
#######################################################
#                                                     #
#                        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  142 ( 1166),  selected  132 , name one
# Molecule2: number of CA atoms  132 ( 1073),  selected  132 , 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:   132       3_A - 134_A       3.01     3.01
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    67       3_A - 69_A        1.97     3.25
  LCS_AVERAGE:     32.66

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    22      44_A - 65_A        0.96     3.33
  LONGEST_CONTINUOUS_SEGMENT:    22      45_A - 66_A        0.96     3.27
  LONGEST_CONTINUOUS_SEGMENT:    22      46_A - 67_A        0.96     3.38
  LCS_AVERAGE:      9.01

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  132
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     D     3_A     D     3_A      3   67  132      8   31   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     V     4_A     V     4_A      4   67  132      8   29   51   78   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     D     5_A     D     5_A      8   67  132      7   32   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     K     6_A     K     6_A      8   67  132      7   29   49   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     R     7_A     R     7_A      8   67  132      7   31   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     K     8_A     K     8_A      8   67  132     11   30   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     I     9_A     I     9_A     12   67  132     11   29   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     K    10_A     K    10_A     12   67  132      6   36   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     I    11_A     I    11_A     12   67  132      8   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     I    12_A     I    12_A     12   67  132      6   37   59   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     L    13_A     L    13_A     12   67  132      3   10   31   61   88  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     N    14_A     N    14_A     12   67  132      4    8   14   40   50   74  100  112  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     G    15_A     G    15_A     14   67  132      7   22   36   62   78  101  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     E    16_A     E    16_A     14   67  132      9   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     M    17_A     M    17_A     14   67  132      5   36   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     E    18_A     E    18_A     14   67  132      6   27   58   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     E    19_A     E    19_A     14   67  132      6   27   58   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     A    20_A     A    20_A     14   67  132     11   27   58   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     E    21_A     E    21_A     14   67  132     11   36   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     L    22_A     L    22_A     14   67  132     11   36   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     H    23_A     H    23_A     14   67  132     11   33   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     M    24_A     M    24_A     14   67  132      9   36   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     I    25_A     I    25_A     14   67  132     14   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     T    26_A     T    26_A     14   67  132     11   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     S    27_A     S    27_A     14   67  132     12   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     P    28_A     P    28_A     14   67  132      8   28   53   78   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     N    29_A     N    29_A     14   67  132      3    7   21   50   65   95  105  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     R    30_A     R    30_A      9   67  132     11   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     H    31_A     H    31_A      9   67  132      4   29   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     C    32_A     C    32_A      9   67  132     14   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     C    33_A     C    33_A      9   67  132     14   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     L    34_A     L    34_A      9   67  132     11   36   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     