
#######################################################
#                                                     #
#                        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  164 ( 1284),  selected  151 , name one
# Molecule2: number of CA atoms  151 ( 1194),  selected  151 , 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:   108      11_A - 118_A       4.93    14.24
  LCS_AVERAGE:     62.85

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    94      11_A - 104_A       1.97    13.60
  LONGEST_CONTINUOUS_SEGMENT:    94      12_A - 105_A       1.96    13.62
  LCS_AVERAGE:     52.78

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    56      46_A - 101_A       0.99    13.95
  LCS_AVERAGE:     28.30

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  151
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     Q    11_A     Q    11_A      3   94  108      3    3    3    6   12   20   79   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     A    12_A     A    12_A     18   94  108      3    4    4   33   69   81   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     V    13_A     V    13_A     18   94  108      3   31   53   71   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     E    14_A     E    14_A     18   94  108     26   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     D    15_A     D    15_A     18   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     F    16_A     F    16_A     18   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     L    17_A     L    17_A     18   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     R    18_A     R    18_A     18   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     V    19_A     V    19_A     18   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     H    20_A     H    20_A     18   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     S    21_A     S    21_A     18   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     E    22_A     E    22_A     18   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     L    23_A     L    23_A     18   94  108     24   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     V    24_A     V    24_A     18   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     H    25_A     H    25_A     18   94  108      8   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     R    26_A     R    26_A     18   94  108     10   32   64   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     L    27_A     L    27_A     18   94  108     14   49   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     A    28_A     A    28_A     18   94  108     24   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     G    29_A     G    29_A     18   94  108      3   44   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     D    30_A     D    30_A     18   94  108     20   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     P    31_A     P    31_A      4   94  108      4    4   11   29   48   73   84   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     P    32_A     P    32_A      4   94  108      4    4    4   34   58   73   84   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     D    33_A     D    33_A     14   94  108     11   41   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     E    34_A     E    34_A     14   94  108     11   20   45   64   76   81   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     L    35_A     L    35_A     14   94  108     11   13   13   15   25   78   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     F    36_A     F    36_A     14   94  108     11   22   38   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     Q    37_A     Q    37_A     14   94  108     11   13   13   65   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     R    38_A     R    38_A     14   94  108     11   14   47   65   76   81   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     L    39_A     L    39_A     14   94  108     11   13   13   15   35   80   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     D    40_A     D    40_A     14   94  108     11   13   16   69   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     R    41_A     R    41_A     14   94  108     11   13   13   48   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     F    42_A     F    42_A     14   94  108     11   13   49   71   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     V    43_A     V    43_A     14   94  108      6   13   17   52   70   78   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     