   15   38   90  120  125  125  126  127  128  129  130  132  132  135  138  140  143  146  148 
LCS_GDT     R    73_A     R    73_A     16  131  150      9   15   17   23   38   54   85  108  119  127  129  130  132  132  135  135  137  139  142  143 
LCS_GDT     A    74_A     A    74_A    126  131  150      6   15   17   23   27   34   44   50   59   65  126  130  131  132  134  134  137  138  140  142 
LCS_GDT     W    75_A     W    75_A    126  132  150      5   11   17   80  124  124  125  126  127  128  128  130  132  134  136  137  140  141  145  148 
LCS_GDT     G    76_A     G    76_A    126  132  150     13   59  122  124  124  125  125  126  127  129  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     S    77_A     S    77_A    126  132  150     24  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     K    78_A     K    78_A    126  132  150     84  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     K    79_A     K    79_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     I    80_A     I    80_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     L    81_A     L    81_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     I    82_A     I    82_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     V    83_A     V    83_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     E    84_A     E    84_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     S    85_A     S    85_A    126  132  150     98  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     D    86_A     D    86_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     T    87_A     T    87_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     A    88_A     A    88_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     L    89_A     L    89_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     S    90_A     S    90_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     A    91_A     A    91_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     T    92_A     T    92_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     L    93_A     L    93_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     R    94_A     R    94_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     S    95_A     S    95_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     A    96_A     A    96_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     L    97_A     L    97_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     E    98_A     E    98_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     G    99_A     G    99_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     R   100_A     R   100_A    126  132  150     94  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     G   101_A     G   101_A    126  132  150     98  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     F   102_A     F   102_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     T   103_A     T   103_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     V   104_A     V   104_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     D   105_A     D   105_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     E   106_A     E   106_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     T   107_A     T   107_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     T   108_A     T   108_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     D   109_A     D   109_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     G   110_A     G   110_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     K   111_A     K   111_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     G   112_A     G   112_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     S   113_A     S   113_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     V   114_A     V   114_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     E   115_A     E   115_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     Q   116_A     Q   116_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     I   117_A     I   117_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     R   118_A     R   118_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     R   119_A     R   119_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  140  142  144  146  147  148 