K    35_A     K    35_A      9   67  132     11   36   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     I    36_A     I    36_A      9   67  132     11   36   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     F    37_A     F    37_A      9   67  132     11   36   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     H    38_A     H    38_A      9   67  132      6   23   56   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     N    39_A     N    39_A      8   67  132      3   10   37   75   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     N    40_A     N    40_A      3   67  132      3    3    4    7   27   35   86  111  114  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     N    41_A     N    41_A      4   67  132      5   27   55   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     Q    42_A     Q    42_A      4   67  132      3    4    9   35   58  102  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     L    43_A     L    43_A     15   67  132      3   16   29   52   79   97  107  114  116  121  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     A    44_A     A    44_A     22   67  132     11   24   59   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     E    45_A     E    45_A     22   67  132     11   24   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     S    46_A     S    46_A     22   67  132     11   36   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     N    47_A     N    47_A     22   67  132     14   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     D    48_A     D    48_A     22   67  132     12   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     T    49_A     T    49_A     22   67  132      9   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     D    50_A     D    50_A     22   67  132      6   30   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     Y    51_A     Y    51_A     22   67  132      9   29   57   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     F    52_A     F    52_A     22   67  132      6   28   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     S    53_A     S    53_A     22   67  132      9   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     C    54_A     C    54_A     22   67  132      9   32   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     F    55_A     F    55_A     22   67  132      9   32   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     A    56_A     A    56_A     22   67  132     13   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     D    57_A     D    57_A     22   67  132      9   34   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     L    58_A     L    58_A     22   67  132      9   32   60   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     R    59_A     R    59_A     22   67  132     12   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     N    60_A     N    60_A     22   67  132     14   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     Q    61_A     Q    61_A     22   67  132     14   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     L    62_A     L    62_A     22   67  132     14   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     K    63_A     K    63_A     22   67  132     14   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     N    64_A     N    64_A     22   67  132     14   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     I    65_A     I    65_A     22   67  132      7   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     I    66_A     I    66_A     22   67  132      6   23   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     F    67_A     F    67_A     22   67  132     11   23   38   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     L    68_A     L    68_A     14   67  132     11   23   56   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     C    69_A     C    69_A     14   67  132     14   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     K    70_A     K    70_A      6   56  132      3    5    6    7   69   99  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     G    71_A     G    71_A      6   56  132      3    5   12   18   27   46   61   79  112  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     A    72_A     A    72_A      6   36  132      3    4    6   18   30   49   65   95  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     K    73_A     K    73_A      9   36  132      2    9   25   57   92  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     I    74_A     I    