T    44_A     T    44_A     14   94  108     11   13   13   21   33   78   85   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     D    45_A     D    45_A     31   94  108      4   13   13   19   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     A    46_A     A    46_A     56   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     I    47_A     I    47_A     56   94  108     26   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     I    48_A     I    48_A     56   94  108     15   52   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     E    49_A     E    49_A     56   94  108      4   40   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     G    50_A     G    50_A     56   94  108      4   16   65   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     N    51_A     N    51_A     56   94  108      9   45   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     P    52_A     P    52_A     56   94  108      9   52   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     E    53_A     E    53_A     56   94  108      4   52   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     R    54_A     R    54_A     56   94  108     14   53   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     R    55_A     R    55_A     56   94  108     17   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     D    56_A     D    56_A     56   94  108     24   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     E    57_A     E    57_A     56   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     I    58_A     I    58_A     56   94  108     13   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     K    59_A     K    59_A     56   94  108      9   44   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     A    60_A     A    60_A     56   94  108     24   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     D    61_A     D    61_A     56   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     L    62_A     L    62_A     56   94  108     33   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     A    63_A     A    63_A     56   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     R    64_A     R    64_A     56   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     A    65_A     A    65_A     56   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     A    66_A     A    66_A     56   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     R    67_A     R    67_A     56   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     V    68_A     V    68_A     56   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     F    69_A     F    69_A     56   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     G    70_A     G    70_A     56   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     E    71_A     E    71_A     56   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     A    72_A     A    72_A     56   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     L    73_A     L    73_A     56   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     E    74_A     E    74_A     56   94  108     33   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     R    75_A     R    75_A     56   94  108     33   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     D    76_A     D    76_A     56   94  108      4    4   27   59   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     I    77_A     I    77_A     56   94  108      9   24   65   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     T    78_A     T    78_A     56   94  108      4   15   37   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     T    79_A     T    79_A     56   94  108     33   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     P    80_A     P    80_A     56   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     E    81_A     E    81_A     56   94  108     33   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     D    82_A     D    82_A     56   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     F    83_A     F    83_A     56   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     N    84_A     N    84_A     56   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     A    85_A     A    85_A     56   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     F    86_A     F    86_A     56   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     L    87_A     L    87_A     56   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     R    88_A     R    88_A     56   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     