LCS_GDT     D   120_A     D   120_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     R   121_A     R   121_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     P   122_A     P   122_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     D   123_A     D   123_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     L   124_A     L   124_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     V   125_A     V   125_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     V   126_A     V   126_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     L   127_A     L   127_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     A   128_A     A   128_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     V   129_A     V   129_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     D   130_A     D   130_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     L   131_A     L   131_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     S   132_A     S   132_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     A   133_A     A   133_A    126  132  150     84  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     G   134_A     G   134_A    126  132  150     29  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     Q   135_A     Q   135_A    126  132  150     98  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     N   136_A     N   136_A    126  132  150     90  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     G   137_A     G   137_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     Y   138_A     Y   138_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     L   139_A     L   139_A    126  132  150     76  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     I   140_A     I   140_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     C   141_A     C   141_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     G   142_A     G   142_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     K   143_A     K   143_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     L   144_A     L   144_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     K   145_A     K   145_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     K   146_A     K   146_A    126  132  150     97  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     D   147_A     D   147_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     D   148_A     D   148_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     D   149_A     D   149_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     L   150_A     L   150_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     K   151_A     K   151_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     N   152_A     N   152_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     V   153_A     V   153_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     P   154_A     P   154_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     I   155_A     I   155_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     V   156_A     V   156_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     I   157_A     I   157_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     I   158_A     I   158_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     G   159_A     G   159_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     N   160_A     N   160_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     P   161_A     P   161_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     D   162_A     D   162_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     G   163_A     G   163_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     F   164_A     F   164_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     A   165_A     A   165_A    126  132  150     96  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     Q   166_A     Q   166_A    126  132  150     96  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     H   167_A     H   167_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     R   168_A     R   168_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     K   169_A     K   169_A    126  132  150     96  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     L   170_A     L   170_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     K   171_A     K   171_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     A   172_A     A   172_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     H   173_A     H   173_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     A   174_A     A   174_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     D   175_A     D   175_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     E   176_A     E   176_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     Y   177_A     Y   177_A    126  132  150     97  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     V   178_A     V   178_A    126  132  150     96  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     A   179_A     A   179_A    126  132  150     97  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     K   180_A     K   180_A    126  132  150     96  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     