74_A      9   36  132      5   19   38   76   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     N    75_A     N    75_A      9   36  132      9   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     V    76_A     V    76_A      9   36  132     10   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     Y    77_A     Y    77_A      9   36  132     12   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     P    78_A     P    78_A      9   36  132      9   32   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     S    79_A     S    79_A      9   36  132      3   11   25   40   84  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     A    80_A     A    80_A      9   36  132      5   17   28   46   91  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     M    81_A     M    81_A      9   15  132      3   15   25   57   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     S    82_A     S    82_A      9   15  132      3   15   46   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     R    83_A     R    83_A      6   15  132      3   15   34   66   87  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     D    84_A     D    84_A      6   15  132      3   21   41   68   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     M    85_A     M    85_A      6   15  132      8   18   45   78   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     S    86_A     S    86_A      6   15  132      6   23   49   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     D    87_A     D    87_A      3   15  132      3    3   19   25   32   58   77  110  116  121  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     G    88_A     G    88_A      3   12  132      3    3   17   25   30   35   47   59   77  100  122  126  129  130  132  132  132  132  132  132 
LCS_GDT     I    89_A     I    89_A      7   12  132      4    8   17   33   57   86  109  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     V    90_A     V    90_A     10   12  132      9   29   58   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     A    91_A     A    91_A     10   12  132      9   32   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     Y    92_A     Y    92_A     10   13  132     12   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     E    93_A     E    93_A     10   13  132     10   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     T    94_A     T    94_A     10   13  132      9   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     T    95_A     T    95_A     10   13  132      4   19   60   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     L    96_A     L    96_A     10   13  132      3   14   54   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     G    97_A     G    97_A     10   13  132      3   14   37   78   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     Q    98_A     Q    98_A     10   13  132      3   14   53   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     P    99_A     P    99_A     10   13  132      3   14   53   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     G   100_A     G   100_A      8   13  132      3   11   42   67   84  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     L   101_A     L   101_A      8   13  132      3   10   17   27   41   69   97  108  114  121  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     P   102_A     P   102_A      8   13  132      3    7    9   17   21   38   62   76  102  109  117  126  128  131  132  132  132  132  132  132 
LCS_GDT     E   103_A     E   103_A      8   13  132      3    7   16   22   40   49   69   87  102  109  115  126  128  131  132  132  132  132  132  132 
LCS_GDT     N   104_A     N   104_A      8   13  132      4    8   20   38   62   76  101  110  116  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     Q   105_A     Q   105_A      8   12  132      5   22   44   72   91  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     V   106_A     V   106_A      8   12  132      4   17   36   60   89  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     H   107_A     H   107_A      8   12  132      4   19   40   63   90  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     I   108_A     I   108_A      6   12  132      3   11   26   57   86  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     F   109_A     F   109_A      6   11  132      3    8   10   17   28   56   73   99  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     D   110_A     D   110_A      5    9  132      3    4   17   38   56   74  105  