E    89_A     E    89_A     56   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     L    90_A     L    90_A     56   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     G    91_A     G    91_A     56   94  108     17   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     P    92_A     P    92_A     56   94  108     14   53   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     E    93_A     E    93_A     56   94  108     17   49   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     A    94_A     A    94_A     56   94  108     19   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     V    95_A     V    95_A     56   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     E    96_A     E    96_A     56   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     L    97_A     L    97_A     56   94  108     35   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     V    98_A     V    98_A     56   94  108      8   54   66   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     S    99_A     S    99_A     56   94  108      6   46   64   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     T   100_A     T   100_A     56   94  108      8   47   64   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     F   101_A     F   101_A     56   94  108      8   47   64   74   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     T   102_A     T   102_A     50   94  108      5   11   29   64   76   82   87   91   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     Q   103_A     Q   103_A     15   94  108      6   11   20   39   60   74   85   90   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     Q   104_A     Q   104_A     15   94  108      5   12   30   51   61   75   85   90   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     F   105_A     F   105_A     15   94  108      6   13   33   55   68   79   85   90   93   96   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     V   106_A     V   106_A     14   71  108      6   11   14   23   35   44   53   71   82   92   94   96   97  100  100  101  102  103  105  106 
LCS_GDT     D   107_A     D   107_A     14   63  108      6   11   14   21   34   43   52   61   68   87   93   96   97  100  100  100  102  103  105  106 
LCS_GDT     V   108_A     V   108_A     14   55  108      6   11   22   52   53   53   58   62   76   89   93   96   97  100  100  100  102  103  104  106 
LCS_GDT     I   109_A     I   109_A     14   55  108      6   10   14   20   34   43   50   60   68   80   91   96   97  100  100  100  102  103  104  106 
LCS_GDT     R   110_A     R   110_A     13   55  108      6   10   14   16   19   22   35   42   51   57   65   78   86   96   97   99  102  103  103  104 
LCS_GDT     G   111_A     G   111_A     51   55  108     26   48   51   52   53   53   54   54   55   56   64   69   79   89   97   99  102  103  103  104 
LCS_GDT     D   112_A     D   112_A     51   55  108     33   48   51   52   53   53   54   54   55   56   57   69   80   84   88   95  102  103  104  106 
LCS_GDT     P   113_A     P   113_A     51   55  108     36   48   51   52   53   53   54   64   78   84   89   94   97  100  100  101  102  103  104  106 
LCS_GDT     Q   114_A     Q   114_A     51   55  108     36   48   51   52   53   53   54   54   55   56   57   58   60   70   76   91   97  102  104  106 
LCS_GDT     A   115_A     A   115_A     51   55  108     33   48   51   52   53   53   54   54   55   56   57   58   60   62   65   66   66   67   72   87 
LCS_GDT     V   116_A     V   116_A     51   55  108     36   48   51   52   53   53   54   54   55   56   73   81   89   94   97  100  102  103  104  106 
LCS_GDT     A   117_A     A   117_A     51   55  108     36   48   51   52   53   53   54   54   55   56   57   58   62   67   72   87   97  101  104  106 
LCS_GDT     E   118_A     E   118_A     51   55  108     23   48   51   52   53   53   54   54   55   56   57   58   60   62   65   66   66   67   68   71 
LCS_GDT     H   119_A     H   119_A     51   55   62     36   48   51   52   53   53   54   54   55   56   57   58   60   62   65   66   66   67   68   71 
LCS_GDT     L   120_A     L   120_A     51   55   62     36   48   51   52   53   53   54   54   55   56   57   58   60   62   65   66   72   73   75   82 
LCS_GDT     N   121_A     N   121_A     51   55   62     36   48   51   52   53   53   54   54   55   56   57   58   60   62   65   66   66   67   68   72 
LCS_GDT     I   122_A     I   122_A     51   55   62     36   48   51   52   53   53   54   54   55   56   57   58   60   62   65   68   72   73   75   92 