P   181_A     P   181_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     V   182_A     V   182_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     D   183_A     D   183_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     A   184_A     A   184_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     D   185_A     D   185_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     Q   186_A     Q   186_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     L   187_A     L   187_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     V   188_A     V   188_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     E   189_A     E   189_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     R   190_A     R   190_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     A   191_A     A   191_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     G   192_A     G   192_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     A   193_A     A   193_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     L   194_A     L   194_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     I   195_A     I   195_A    126  132  150    101  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     G   196_A     G   196_A    126  132  150     91  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     F   197_A     F   197_A    126  132  150     98  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     P   198_A     P   198_A    126  132  150     98  123  123  124  124  125  125  126  127  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     E   199_A     E   199_A    126  132  150     79  123  123  124  124  125  125  126  127  129  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     G   200_A     G   200_A    126  132  150      3    3    5   31   73  113  124  125  126  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     N   201_A     N   201_A     22  132  150     19   21   21   22   22   26   35   47   59   74   92  133  134  137  139  142  144  144  147  148 
LCS_GDT     S   202_A     S   202_A     22  132  150     19   21   21   22   22   26   35   47  123  130  132  135  136  138  140  142  144  146  147  148 
LCS_GDT     M   203_A     M   203_A     22  132  150     19   21   21   22   22   26   35   47  119  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     M   204_A     M   204_A     22  132  150     19   21   21   22   22   26   88  114  126  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     I   205_A     I   205_A     22  132  150     19   21   21   22   33   71  100  122  126  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     A   206_A     A   206_A     22  132  150     19   21   21   22   41   64  102  119  126  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     L   207_A     L   207_A     22   23  150     19   21   21   22   36   64   90  117  126  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     G   208_A     G   208_A     22   23  150     19   21   21   22   39   64   88  113  126  130  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     V   209_A     V   209_A     22   23  150     19   21   21   24   27   39   59   80  107  126  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     A   210_A     A   210_A     22   23  150     19   21   21   24   32   49   67   89  110  125  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     C   211_A     C   211_A     22   23  150     19   21   21   22   26   45   57   75   96  120  132  135  137  139  141  142  144  146  147  148 
LCS_GDT     A   212_A     A   212_A     22   23  150     19   21   21   22   22   25   33   54   72   90  109  130  137  139  141  142  144  146  147  148 
LCS_GDT     I   213_A     I   213_A     22   23  150     19   21   21   22   22   24   31   50   63   81   98  122  136  139  141  142  144  146  147  148 
LCS_GDT     A   214_A     A   214_A     22   23  150     19   21   21   22   22   24   31   50   63   80   98  117  133  139  141  142  144  146  147  148 
LCS_GDT     L   215_A     L   215_A     22   23  150     19   21   21   22   22   22   31   36   46   69   83   97  114  134  141  142  144  146  147  148 
LCS_GDT     A   216_A     A   216_A     22   23  150     19   21   21   22   22   22   23   27   35   45   56   73   91  110  126  141  144  146  147  148 
LCS_GDT     I   217_A     I   217_A     22   23  150     19   21   21   22   22   22   23   27   34   45   52   75   91  110  125  141  144  146  147  148 
LCS_GDT     A   218_A     A   218_A     22   23  149     19   21   21   22   22   22   23   27   34   44   51   69   84   97  113  128  141  146  147  148 
LCS_GDT     A   219_A     A   219_A     22   23  149     15   21   21   22   22   22   23   23   30   39   48   53   63   79   90  110  120  134  146  148 