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     F   111_A     F   111_A      5    9  132      3    5   11   19   44   60   73   99  114  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     E   112_A     E   112_A      4    8  132      3    4   20   50   82  102  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     D   113_A     D   113_A      4    8  132      3    4   31   50   90  103  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     K   114_A     K   114_A      3    8  132      3    4    7   13   25   36  103  113  116  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     Y   115_A     Y   115_A      3   18  132      3    3    5    6    7   23   42   94  113  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     V   116_A     V   116_A      3   18  132      3    4    8   27   32   49   71   94  116  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     D   117_A     D   117_A     14   18  132      3   12   27   46   78  102  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     I   118_A     I   118_A     14   18  132      3    4    7   52   79   97  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     T   119_A     T   119_A     14   18  132      7   25   50   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     P   120_A     P   120_A     14   18  132     12   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     E   121_A     E   121_A     14   18  132      9   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     E   122_A     E   122_A     14   18  132     12   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     Q   123_A     Q   123_A     14   18  132     12   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     R   124_A     R   124_A     14   18  132     14   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     K   125_A     K   125_A     14   18  132     14   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     F   126_A     F   126_A     14   18  132     14   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     H   127_A     H   127_A     14   18  132     10   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     S   128_A     S   128_A     14   18  132     10   31   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     Q   129_A     Q   129_A     14   18  132     10   29   55   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     W   130_A     W   130_A     14   18  132     14   37   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     F   131_A     F   131_A     14   18  132      4   27   61   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     E   132_A     E   132_A     14   18  132      9   32   59   81   93  104  110  114  117  122  126  128  129  131  132  132  132  132  132  132 
LCS_GDT     S   133_A     S   133_A      3   15  132      3    3    4    9   30   43   53   64   92  110  116  127  129  131  132  132  132  132  132  132 
LCS_GDT     L   134_A     L   134_A      3    4  132      3    3    3    4   17   41   53   95  104  112  124  128  129  131  132  132  132  132  132  132 
LCS_AVERAGE  LCS_A:  47.22  (   9.01   32.66  100.00 )

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     14     37     61     81     93    104    110    114    117    122    126    128    129    131    132    132    132    132    132    132 
GDT PERCENT_AT  10.61  28.03  46.21  61.36  70.45  78.79  83.33  86.36  88.64  92.42  95.45  96.97  97.73  99.24 100.00 100.00 100.00 100.00 100.00 100.00
GDT RMS_LOCAL    0.37   0.69   1.04   1.27   1.48   1.73   1.88   2.00   2.18   2.42   2.57   2.69   2.77   2.93   3.01   3.01   3.01   3.01   3.01   3.01
GDT RMS_ALL_AT   3.17   3.10   3.16   3.14   3.13   3.08   3.06   3.07   3.05   3.05   3.05   3.02   3.03   3.01   3.01   3.01   3.01   3.01   3.01   3.01

# Checking swapping
#   possible swapping detected:  D     5_A      D     5_A
#   possible swapping detected:  E    16_A      E    16_A
#   possible swapping detected:  E    21_A      E    21_A
#   possible swapping detected:  F    37_A      F    37_A
#   possible swapping detected:  E    45_A      E    45_A
#   possible swapping detected:  D    48_A      D    48_A
#   possible swapping detected:  D    50_A      D    50_A
#   possible swapping detected:  Y    51_A      Y    51_A
#   possible swapping detected:  F    55_A      F    55_A
#   possible swapping detected:  F    67_A      F    67_A
#   possible swapping detected:  Y    77_A      Y    77_A
#   possible swapping detected:  D    84_A      D    84_A
#   possible swapping detected:  D    87_A      D    87_A
#   possible swapping detected:  Y    92_A      Y    