LCS_GDT     S   123_A     S   123_A     51   55   62     36   48   51   52   53   53   54   54   55   56   57   58   60   68   72   75   96   99  101  103 
LCS_GDT     L   124_A     L   124_A     51   55   62     36   48   51   52   53   53   54   64   76   83   90   95   98   99   99  101  102  103  105  106 
LCS_GDT     E   125_A     E   125_A     51   55   62     36   48   51   52   53   53   54   71   78   84   91   97   98  100  101  102  102  103  105  105 
LCS_GDT     D   126_A     D   126_A     51   55   62     36   48   51   52   53   53   54   54   55   64   74   82   91   97  101  102  102  103  105  105 
LCS_GDT     V   127_A     V   127_A     51   55   62     36   48   51   52   53   53   71   81   88   94   97   97   98  100  101  102  102  103  105  106 
LCS_GDT     A   128_A     A   128_A     51   55   62     36   48   51   52   59   81   85   91   93   96   97   97   98  100  101  102  102  103  105  105 
LCS_GDT     R   129_A     R   129_A     51   55   62     36   48   51   52   53   53   54   54   55   66   77   82   96  100  101  102  102  103  105  105 
LCS_GDT     L   130_A     L   130_A     51   55   62     36   48   51   52   53   53   54   54   59   66   80   92   98  100  101  102  102  103  105  105 
LCS_GDT     A   131_A     A   131_A     51   55   62     36   48   51   52   53   53   57   84   88   93   96   97   98  100  101  102  102  103  105  105 
LCS_GDT     E   132_A     E   132_A     51   55   62     36   48   51   52   53   53   54   54   55   57   80   85   89   93   95   99  100  101  103  105 
LCS_GDT     A   133_A     A   133_A     51   55   62     36   48   51   52   53   53   54   54   55   56   57   58   60   62   66   73   74  101  103  105 
LCS_GDT     G   134_A     G   134_A     51   55   62     36   48   51   52   53   53   54   54   55   56   57   58   60   79   86   90   98  101  103  105 
LCS_GDT     E   135_A     E   135_A     51   55   62     36   48   51   52   53   53   54   54   55   56   57   58   60   62   66   73   74   77  100  102 
LCS_GDT     A   136_A     A   136_A     51   55   62     36   48   51   52   53   53   54   54   55   56   57   58   60   62   65   66   66   67   68   82 
LCS_GDT     A   137_A     A   137_A     51   55   62     36   48   51   52   53   53   54   54   55   56   57   58   60   62   65   66   66   67   68   71 
LCS_GDT     I   138_A     I   138_A     51   55   62     36   48   51   52   53   53   54   54   55   56   57   58   60   62   65   66   66   67   68   71 
LCS_GDT     E   139_A     E   139_A     51   55   62     36   48   51   52   53   53   54   54   55   56   57   58   60   62   65   66   66   67   68   71 
LCS_GDT     R   140_A     R   140_A     51   55   62     36   48   51   52   53   53   54   54   55   56   57   58   60   62   65   66   66   67   68   71 
LCS_GDT     G   141_A     G   141_A     51   55   62     36   48   51   52   53   53   54   54   55   56   57   58   60   62   65   66   66   67   68   71 
LCS_GDT     E   142_A     E   142_A     51   55   62     36   48   51   52   53   53   54   54   55   56   57   58   60   62   65   66   66   67   68   71 
LCS_GDT     G   143_A     G   143_A     51   55   62      4   16   51   52   53   53   54   54   55   56   57   58   60   62   65   66   66   67   68   71 
LCS_GDT     A   144_A     A   144_A     51   55   62     36   48   51   52   53   53   54   54   55   56   57   58   60   62   66   73   74   77  100  105 
LCS_GDT     S   145_A     S   145_A     51   55   62     33   48   51   52   53   53   54   54   55   56   57   58   60   62   66   73   74  101  103  105 
LCS_GDT     L   146_A     L   146_A     51   55   62     36   48   51   52   53   53   54   54   55   56   57   58   60   62   65   66   66   67   68   71 
LCS_GDT     G   147_A     G   147_A     51   55   62     36   48   51   52   53   53   54   54   55   56   57   58   60   62   65   66   66   67   68   71 
LCS_GDT     V   148_A     V   148_A     51   55   62     27   48   51   52   53   53   54   54   55   56   57   58   60   62   80   82   85   99  103  105 
LCS_GDT     H   149_A     H   149_A     51   55   62     23   48   51   52   53   53   54   54   55   56   57   58   60   62   65   66   66   67   68   71 
LCS_GDT     R   150_A     R   150_A     51   55   62     36   48   51   52   53   53   54   54   55   56   57   58   60   62   65   66   66   67   68   71 
LCS_GDT     E   151_A     E   151_A     51   55   62     36   48   51   52   53   53   54   54   55   56   57   58   60   62   65   66   66   67   68   71 
LCS_GDT     L   152_A     L   152_A     51   55   62     36   48   51   52   53   53   54   54   55   56   57   58   60   62   65   66   66   67   68   71 