LCS_GDT     V   220_A     V   220_A     22   23  149      9   21   21   22   22   22   23   23   26   33   39   44   53   65   78   87  110  116  129  145 
LCS_GDT     Y   221_A     Y   221_A     22   23  147     19   21   21   22   22   22   23   23   24   33   36   41   53   65   79   93  109  123  143  145 
LCS_GDT     F   222_A     F   222_A     22   23   68      4    7   15   22   22   22   23   23   23   27   31   35   40   50   57   63   77   93  116  129 
LCS_AVERAGE  LCS_A:  46.27  (  35.97   42.30   60.53 )

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    101    123    123    124    124    125    125    126    127    130    132    135    137    139    141    142    144    146    147    148 
GDT PERCENT_AT  45.50  55.41  55.41  55.86  55.86  56.31  56.31  56.76  57.21  58.56  59.46  60.81  61.71  62.61  63.51  63.96  64.86  65.77  66.22  66.67
GDT RMS_LOCAL    0.30   0.41   0.41   0.48   0.48   0.68   0.58   0.75   1.05   2.12   2.14   2.69   3.00   3.28   3.74   3.74   4.09   4.21   4.37   4.08
GDT RMS_ALL_AT  18.24  18.16  18.16  18.08  18.08  18.01  18.18  18.11  18.23  17.28  17.26  16.60  16.23  16.04  15.71  15.73  15.52  15.43  15.32  15.54

# Checking swapping
#   possible swapping detected:  E     8_A      E     8_A
#   possible swapping detected:  E    18_A      E    18_A
#   possible swapping detected:  D    31_A      D    31_A
#   possible swapping detected:  D    35_A      D    35_A
#   possible swapping detected:  E    46_A      E    46_A
#   possible swapping detected:  E    63_A      E    63_A
#   possible swapping detected:  E    84_A      E    84_A
#   possible swapping detected:  E    98_A      E    98_A
#   possible swapping detected:  F   102_A      F   102_A
#   possible swapping detected:  D   105_A      D   105_A
#   possible swapping detected:  E   115_A      E   115_A
#   possible swapping detected:  D   148_A      D   148_A
#   possible swapping detected:  D   149_A      D   149_A
#   possible swapping detected:  Y   177_A      Y   177_A
#   possible swapping detected:  D   183_A      D   183_A
#   possible swapping detected:  D   185_A      D   185_A
#   possible swapping detected:  E   189_A      E   189_A
#   possible swapping detected:  E   199_A      E   199_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    G     1_A      G     1_A    19.669     0    0.274   0.274    22.057    0.000    0.000
LGA    P     2_A      P     2_A    24.382     0    0.673   0.599    26.203    0.000    0.000
LGA    H     3_A      H     3_A    27.137     0    0.602   1.081    29.705    0.000    0.000
LGA    M     4_A      M     4_A    25.131     0    0.258   0.590    27.218    0.000    0.000
LGA    E     5_A      E     5_A    30.998     0    0.042   1.322    33.640    0.000    0.000
LGA    Q     6_A      Q     6_A    35.382     0    0.017   0.757    42.340    0.000    0.000
LGA    L     7_A      L     7_A    30.474     0    0.034   0.118    31.792    0.000    0.000
LGA    E     8_A      E     8_A    29.269     0    0.062   0.771    32.093    0.000    0.000
LGA    G     9_A      G     9_A    36.537     0    0.038   0.038    38.169    0.000    0.000
LGA    I    10_A      I    10_A    36.793     0    0.012   0.089    38.287    0.000    0.000
LGA    M    11_A      M    11_A    31.213     0    0.023   0.917    32.840    0.000    0.000
LGA    L    12_A      L    12_A    34.635     0    0.047   0.093    38.571    0.000    0.000
LGA    S    13_A      S    13_A    40.839     0    0.025   0.078    41.864    0.000    0.000
LGA    P    14_A      P    14_A    43.743     0    0.009   0.022    46.825    0.000    0.000
LGA    A    15_A      A    15_A    45.212     0    0.035   0.048    46.843    0.000    0.000
LGA    F    16_A      F    16_A    38.511     0    0.038   1.403    40.901    0.000    0.000
LGA    Q    17_A      Q    17_A    36.176     0    0.025   0.693    37.341    0.000    0.000
LGA    E    18_A      E    18_A    41.210     0    0.043   1.076    48.901    0.000    0.000
LGA    Q    19_A      Q    19_A    40.858     0    0.028   0.640    45.933    0.000    0.000
LGA    M    20_A      M    20_A    33.992     0    0.055   1.034    36.315    0.000    0.000
LGA    N    21_A      N    21_A    34.554     0    0.014   0.695    36.003    0.000    0.000
LGA    A    22_A      A    22_A    39.904     0    0.021   0.022    42.389    0.000    0.000
LGA    L    23_A      L    23_A    37.137     0    0.033   1.453    37.826    0.000    0.000
LGA    M    24_A      M    24_A    31.444     0    0.091   0.799    33.437    0.000    0.000
LGA    L    25_A      L    25_A    35.129     0    0.116   1.295    38.049    0.000    0.000
LGA    D    26_A      D    26_A    38.782     0    0.021   1.058    43.870    0.000    0.000
LGA    P    27_A      P    27_A    34.578     0    0.096   0.354    36.960    0.000    0.000