92_A
#   possible swapping detected:  E    93_A      E    93_A
#   possible swapping detected:  F   109_A      F   109_A
#   possible swapping detected:  D   110_A      D   110_A
#   possible swapping detected:  D   113_A      D   113_A
#   possible swapping detected:  Y   115_A      Y   115_A
#   possible swapping detected:  E   121_A      E   121_A
#   possible swapping detected:  E   122_A      E   122_A
#   possible swapping detected:  F   131_A      F   131_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    D     3_A      D     3_A     1.209     3    0.219   0.218     4.220   71.905   40.595
LGA    V     4_A      V     4_A     2.157     0    0.170   0.980     6.844   75.357   52.517
LGA    D     5_A      D     5_A     1.262     0    0.141   0.867     3.816   85.952   73.690
LGA    K     6_A      K     6_A     2.393     0    0.120   0.563     3.480   61.071   58.942
LGA    R     7_A      R     7_A     1.957     0    0.025   1.228     4.988   72.857   61.602
LGA    K     8_A      K     8_A     1.784     0    0.092   0.358     2.481   75.000   69.312
LGA    I     9_A      I     9_A     1.642     0    0.105   0.622     2.946   70.833   70.952
LGA    K    10_A      K    10_A     1.375     0    0.101   1.008     3.545   85.952   74.497
LGA    I    11_A      I    11_A     0.928     0    0.096   1.346     3.581   85.952   74.048
LGA    I    12_A      I    12_A     1.648     0    0.141   1.121     4.696   75.000   65.714
LGA    L    13_A      L    13_A     3.354     0    0.063   1.123     6.577   50.357   44.881
LGA    N    14_A      N    14_A     5.723     0    0.038   0.874    10.249   27.619   18.512
LGA    G    15_A      G    15_A     3.909     0    0.078   0.078     4.360   48.690   48.690
LGA    E    16_A      E    16_A     0.777     0    0.043   1.106     4.591   88.452   70.582
LGA    M    17_A      M    17_A     1.450     0    0.063   1.281     5.382   77.143   67.262
LGA    E    18_A      E    18_A     2.189     0    0.079   0.910     6.637   66.786   48.201
LGA    E    19_A      E    19_A     2.172     0    0.093   0.912     6.109   64.762   47.302
LGA    A    20_A      A    20_A     1.997     0    0.106   0.155     2.004   70.833   71.238
LGA    E    21_A      E    21_A     1.531     0    0.088   0.467     2.808   77.143   73.968
LGA    L    22_A      L    22_A     1.323     0    0.113   1.335     4.446   81.429   69.821
LGA    H    23_A      H    23_A     1.405     0    0.088   1.238     5.551   77.143   60.190
LGA    M    24_A      M    24_A     1.185     0    0.150   0.981     3.593   81.429   76.667
LGA    I    25_A      I    25_A     0.636     0    0.030   0.744     2.863   92.857   84.107
LGA    T    26_A      T    26_A     0.537     0    0.022   0.771     2.268   95.238   85.850
LGA    S    27_A      S    27_A     0.843     0    0.131   0.170     2.162   81.786   77.460
LGA    P    28_A      P    28_A     2.391     0    0.470   0.609     6.037   47.976   54.082
LGA    N    29_A      N    29_A     4.776     0    0.402   0.530     8.838   37.738   22.381
LGA    R    30_A      R    30_A     1.277     0    0.426   1.830     8.447   79.286   45.065
LGA    H    31_A      H    31_A     1.537     0    0.050   1.105     7.593   79.286   48.905
LGA    C    32_A      C    32_A     0.375     0    0.131   0.609     2.957   92.857   86.508
LGA    C    33_A      C    33_A     0.830     0    0.013   0.824     3.865   88.214   81.111
LGA    L    34_A      L    34_A     1.162     0    0.021   1.158     4.400   81.429   72.738
LGA    K    35_A      K    35_A     1.451     0    0.114   0.968     4.476   79.286   69.259
LGA    I    36_A      I    36_A     1.351     0    0.046   0.321     1.685   81.429   77.143
LGA    F    37_A      F    37_A     1.491     0    0.144   1.173     5.418   81.429   66.104
LGA    H    38_A      H    38_A     2.066     0    0.175   1.207     9.046   72.976   41.952
LGA    N    39_A      N    39_A     2.354     0    0.577   0.902     4.659   51.071   61.071
LGA    N    40_A      N    40_A     6.083     0    0.081   1.055    11.532   26.786   14.048
LGA    N    41_A      N    41_A     1.769     0    0.483   1.053     7.169   59.524   42.500
LGA    Q    42_A      Q    42_A     3.663     0    0.161   0.783    11.741   57.738   28.571
LGA    L    43_A      L    43_A     3.630     0    0.626   1.231    10.845   48.452   26.786
LGA    A    44_A      A    44_A     2.008     0    0.119   0.171     2.322   70.952   69.714
LGA    E    45_A      E    45_A     1.902     0    0.052   0.809     2.707   70.833   65.820
LGA    S    46_A      S    46_A     1.095     0    0.069   0.611     3.166   83.690   77.698