LCS_GDT     R   153_A     R   153_A     51   55   62     36   48   51   52   53   53   54   54   55   56   57   58   60   62   65   66   66   67   68   71 
LCS_GDT     R   154_A     R   154_A     51   55   62     36   48   51   52   53   53   54   54   55   56   57   58   60   62   65   66   66   67   68   71 
LCS_GDT     I   155_A     I   155_A     51   55   62     36   48   51   52   53   53   54   54   55   56   57   58   60   62   65   66   66   67   68   71 
LCS_GDT     E   156_A     E   156_A     51   55   62     36   48   51   52   53   53   54   54   55   56   57   58   60   62   65   66   66   67   68   71 
LCS_GDT     A   157_A     A   157_A     51   55   62     34   48   51   52   53   53   54   54   55   56   57   58   60   62   65   66   66   67   68   71 
LCS_GDT     R   158_A     R   158_A     51   55   62     34   48   51   52   53   53   54   54   55   56   57   58   60   62   65   66   66   67   68   71 
LCS_GDT     R   159_A     R   159_A     51   55   62     28   48   51   52   53   53   54   54   55   56   57   58   60   62   65   66   66   67   68   71 
LCS_GDT     N   160_A     N   160_A     51   55   62      3    5   51   52   53   53   54   54   55   56   57   58   60   62   65   66   66   67   68   71 
LCS_GDT     S   161_A     S   161_A     51   55   62     11   40   51   52   53   53   54   54   55   56   57   58   60   62   65   66   66   67   68   71 
LCS_AVERAGE  LCS_A:  47.98  (  28.30   52.78   62.85 )

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     36     54     66     74     76     82     87     91     93     96     97     97     98    100    101    102    102    103    105    106 
GDT PERCENT_AT  23.84  35.76  43.71  49.01  50.33  54.30  57.62  60.26  61.59  63.58  64.24  64.24  64.90  66.23  66.89  67.55  67.55  68.21  69.54  70.20
GDT RMS_LOCAL    0.30   0.58   0.79   0.98   1.07   1.31   1.54   1.76   1.86   2.06   2.20   2.16   2.31   2.81   2.85   3.08   2.97   3.25   3.49   4.11
GDT RMS_ALL_AT  20.26  13.68  13.72  13.78  13.73  13.72  13.65  13.57  13.73  13.56  13.48  13.55  13.47  13.92  13.21  13.11  13.77  13.08  13.16  13.86

# Checking swapping
#   possible swapping detected:  E    14_A      E    14_A
#   possible swapping detected:  F    16_A      F    16_A
#   possible swapping detected:  E    22_A      E    22_A
#   possible swapping detected:  D    30_A      D    30_A
#   possible swapping detected:  D    33_A      D    33_A
#   possible swapping detected:  F    36_A      F    36_A
#   possible swapping detected:  D    40_A      D    40_A
#   possible swapping detected:  E    49_A      E    49_A
#   possible swapping detected:  F    69_A      F    69_A
#   possible swapping detected:  E    71_A      E    71_A
#   possible swapping detected:  E    74_A      E    74_A
#   possible swapping detected:  E    81_A      E    81_A
#   possible swapping detected:  F    83_A      F    83_A
#   possible swapping detected:  F    86_A      F    86_A
#   possible swapping detected:  E    89_A      E    89_A
#   possible swapping detected:  E    93_A      E    93_A
#   possible swapping detected:  E    96_A      E    96_A
#   possible swapping detected:  F   105_A      F   105_A
#   possible swapping detected:  E   118_A      E   118_A
#   possible swapping detected:  D   126_A      D   126_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    Q    11_A      Q    11_A     4.360     0    0.489   1.680    11.402   41.905   22.434
LGA    A    12_A      A    12_A     3.106     0    0.348   0.343     4.548   55.476   50.667
LGA    V    13_A      V    13_A     2.108     0    0.311   1.263     5.491   75.119   66.463
LGA    E    14_A      E    14_A     0.584     0    0.198   0.485     2.230   92.857   82.857
LGA    D    15_A      D    15_A     0.322     0    0.044   0.341     1.128  100.000   96.488
LGA    F    16_A      F    16_A     0.395     0    0.023   0.149     1.070  100.000   95.714
LGA    L    17_A      L    17_A     0.339     0    0.085   0.099     0.664   97.619   98.810
LGA    R    18_A      R    18_A     0.270     0    0.049   0.279     0.706  100.000   99.134
LGA    V    19_A      V    19_A     0.607     0    0.051   0.086     0.908   90.476   90.476
LGA    H    20_A      H    20_A     0.614     0    0.061   0.500     1.229   90.476   88.667
LGA    S    21_A      S    21_A     0.528     0    0.067   0.078     0.766   92.857   92.063
LGA    E    22_A      E    22_A     0.461     0    0.024   0.140     0.903   95.238   94.709
LGA    L    23_A      L    23_A     0.773     0    0.018   0.056     1.451   90.476   87.083