LGA    R    28_A      R    28_A    40.088     0    0.126   1.241    50.471    0.000    0.000
LGA    M    29_A      M    29_A    37.845     0    0.025   1.262    38.594    0.000    0.000
LGA    L    30_A      L    30_A    31.136     0    0.025   0.429    33.410    0.000    0.000
LGA    D    31_A      D    31_A    34.953     0    0.014   1.087    36.869    0.000    0.000
LGA    M    32_A      M    32_A    39.533     0    0.004   0.740    45.226    0.000    0.000
LGA    M    33_A      M    33_A    33.958     0    0.018   1.198    35.712    0.000    0.000
LGA    I    34_A      I    34_A    31.643     0    0.020   0.081    34.134    0.000    0.000
LGA    D    35_A      D    35_A    38.783     0    0.139   1.322    42.860    0.000    0.000
LGA    Q    36_A      Q    36_A    39.300     0    0.083   1.126    41.638    0.000    0.000
LGA    N    37_A      N    37_A    34.925     0    0.058   1.004    36.133    0.000    0.000
LGA    P    38_A      P    38_A    39.237     0    0.043   0.056    41.251    0.000    0.000
LGA    Q    39_A      Q    39_A    33.596     0    0.123   0.626    35.222    0.000    0.000
LGA    L    40_A      L    40_A    30.062     0    0.134   0.188    32.028    0.000    0.000
LGA    R    41_A      R    41_A    36.606     0    0.077   0.834    45.915    0.000    0.000
LGA    N    42_A      N    42_A    37.465     0    0.059   1.035    42.791    0.000    0.000
LGA    M    43_A      M    43_A    30.591     0    0.050   1.078    32.779    0.000    0.000
LGA    G    44_A      G    44_A    31.336     0    0.051   0.051    31.336    0.000    0.000
LGA    P    45_A      P    45_A    29.370     0    0.026   0.067    32.710    0.000    0.000
LGA    E    46_A      E    46_A    23.096     0    0.013   0.655    27.677    0.000    0.000
LGA    A    47_A      A    47_A    20.808     0    0.016   0.032    22.249    0.000    0.000
LGA    R    48_A      R    48_A    23.166     0    0.024   0.481    35.246    0.000    0.000
LGA    Q    49_A      Q    49_A    20.380     0    0.070   0.866    21.549    0.000    0.000
LGA    M    50_A      M    50_A    13.812     0    0.207   0.896    16.296    0.000    0.000
LGA    L    51_A      L    51_A    15.742     0    0.113   0.134    20.446    0.000    0.000
LGA    R    52_A      R    52_A    18.983     0    0.036   1.419    30.621    0.000    0.000
LGA    P    53_A      P    53_A    15.165     0    0.043   0.313    16.108    0.000    0.000
LGA    M    54_A      M    54_A    11.593     0    0.072   1.500    13.243    0.000    0.119
LGA    F    55_A      F    55_A    16.499     0    0.017   1.390    22.900    0.000    0.000
LGA    R    56_A      R    56_A    20.640     0    0.013   1.180    24.348    0.000    0.000
LGA    E    57_A      E    57_A    17.712     0    0.046   0.700    19.171    0.000    0.000
LGA    M    58_A      M    58_A    16.554     0    0.034   0.206    19.617    0.000    0.000
LGA    M    59_A      M    59_A    22.860     0    0.022   0.978    26.389    0.000    0.000
LGA    S    60_A      S    60_A    25.892     0    0.089   0.268    27.576    0.000    0.000
LGA    N    61_A      N    61_A    23.735     0    0.064   0.811    23.752    0.000    0.000
LGA    P    62_A      P    62_A    23.657     0    0.415   0.589    27.304    0.000    0.000
LGA    E    63_A      E    63_A    21.048     0    0.032   1.285    25.020    0.000    0.000
LGA    S    64_A      S    64_A    13.782     0    0.027   0.615    16.534    0.000    0.000
LGA    M    65_A      M    65_A    15.891     0    0.019   0.756    23.277    0.000    0.000
LGA    R    66_A      R    66_A    19.091     0    0.024   1.321    31.324    0.000    0.000
LGA    S    67_A      S    67_A    14.650     0    0.016   0.194    16.479    0.000    0.000
LGA    M    68_A      M    68_A     8.540     0    0.055   1.215    10.766    2.857    5.714
LGA    M    69_A      M    69_A    13.096     0    0.016   0.830    21.053    0.000    0.000
LGA    N    70_A      N    70_A    14.475     0    0.011   1.111    20.539    0.000    0.000
LGA    M    71_A      M    71_A     8.432     0    0.085   1.102    11.689   10.833    7.440
LGA    G    72_A      G    72_A     5.299     0    0.059   0.059     6.299   21.667   21.667
LGA    R    73_A      R    73_A     9.708     0    0.099   1.117    23.113    2.262    0.823
LGA    A    74_A      A    74_A     9.186     0    0.045   0.046    11.042    5.357    4.286
LGA    W    75_A      W    75_A     3.638     0    0.024   1.180    11.673   49.405   20.068
LGA    G    76_A      G    76_A     2.836     0    0.533   0.533     2.836   67.024   67.024
LGA    S    77_A      S    77_A     1.001     0    0.006   0.295     1.805   79.286   77.143
LGA    K    78_A      K    78_A     0.781     0    0.086   0.748     2.018   90.476   83.651