LGA    N    47_A      N    47_A     0.174     0    0.085   1.026     5.033   97.619   78.631
LGA    D    48_A      D    48_A     0.305     0    0.066   0.882     4.503  100.000   76.131
LGA    T    49_A      T    49_A     0.984     0    0.161   1.065     3.873   90.476   79.932
LGA    D    50_A      D    50_A     1.372     0    0.106   1.044     2.729   83.690   78.452
LGA    Y    51_A      Y    51_A     1.680     0    0.113   0.291     6.348   81.548   51.706
LGA    F    52_A      F    52_A     1.450     0    0.074   1.184     5.989   81.429   61.255
LGA    S    53_A      S    53_A     0.816     0    0.036   0.653     2.706   88.214   83.413
LGA    C    54_A      C    54_A     1.274     0    0.050   0.099     2.015   81.429   77.222
LGA    F    55_A      F    55_A     1.295     0    0.020   0.907     4.973   81.429   63.723
LGA    A    56_A      A    56_A     0.449     0    0.029   0.049     0.768   92.857   92.381
LGA    D    57_A      D    57_A     1.321     0    0.007   0.838     2.532   83.690   76.369
LGA    L    58_A      L    58_A     1.435     0    0.055   0.533     2.612   81.429   76.250
LGA    R    59_A      R    59_A     0.553     0    0.026   0.898     2.155   90.476   83.333
LGA    N    60_A      N    60_A     0.851     0    0.064   1.003     2.287   90.476   82.917
LGA    Q    61_A      Q    61_A     1.100     0    0.062   1.029     2.696   83.690   77.884
LGA    L    62_A      L    62_A     1.105     0    0.053   0.164     2.218   85.952   79.464
LGA    K    63_A      K    63_A     1.156     0    0.412   0.645     4.461   75.357   69.206
LGA    N    64_A      N    64_A     0.700     0    0.286   0.954     2.555   88.214   81.786
LGA    I    65_A      I    65_A     0.725     0    0.059   0.180     1.691   88.214   87.143
LGA    I    66_A      I    66_A     1.599     0    0.085   0.205     1.736   72.857   73.929
LGA    F    67_A      F    67_A     2.092     0    0.068   1.281     7.162   68.810   49.177
LGA    L    68_A      L    68_A     1.920     0    0.216   1.352     3.780   70.833   66.131
LGA    C    69_A      C    69_A     0.661     0    0.243   0.374     3.647   88.214   78.175
LGA    K    70_A      K    70_A     3.871     0    0.223   0.949     8.002   41.429   26.720
LGA    G    71_A      G    71_A     6.179     0    0.033   0.033     8.120   16.667   16.667
LGA    A    72_A      A    72_A     5.598     0    0.587   0.551     5.905   37.024   33.905
LGA    K    73_A      K    73_A     2.876     0    0.486   0.838     8.665   39.762   32.011
LGA    I    74_A      I    74_A     2.215     0    0.618   1.388     7.258   68.929   54.881
LGA    N    75_A      N    75_A     1.247     0    0.172   0.802     5.739   79.286   58.750
LGA    V    76_A      V    76_A     1.063     0    0.024   0.110     2.113   88.214   79.320
LGA    Y    77_A      Y    77_A     0.489     0    0.207   0.690     3.521   95.238   77.540
LGA    P    78_A      P    78_A     1.384     0    0.190   0.372     3.627   67.738   63.197
LGA    S    79_A      S    79_A     3.097     0    0.128   0.673     5.182   57.262   50.873
LGA    A    80_A      A    80_A     2.847     0    0.268   0.265     3.088   63.333   60.667
LGA    M    81_A      M    81_A     2.549     0    0.186   1.069     9.339   62.976   40.357
LGA    S    82_A      S    82_A     2.366     0    0.441   0.406     2.732   62.857   60.952
LGA    R    83_A      R    83_A     3.191     0    0.146   1.405     9.072   50.000   37.316
LGA    D    84_A      D    84_A     2.899     0    0.139   0.792     3.984   55.357   56.488
LGA    M    85_A      M    85_A     2.698     0    0.334   0.892     7.062   59.167   46.369
LGA    S    86_A      S    86_A     2.313     0    0.690   0.875     6.757   61.190   48.254
LGA    D    87_A      D    87_A     5.968     0    0.067   0.918     8.511   17.857   19.107
LGA    G    88_A      G    88_A     7.970     0    0.675   0.675     7.970   14.762   14.762
LGA    I    89_A      I    89_A     4.076     0    0.589   1.699     7.855   34.762   32.679
LGA    V    90_A      V    90_A     1.545     0    0.059   0.675     2.198   75.119   74.218
LGA    A    91_A      A    91_A     0.971     0    0.077   0.102     1.859   88.214   85.143
LGA    Y    92_A      Y    92_A     0.765     0    0.040   1.259     7.844   85.952   58.175
LGA    E    93_A      E    93_A     1.152     0    0.031   0.479     2.582   81.429   77.778
LGA    T    94_A      T    94_A     0.989     0    0.137   0.161     1.430   83.690   85.306
LGA    T    95_A      T    95_A     1.515     0    0.070   1.226     3.744   75.000   67.823