LGA    V    24_A      V    24_A     0.225     0    0.022   0.034     0.505   97.619   98.639
LGA    H    25_A      H    25_A     1.199     0    0.091   1.481     3.691   83.690   70.667
LGA    R    26_A      R    26_A     1.643     0    0.067   0.749     2.318   75.000   72.900
LGA    L    27_A      L    27_A     1.153     0    0.020   0.147     2.167   83.690   79.405
LGA    A    28_A      A    28_A     0.733     0    0.083   0.082     1.508   88.214   85.143
LGA    G    29_A      G    29_A     1.404     0    0.653   0.653     4.369   66.190   66.190
LGA    D    30_A      D    30_A     1.224     0    0.281   1.264     6.868   72.024   48.274
LGA    P    31_A      P    31_A     5.149     0    0.076   0.150     7.191   48.095   34.558
LGA    P    32_A      P    32_A     5.556     0    0.042   0.162    10.133   29.405   17.891
LGA    D    33_A      D    33_A     1.409     0    0.630   1.340     6.207   71.071   50.298
LGA    E    34_A      E    34_A     3.710     0    0.020   1.245    10.234   50.119   27.460
LGA    L    35_A      L    35_A     3.798     0    0.039   1.274    10.055   50.119   29.821
LGA    F    36_A      F    36_A     2.846     0    0.042   1.347     6.428   62.857   45.238
LGA    Q    37_A      Q    37_A     2.964     0    0.076   0.272     7.800   61.190   37.989
LGA    R    38_A      R    38_A     3.425     0    0.039   1.370    12.314   55.476   26.926
LGA    L    39_A      L    39_A     3.419     0    0.074   0.088     7.954   57.262   36.845
LGA    D    40_A      D    40_A     3.376     0    0.063   1.089     8.532   55.476   35.655
LGA    R    41_A      R    41_A     2.716     0    0.038   1.097     7.511   64.881   38.312
LGA    F    42_A      F    42_A     2.456     0    0.047   0.137     7.944   68.810   36.494
LGA    V    43_A      V    43_A     3.495     0    0.030   0.107     6.039   53.690   40.680
LGA    T    44_A      T    44_A     4.041     0    0.131   1.011     7.790   45.119   36.735
LGA    D    45_A      D    45_A     2.868     0    0.031   0.128     4.807   60.952   49.226
LGA    A    46_A      A    46_A     0.788     0    0.011   0.019     1.080   90.595   90.571
LGA    I    47_A      I    47_A     0.917     0    0.190   0.207     1.413   85.952   84.821
LGA    I    48_A      I    48_A     1.245     0    0.055   0.086     1.568   77.143   81.548
LGA    E    49_A      E    49_A     2.143     0    0.097   0.739     4.174   66.786   60.106
LGA    G    50_A      G    50_A     2.424     0    0.025   0.025     2.424   64.762   64.762
LGA    N    51_A      N    51_A     1.739     0    0.136   0.767     5.942   79.405   59.048
LGA    P    52_A      P    52_A     1.311     0    0.033   0.097     1.824   81.429   78.980
LGA    E    53_A      E    53_A     1.223     0    0.053   1.147     6.894   81.429   58.095
LGA    R    54_A      R    54_A     1.319     0    0.148   0.929     5.985   85.952   62.208
LGA    R    55_A      R    55_A     0.712     0    0.042   1.148     4.993   90.476   79.740
LGA    D    56_A      D    56_A     0.767     0    0.054   0.465     2.701   92.857   80.952
LGA    E    57_A      E    57_A     0.722     0    0.066   0.763     2.087   90.476   84.603
LGA    I    58_A      I    58_A     0.780     0    0.014   0.693     2.884   90.476   84.048
LGA    K    59_A      K    59_A     1.185     0    0.101   0.708     3.216   83.690   70.741
LGA    A    60_A      A    60_A     1.070     0    0.068   0.088     1.454   88.214   86.857
LGA    D    61_A      D    61_A     0.343     0    0.094   0.152     0.883  100.000   96.429
LGA    L    62_A      L    62_A     0.312     0    0.053   1.039     2.399  100.000   91.012
LGA    A    63_A      A    63_A     0.208     0    0.015   0.017     0.245  100.000  100.000
LGA    R    64_A      R    64_A     0.352     0    0.101   1.048     2.970  100.000   81.429
LGA    A    65_A      A    65_A     0.388     0    0.076   0.095     0.464  100.000  100.000
LGA    A    66_A      A    66_A     0.277     0    0.128   0.137     0.727   97.619   98.095
LGA    R    67_A      R    67_A     0.237     0    0.081   0.545     2.426  100.000   80.779
LGA    V    68_A      V    68_A     0.360     0    0.024   0.039     0.454  100.000  100.000
LGA    F    69_A      F    69_A     0.296     0    0.035   0.513     1.615  100.000   89.134
LGA    G    70_A      G    70_A     0.245     0    0.015   0.015     0.323  100.000  100.000
LGA    E    71_A      E    71_A     0.398     0    0.019   0.124     0.672   97.619   95.767
LGA    A    72_A      A    72_A     0.196     0    0.012   0.011     0.309  100.000  100.000
LGA    L    73_A      L    73_A     0.270     0    0.100   0.146     0.482  100.000  100.000