LGA    K    79_A      K    79_A     0.119     0    0.055   0.695     1.581  100.000   92.804
LGA    I    80_A      I    80_A     0.075     0    0.011   0.127     0.383  100.000  100.000
LGA    L    81_A      L    81_A     0.115     0    0.034   0.069     0.178  100.000  100.000
LGA    I    82_A      I    82_A     0.078     0    0.011   0.051     0.242  100.000  100.000
LGA    V    83_A      V    83_A     0.148     0    0.021   0.036     0.148  100.000  100.000
LGA    E    84_A      E    84_A     0.177     0    0.052   0.169     0.490  100.000  100.000
LGA    S    85_A      S    85_A     0.467     0    0.047   0.078     0.677  100.000   96.825
LGA    D    86_A      D    86_A     0.323     0    0.038   0.093     0.603  100.000   98.810
LGA    T    87_A      T    87_A     0.296     0    0.073   0.146     0.482  100.000  100.000
LGA    A    88_A      A    88_A     0.313     0    0.020   0.031     0.353  100.000  100.000
LGA    L    89_A      L    89_A     0.232     0    0.060   0.096     0.331  100.000  100.000
LGA    S    90_A      S    90_A     0.189     0    0.077   0.083     0.457  100.000  100.000
LGA    A    91_A      A    91_A     0.340     0    0.021   0.022     0.398  100.000  100.000
LGA    T    92_A      T    92_A     0.371     0    0.036   0.130     0.537  100.000   98.639
LGA    L    93_A      L    93_A     0.207     0    0.034   0.055     0.338  100.000  100.000
LGA    R    94_A      R    94_A     0.188     0    0.057   0.213     1.486  100.000   94.069
LGA    S    95_A      S    95_A     0.421     0    0.064   0.595     2.415  100.000   92.540
LGA    A    96_A      A    96_A     0.284     0    0.023   0.025     0.323  100.000  100.000
LGA    L    97_A      L    97_A     0.123     0    0.037   0.088     0.224  100.000  100.000
LGA    E    98_A      E    98_A     0.113     0    0.033   0.116     0.384  100.000  100.000
LGA    G    99_A      G    99_A     0.241     0    0.017   0.017     0.330  100.000  100.000
LGA    R   100_A      R   100_A     0.484     0    0.119   1.164     6.051   95.238   69.221
LGA    G   101_A      G   101_A     0.448     0    0.019   0.019     0.448  100.000  100.000
LGA    F   102_A      F   102_A     0.165     0    0.015   0.058     0.470  100.000  100.000
LGA    T   103_A      T   103_A     0.143     0    0.019   0.077     0.436  100.000  100.000
LGA    V   104_A      V   104_A     0.188     0    0.036   0.049     0.373  100.000  100.000
LGA    D   105_A      D   105_A     0.150     0    0.044   0.198     0.936  100.000   98.810
LGA    E   106_A      E   106_A     0.286     0    0.012   0.106     0.490  100.000  100.000
LGA    T   107_A      T   107_A     0.062     0    0.019   0.055     0.350  100.000  100.000
LGA    T   108_A      T   108_A     0.206     0    0.058   0.202     0.789  100.000   95.918
LGA    D   109_A      D   109_A     0.088     0    0.041   0.196     0.764  100.000   98.810
LGA    G   110_A      G   110_A     0.394     0    0.077   0.077     0.394  100.000  100.000
LGA    K   111_A      K   111_A     0.295     0    0.055   0.750     2.437  100.000   91.111
LGA    G   112_A      G   112_A     0.332     0    0.071   0.071     0.336  100.000  100.000
LGA    S   113_A      S   113_A     0.339     0    0.030   0.033     0.482  100.000  100.000
LGA    V   114_A      V   114_A     0.317     0    0.015   0.053     0.344  100.000  100.000
LGA    E   115_A      E   115_A     0.524     0    0.032   0.063     0.931   97.619   93.651
LGA    Q   116_A      Q   116_A     0.473     0    0.057   0.152     0.556  100.000   97.884
LGA    I   117_A      I   117_A     0.281     0    0.010   0.098     0.385  100.000  100.000
LGA    R   118_A      R   118_A     0.203     0    0.018   0.159     0.533  100.000   99.134
LGA    R   119_A      R   119_A     0.347     0    0.011   0.581     2.729  100.000   80.087
LGA    D   120_A      D   120_A     0.283     0    0.010   0.103     0.347  100.000  100.000
LGA    R   121_A      R   121_A     0.258     0    0.025   0.402     1.201  100.000   94.892
LGA    P   122_A      P   122_A     0.170     0    0.040   0.080     0.414  100.000  100.000
LGA    D   123_A      D   123_A     0.137     0    0.028   0.048     0.377  100.000  100.000
LGA    L   124_A      L   124_A     0.125     0    0.034   0.063     0.323  100.000  100.000
LGA    V   125_A      V   125_A     0.167     0    0.035   0.053     0.262  100.000  100.000
LGA    V   126_A      V   126_A     0.094     0    0.011   0.024     0.117  100.000  100.000
LGA    L   127_A      L   127_A     0.118     0    0.021   0.051     0.207  100.000  100.000
LGA    A   128_A      A   128_A     0.393     0    0.033   0.034     0.530  100.000   98.095
LGA    V   129_A      V   129_A     0.379     0    0.013   0.077     0.542   97.619   97.279
LGA    D   130_A      D   130_A     0.500     0    0.023   0.082     0.749   97.619   94.048