LGA    L    96_A      L    96_A     1.901     0    0.032   1.349     4.854   75.000   65.774
LGA    G    97_A      G    97_A     2.522     0    0.273   0.273     2.522   62.857   62.857
LGA    Q    98_A      Q    98_A     2.335     0    0.153   0.804     4.462   62.857   63.598
LGA    P    99_A      P    99_A     1.755     0    0.152   0.405     2.456   77.381   74.286
LGA    G   100_A      G   100_A     3.437     0    0.172   0.172     4.602   43.929   43.929
LGA    L   101_A      L   101_A     6.120     0    0.212   0.866     9.164   12.976   16.131
LGA    P   102_A      P   102_A     8.422     0    0.193   0.313    10.619    4.286    2.449
LGA    E   103_A      E   103_A     8.934     0    0.124   1.220    11.037    4.405    2.169
LGA    N   104_A      N   104_A     5.199     0    0.188   0.959     6.169   30.952   37.321
LGA    Q   105_A      Q   105_A     2.868     0    0.143   0.375     4.415   50.238   47.196
LGA    V   106_A      V   106_A     2.913     0    0.059   0.955     4.604   59.048   55.782
LGA    H   107_A      H   107_A     2.825     0    0.165   1.220     8.672   50.357   31.238
LGA    I   108_A      I   108_A     3.103     0    0.257   0.945     5.512   41.429   50.476
LGA    F   109_A      F   109_A     5.774     0    0.463   0.467     8.845   29.048   13.939
LGA    D   110_A      D   110_A     4.695     0    0.563   0.903     5.580   26.310   30.655
LGA    F   111_A      F   111_A     6.371     0    0.166   1.268    11.880   21.548    9.307
LGA    E   112_A      E   112_A     3.445     0    0.302   1.013     8.199   39.167   26.931
LGA    D   113_A      D   113_A     3.276     0    0.655   1.026     3.841   51.786   49.226
LGA    K   114_A      K   114_A     4.973     0    0.433   1.032     8.356   22.262   14.921
LGA    Y   115_A      Y   115_A     5.799     0    0.444   1.144     7.601   20.714   27.183
LGA    V   116_A      V   116_A     6.083     0    0.704   1.488     8.284   21.667   16.395
LGA    D   117_A      D   117_A     3.517     0    0.345   1.092     4.049   45.000   45.952
LGA    I   118_A      I   118_A     3.479     0    0.305   1.219     6.397   57.262   44.048
LGA    T   119_A      T   119_A     2.141     0    0.038   0.784     3.488   71.190   65.238
LGA    P   120_A      P   120_A     0.657     0    0.069   0.361     1.405   90.476   89.184
LGA    E   121_A      E   121_A     1.136     0    0.031   1.016     7.243   85.952   54.921
LGA    E   122_A      E   122_A     0.795     0    0.129   0.676     3.588   95.238   77.937
LGA    Q   123_A      Q   123_A     0.109     0    0.049   0.552     2.253   97.619   85.979
LGA    R   124_A      R   124_A     1.155     0    0.087   1.224     4.855   83.690   69.437
LGA    K   125_A      K   125_A     1.074     0    0.054   1.230     7.449   83.690   61.746
LGA    F   126_A      F   126_A     1.066     0    0.061   0.657     4.619   85.952   65.152
LGA    H   127_A      H   127_A     0.922     0    0.056   1.640     6.079   85.952   61.190
LGA    S   128_A      S   128_A     1.599     0    0.126   0.530     1.704   75.000   74.286
LGA    Q   129_A      Q   129_A     1.909     0    0.043   0.541     2.928   72.857   72.169
LGA    W   130_A      W   130_A     1.480     0    0.094   0.469     2.306   77.143   72.959
LGA    F   131_A      F   131_A     1.331     0    0.285   1.190     5.884   77.619   54.156
LGA    E   132_A      E   132_A     1.801     0    0.232   1.056     6.044   50.714   52.910
LGA    S   133_A      S   133_A     9.000     0    0.474   0.684    12.181    5.833    3.889
LGA    L   134_A      L   134_A     7.708     0    0.494   0.659     9.631   11.190    7.262

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      132     528    528  100.00    1073   1073  100.00               132
SUMMARY(RMSD_GDC):     3.007          3.014                  3.921           65.933   56.986

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  142  132    4.0    114    2.00    68.939    64.592     5.418

LGA_LOCAL      RMSD:   2.004  Number of atoms:  114  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   3.069  Number of assigned atoms:  132 
Std_ASGN_ATOMS RMSD:   3.007  Standard rmsd on all 132 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.981144 * X  +  -0.089404 * Y  +  -0.171355 * Z  + -12.634734
  Y_new =   0.075360 * X  +   0.993372 * Y  +  -0.086795 * Z  +  11.406716
  Z_new =   0.177979 * X  +   0.072245 * Y  +   0.981379 * Z  +   0.202259 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  0.076658 -0.178932  0.073483   [DEG:    4.3922  -10.2521    4.2103 ]
ZXZ: -1.101945  0.193284  1.185198   [DEG:  -63.1368   11.0744   67.9068 ]
 
# END of job