LGA    E    74_A      E    74_A     0.778     0    0.117   0.279     1.209   90.476   89.471
LGA    R    75_A      R    75_A     0.797     0    0.695   1.241     4.514   86.071   80.433
LGA    D    76_A      D    76_A     3.220     0    0.269   0.288     5.896   53.571   41.429
LGA    I    77_A      I    77_A     1.671     0    0.025   0.118     2.173   68.810   78.512
LGA    T    78_A      T    78_A     2.178     0    0.069   0.106     3.876   73.095   62.245
LGA    T    79_A      T    79_A     0.935     0    0.052   0.092     2.016   90.595   81.837
LGA    P    80_A      P    80_A     0.640     0    0.034   0.108     1.091   90.476   89.184
LGA    E    81_A      E    81_A     1.029     0    0.055   1.247     5.730   88.214   68.360
LGA    D    82_A      D    82_A     0.541     0    0.007   0.127     0.806   95.238   94.048
LGA    F    83_A      F    83_A     0.227     0    0.033   0.146     0.430  100.000  100.000
LGA    N    84_A      N    84_A     0.695     0    0.036   0.316     1.189   90.476   89.345
LGA    A    85_A      A    85_A     0.608     0    0.076   0.086     0.660   95.238   94.286
LGA    F    86_A      F    86_A     0.202     0    0.059   0.117     0.570   97.619   99.134
LGA    L    87_A      L    87_A     0.491     0    0.030   0.092     0.847   95.238   94.048
LGA    R    88_A      R    88_A     0.655     0    0.075   0.404     1.804   88.214   85.584
LGA    E    89_A      E    89_A     0.378     0    0.079   0.158     1.074   92.976   92.698
LGA    L    90_A      L    90_A     0.719     0    0.082   1.309     2.677   90.595   82.024
LGA    G    91_A      G    91_A     1.033     0    0.060   0.060     1.117   83.690   83.690
LGA    P    92_A      P    92_A     1.347     0    0.065   0.398     1.481   81.429   82.721
LGA    E    93_A      E    93_A     1.602     0    0.077   0.180     3.194   79.405   67.989
LGA    A    94_A      A    94_A     0.916     0    0.029   0.043     1.182   88.214   86.857
LGA    V    95_A      V    95_A     0.545     0    0.038   0.089     0.739   95.238   93.197
LGA    E    96_A      E    96_A     0.481     0    0.063   0.988     3.323   95.238   87.090
LGA    L    97_A      L    97_A     0.403     0    0.043   0.184     1.120  100.000   92.976
LGA    V    98_A      V    98_A     0.915     0    0.015   0.039     1.977   86.190   81.701
LGA    S    99_A      S    99_A     1.779     0    0.084   0.081     2.570   71.071   73.095
LGA    T   100_A      T   100_A     2.021     0    0.015   0.117     2.589   64.881   65.986
LGA    F   101_A      F   101_A     1.797     0    0.035   1.378     6.238   66.905   58.009
LGA    T   102_A      T   102_A     3.259     0    0.021   0.869     5.260   43.929   39.524
LGA    Q   103_A      Q   103_A     5.069     0    0.072   0.243     8.469   26.667   19.418
LGA    Q   104_A      Q   104_A     5.099     0    0.060   0.221     5.909   26.310   29.206
LGA    F   105_A      F   105_A     4.442     0    0.023   1.240     6.434   28.214   36.883
LGA    V   106_A      V   106_A     7.941     0    0.023   0.080     9.965    6.905    5.374
LGA    D   107_A      D   107_A     9.718     0    0.049   0.069    11.289    0.952    0.774
LGA    V   108_A      V   108_A     9.302     0    0.017   0.076    10.834    1.190    2.721
LGA    I   109_A      I   109_A    10.307     0    0.056   0.111    13.168    0.119    1.905
LGA    R   110_A      R   110_A    13.978     0    0.131   0.999    16.309    0.000    0.000
LGA    G   111_A      G   111_A    15.304     0    0.266   0.266    17.635    0.000    0.000
LGA    D   112_A      D   112_A    16.341     0    0.074   0.124    22.682    0.000    0.000
LGA    P   113_A      P   113_A    11.717     0    0.057   0.074    13.858    0.000    0.000
LGA    Q   114_A      Q   114_A    18.428     0    0.102   1.295    22.414    0.000    0.000
LGA    A   115_A      A   115_A    20.138     0    0.017   0.038    20.451    0.000    0.000
LGA    V   116_A      V   116_A    14.412     0    0.050   0.051    16.690    0.000    0.000
LGA    A   117_A      A   117_A    17.664     0    0.012   0.016    21.654    0.000    0.000
LGA    E   118_A      E   118_A    24.131     0    0.012   0.598    29.936    0.000    0.000
LGA    H   119_A      H   119_A    22.537     0    0.032   1.111    23.924    0.000    0.000
LGA    L   120_A      L   120_A    20.968     0    0.036   1.056    23.951    0.000    0.000
LGA    N   121_A      N   121_A    26.063     0    0.060   0.830    31.422    0.000    0.000
LGA    I   122_A      I   122_A    21.949     0    0.036   0.080    22.882    0.000    0.000