LGA    L   131_A      L   131_A     0.319     0    0.014   0.117     0.454  100.000  100.000
LGA    S   132_A      S   132_A     0.327     0    0.031   0.045     0.746  100.000   96.825
LGA    A   133_A      A   133_A     0.788     0    0.056   0.061     1.377   88.333   88.762
LGA    G   134_A      G   134_A     1.231     0    0.029   0.029     1.248   83.690   83.690
LGA    Q   135_A      Q   135_A     0.502     0    0.038   0.642     3.024   92.857   80.476
LGA    N   136_A      N   136_A     0.655     0    0.081   0.191     1.757   90.476   87.143
LGA    G   137_A      G   137_A     0.552     0    0.033   0.033     0.601   90.476   90.476
LGA    Y   138_A      Y   138_A     0.610     0    0.020   0.053     0.669   90.476   94.444
LGA    L   139_A      L   139_A     0.797     0    0.046   0.075     1.323   90.476   87.083
LGA    I   140_A      I   140_A     0.591     0    0.037   0.058     0.680   90.476   91.667
LGA    C   141_A      C   141_A     0.534     0    0.066   0.079     0.605   90.476   93.651
LGA    G   142_A      G   142_A     0.502     0    0.022   0.022     0.562   95.238   95.238
LGA    K   143_A      K   143_A     0.583     0    0.036   0.318     1.233   90.476   89.524
LGA    L   144_A      L   144_A     0.480     0    0.027   0.045     0.529   92.857   96.429
LGA    K   145_A      K   145_A     0.531     0    0.017   0.109     0.636   90.476   92.593
LGA    K   146_A      K   146_A     0.749     0    0.028   0.606     2.413   90.476   85.661
LGA    D   147_A      D   147_A     0.586     0    0.002   0.116     0.633   90.476   94.048
LGA    D   148_A      D   148_A     0.696     0    0.017   0.586     2.304   90.476   85.000
LGA    D   149_A      D   149_A     0.572     0    0.082   0.301     1.310   92.857   90.536
LGA    L   150_A      L   150_A     0.224     0    0.056   1.132     2.417  100.000   90.000
LGA    K   151_A      K   151_A     0.336     0    0.041   0.786     4.046  100.000   84.603
LGA    N   152_A      N   152_A     0.377     0    0.064   0.111     1.025  100.000   94.107
LGA    V   153_A      V   153_A     0.245     0    0.010   0.060     0.557  100.000   98.639
LGA    P   154_A      P   154_A     0.156     0    0.013   0.231     0.799  100.000   98.639
LGA    I   155_A      I   155_A     0.173     0    0.023   0.249     0.674  100.000   97.619
LGA    V   156_A      V   156_A     0.131     0    0.013   0.059     0.316  100.000  100.000
LGA    I   157_A      I   157_A     0.130     0    0.029   0.117     0.307  100.000  100.000
LGA    I   158_A      I   158_A     0.400     0    0.046   0.082     0.483  100.000  100.000
LGA    G   159_A      G   159_A     0.314     0    0.049   0.049     0.468  100.000  100.000
LGA    N   160_A      N   160_A     0.276     0    0.013   0.097     0.356  100.000  100.000
LGA    P   161_A      P   161_A     0.342     0    0.117   0.113     0.681  100.000   97.279
LGA    D   162_A      D   162_A     0.325     0    0.051   1.040     4.131  100.000   80.536
LGA    G   163_A      G   163_A     0.389     0    0.107   0.107     0.389  100.000  100.000
LGA    F   164_A      F   164_A     0.350     0    0.025   0.098     0.671  100.000   94.805
LGA    A   165_A      A   165_A     0.496     0    0.049   0.046     0.708   97.619   96.190
LGA    Q   166_A      Q   166_A     0.515     0    0.047   0.077     1.127   97.619   91.640
LGA    H   167_A      H   167_A     0.340     0    0.073   0.145     0.795  100.000   95.238
LGA    R   168_A      R   168_A     0.273     0    0.062   0.760     2.357   97.619   85.152
LGA    K   169_A      K   169_A     0.503     0    0.006   0.547     3.147   97.619   89.153
LGA    L   170_A      L   170_A     0.275     0    0.019   0.118     0.403  100.000  100.000
LGA    K   171_A      K   171_A     0.523     0    0.021   0.198     1.975   92.857   86.614
LGA    A   172_A      A   172_A     0.354     0    0.092   0.099     0.540   97.619   98.095
LGA    H   173_A      H   173_A     0.280     0    0.025   1.147     2.413  100.000   89.238
LGA    A   174_A      A   174_A     0.269     0    0.045   0.067     0.725   97.619   98.095
LGA    D   175_A      D   175_A     0.443     0    0.094   0.179     0.697   97.619   97.619
LGA    E   176_A      E   176_A     0.511     0    0.057   0.746     1.658   95.238   89.683
LGA    Y   177_A      Y   177_A     0.591     0    0.043   0.135     0.684   90.476   92.063
LGA    V   178_A      V   178_A     0.635     0    0.037   0.096     0.838   92.857   91.837
LGA    A   179_A      A   179_A     0.570     0    0.010   0.022     0.646   90.476   90.476
LGA    K   180_A      K   180_A     0.607     0    0.027   0.385     1.084   90.476   91.587
LGA    P   181_A      P   181_A     0.357     0    0.026   0.047     0.516  100.000   97.279