LGA    S   123_A      S   123_A    19.239     0    0.048   0.089    20.362    0.000    0.000
LGA    L   124_A      L   124_A    13.036     0    0.026   0.060    15.897    0.714    0.357
LGA    E   125_A      E   125_A    11.342     0    0.013   0.949    17.186    0.000    0.000
LGA    D   126_A      D   126_A    14.087     0    0.084   1.063    20.088    0.000    0.000
LGA    V   127_A      V   127_A     8.507     0    0.054   0.074    11.355   11.548    8.435
LGA    A   128_A      A   128_A     4.779     0    0.051   0.059     7.273   19.048   21.524
LGA    R   129_A      R   129_A    11.498     0    0.020   0.447    19.771    0.357    0.130
LGA    L   130_A      L   130_A     9.830     0    0.012   0.132    13.500    0.952    0.833
LGA    A   131_A      A   131_A     6.849     0    0.060   0.068    11.182    6.786   10.667
LGA    E   132_A      E   132_A    12.758     0    0.030   1.052    16.830    0.000    0.000
LGA    A   133_A      A   133_A    16.723     0    0.012   0.016    18.773    0.000    0.000
LGA    G   134_A      G   134_A    14.454     0    0.041   0.041    17.992    0.000    0.000
LGA    E   135_A      E   135_A    18.114     0    0.051   1.042    22.705    0.000    0.000
LGA    A   136_A      A   136_A    23.581     0    0.079   0.076    27.256    0.000    0.000
LGA    A   137_A      A   137_A    24.305     0    0.062   0.074    27.012    0.000    0.000
LGA    I   138_A      I   138_A    24.640     0    0.017   0.042    29.296    0.000    0.000
LGA    E   139_A      E   139_A    30.322     0    0.030   1.182    34.666    0.000    0.000
LGA    R   140_A      R   140_A    33.617     0    0.012   0.167    35.770    0.000    0.000
LGA    G   141_A      G   141_A    32.989     0    0.038   0.038    32.989    0.000    0.000
LGA    E   142_A      E   142_A    28.300     0    0.695   1.155    31.667    0.000    0.000
LGA    G   143_A      G   143_A    21.629     0    0.070   0.070    24.361    0.000    0.000
LGA    A   144_A      A   144_A    15.921     0    0.060   0.066    17.831    0.000    0.000
LGA    S   145_A      S   145_A    13.698     0    0.033   0.642    16.179    0.000    0.000
LGA    L   146_A      L   146_A    20.799     0    0.021   0.838    27.196    0.000    0.000
LGA    G   147_A      G   147_A    20.094     0    0.083   0.083    20.226    0.000    0.000
LGA    V   148_A      V   148_A    14.519     0    0.055   0.085    17.022    0.000    0.000
LGA    H   149_A      H   149_A    19.406     0    0.011   1.104    24.403    0.000    0.000
LGA    R   150_A      R   150_A    25.029     0    0.014   0.197    32.373    0.000    0.000
LGA    E   151_A      E   151_A    21.533     0    0.057   1.037    22.563    0.000    0.000
LGA    L   152_A      L   152_A    21.045     0    0.102   1.302    25.101    0.000    0.000
LGA    R   153_A      R   153_A    28.250     0    0.023   1.158    36.030    0.000    0.000
LGA    R   154_A      R   154_A    29.144     0    0.026   1.529    30.058    0.000    0.000
LGA    I   155_A      I   155_A    25.658     0    0.050   0.113    29.138    0.000    0.000
LGA    E   156_A      E   156_A    30.707     0    0.021   1.024    34.852    0.000    0.000
LGA    A   157_A      A   157_A    35.997     0    0.027   0.036    38.322    0.000    0.000
LGA    R   158_A      R   158_A    34.184     0    0.094   1.231    36.443    0.000    0.000
LGA    R   159_A      R   159_A    34.939     0    0.024   1.113    39.388    0.000    0.000
LGA    N   160_A      N   160_A    40.406     0    0.138   0.372    44.528    0.000    0.000
LGA    S   161_A      S   161_A    44.198     0    0.671   0.782    44.570    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      151     604    604  100.00    1194   1194  100.00               151
SUMMARY(RMSD_GDC):    12.210         12.344                 12.420           50.604   46.121

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  164  151    4.0     91    1.76    53.146    54.548     4.903

LGA_LOCAL      RMSD:   1.756  Number of atoms:   91  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  13.574  Number of assigned atoms:  151 
Std_ASGN_ATOMS RMSD:  12.210  Standard rmsd on all 151 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.152660 * X  +  -0.260170 * Y  +  -0.953418 * Z  +   1.317384
  Y_new =   0.290286 * X  +  -0.910366 * Y  +   0.294902 * Z  + -10.755553
  Z_new =  -0.944685 * X  +  -0.321784 * Y  +  -0.063453 * Z  + -14.499323 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  1.086646  1.236631 -1.765491   [DEG:   62.2603   70.8538 -101.1552 ]
ZXZ: -1.870772  1.634292 -1.899096   [DEG: -107.1874   93.6381 -108.8102 ]
 
# END of job