LGA    V   182_A      V   182_A     0.484     0    0.058   1.175     2.884  100.000   88.639
LGA    D   183_A      D   183_A     0.500     0    0.009   0.724     3.827   95.238   78.452
LGA    A   184_A      A   184_A     0.139     0    0.029   0.030     0.312  100.000  100.000
LGA    D   185_A      D   185_A     0.319     0    0.058   0.343     1.258  100.000   94.107
LGA    Q   186_A      Q   186_A     0.433     0    0.022   1.130     4.894   97.619   82.646
LGA    L   187_A      L   187_A     0.305     0    0.023   0.036     0.372  100.000  100.000
LGA    V   188_A      V   188_A     0.236     0    0.020   0.066     0.332  100.000  100.000
LGA    E   189_A      E   189_A     0.170     0    0.029   0.058     0.335  100.000  100.000
LGA    R   190_A      R   190_A     0.198     0    0.021   1.520     7.259  100.000   69.177
LGA    A   191_A      A   191_A     0.357     0    0.072   0.081     0.448  100.000  100.000
LGA    G   192_A      G   192_A     0.437     0    0.088   0.088     0.646   97.619   97.619
LGA    A   193_A      A   193_A     0.232     0    0.083   0.084     0.338  100.000  100.000
LGA    L   194_A      L   194_A     0.139     0    0.064   0.088     0.321  100.000  100.000
LGA    I   195_A      I   195_A     0.370     0    0.748   0.606     3.277   85.119   90.179
LGA    G   196_A      G   196_A     0.763     0    0.051   0.051     1.136   92.976   92.976
LGA    F   197_A      F   197_A     0.421     0    0.055   0.139     0.841  100.000   93.939
LGA    P   198_A      P   198_A     0.464     0    0.641   0.593     2.742   84.524   83.265
LGA    E   199_A      E   199_A     0.945     0    0.601   1.280     8.016   65.952   41.164
LGA    G   200_A      G   200_A     7.001     0    0.401   0.401     9.628   13.095   13.095
LGA    N   201_A      N   201_A     9.334     0    0.554   0.713    12.941    2.857    1.488
LGA    S   202_A      S   202_A     9.038     0    0.057   0.079     9.674    1.190    1.270
LGA    M   203_A      M   203_A     9.651     0    0.025   1.047    10.402    0.595    1.667
LGA    M   204_A      M   204_A     9.843     0    0.024   1.177    11.178    0.357    0.238
LGA    I   205_A      I   205_A     9.885     0    0.031   0.116    11.029    0.238    0.298
LGA    A   206_A      A   206_A    10.832     0    0.018   0.018    12.218    0.000    0.000
LGA    L   207_A      L   207_A    12.022     0    0.027   0.162    13.857    0.000    0.000
LGA    G   208_A      G   208_A    12.004     0    0.030   0.030    13.661    0.000    0.000
LGA    V   209_A      V   209_A    13.631     0    0.023   0.060    15.493    0.000    0.000
LGA    A   210_A      A   210_A    15.051     0    0.014   0.018    16.823    0.000    0.000
LGA    C   211_A      C   211_A    16.029     0    0.019   0.547    17.514    0.000    0.000
LGA    A   212_A      A   212_A    16.791     0    0.012   0.022    18.947    0.000    0.000
LGA    I   213_A      I   213_A    18.765     0    0.008   0.060    20.716    0.000    0.000
LGA    A   214_A      A   214_A    20.077     0    0.009   0.019    21.878    0.000    0.000
LGA    L   215_A      L   215_A    20.946     0    0.027   0.100    22.937    0.000    0.000
LGA    A   216_A      A   216_A    22.549     0    0.007   0.018    24.834    0.000    0.000
LGA    I   217_A      I   217_A    24.303     0    0.030   0.094    26.394    0.000    0.000
LGA    A   218_A      A   218_A    25.512     0    0.028   0.032    27.489    0.000    0.000
LGA    A   219_A      A   219_A    26.753     0    0.136   0.134    29.572    0.000    0.000
LGA    V   220_A      V   220_A    29.274     0    0.009   0.125    31.559    0.000    0.000
LGA    Y   221_A      Y   221_A    30.402     0    0.112   0.126    31.836    0.000    0.000
LGA    F   222_A      F   222_A    32.182     0    0.636   0.811    33.213    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      222     888    888  100.00    1696   1696  100.00               222
SUMMARY(RMSD_GDC):    13.683         13.595                 14.239           54.646   52.884

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  222  222    4.0    126    0.75    57.995    53.918    14.791

LGA_LOCAL      RMSD:   0.752  Number of atoms:  126  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  18.110  Number of assigned atoms:  222 
Std_ASGN_ATOMS RMSD:  13.683  Standard rmsd on all 222 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.919063 * X  +   0.278258 * Y  +   0.279098 * Z  +  28.556814
  Y_new =   0.215653 * X  +  -0.237679 * Y  +   0.947102 * Z  +  39.683746
  Z_new =   0.329875 * X  +   0.930635 * Y  +   0.158435 * Z  +  29.438284 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  2.911118 -0.336171  1.402169   [DEG:  166.7948  -19.2612   80.3384 ]
ZXZ:  2.855018  1.411691  0.340644   [DEG:  163.5805   80.8839   19.5175 ]
 
# END of job
