
#######################################################
#                                                     #
#                        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   77 (  600),  selected   77 , name one
# Molecule2: number of CA atoms  207 ( 1517),  selected   77 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:B  -ch2:B  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    31      70_B - 100_B       4.77    31.95
  LCS_AVERAGE:     12.70

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    26      70_B - 95_B        1.90    37.85
  LCS_AVERAGE:      8.19

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    20      71_B - 90_B        0.97    39.87
  LONGEST_CONTINUOUS_SEGMENT:    20      73_B - 92_B        0.96    39.36
  LCS_AVERAGE:      6.40

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:   77
LCS_GDT     RESIDUE       RESIDUE       SEGMENT_SIZE    GLOBAL DISTANCE TEST COLUMNS: number of residues under the threshold assigned to each residue pair
LCS_GDT   NAME NUMBER   NAME NUMBER    1.0  2.0  5.0    0.5  1.0  1.5  2.0  2.5  3.0  3.5  4.0  4.5  5.0  5.5  6.0  6.5  7.0  7.5  8.0  8.5  9.0  9.5 10.0
LCS_GDT     E    70_B     E    70_B     19   26   31      8   15   19   21   23   23   25   26   26   27   27   27   28   30   30   30   30   33   35   38 
LCS_GDT     M    71_B     M    71_B     20   26   31      8   15   19   22   23   24   25   26   26   27   27   27   28   30   30   30   30   33   35   38 
LCS_GDT     K    72_B     K    72_B     20   26   31      8   15   19   22   23   24   25   26   26   27   27   27   28   30   30   30   30   30   31   34 
LCS_GDT     A    73_B     A    73_B     20   26   31      8   15   19   22   23   24   25   26   26   27   27   27   28   30   30   30   30   30   31   32 
LCS_GDT     A    74_B     A    74_B     20   26   31      8   15   19   22   23   24   25   26   26   27   27   27   28   30   30   30   30   30   31   32 
LCS_GDT     L    75_B     L    75_B     20   26   31      8   15   19   22   23   24   25   26   26   27   27   27   28   30   30   30   30   30   31   32 
LCS_GDT     A    76_B     A    76_B     20   26   31      8   15   19   22   23   24   25   26   26   27   27   27   28   30   30   30   30   30   31   32 
LCS_GDT     A    77_B     A    77_B     20   26   31      8   15   19   22   23   24   25   26   26   27   27   27   28   30   30   30   30   30   31   32 
LCS_GDT     A    78_B     A    78_B     20   26   31     10   15   19   22   23   24   25   26   26   27   27   27   28   30   30   30   30   30   31   32 
LCS_GDT     K    79_B     K    79_B     20   26   31      9   15   19   22   23   24   25   26   26   27   27   27   28   30   30   30   30   30   31   32 
LCS_GDT     T    80_B     T    80_B     20   26   31      7   15   19   22   23   24   25   26   26   27   27   27   28   30   30   30   30   30   31   32 
LCS_GDT     P    81_B     P    81_B     20   26   31     11   15   19   22   23   24   25   26   26   27   27   27   28   30   30   30   30   30   31   32 
LCS_GDT     E    82_B     E    82_B     20   26   31     11   15   19   22   23   24   25   26   26   27   27   27   28   30   30   30   30   30   31   32 
LCS_GDT     E    83_B     E    83_B     20   26   31     11   15   19   22   23   24   25   26   26   27   27   27   28   30   30   30   30   30   31   32 
LCS_GDT     K    84_B     K    84_B     20   26   31     11   15   19   22   23   24   25   26   26   27   27   27   28   30   30   30   30   30   31   32 
LCS_GDT     I    85_B     I    85_B     20   26   31     11   15   19   22   23   24   25   26   26   27   27   27   28   30   30   30   30   30   31   32 
LCS_GDT     A    86_B     A    86_B     20   26   31     11   15   19   22   23   24   25   26   26   27   27   27   28   30   30   30   30   30   31   32 
LCS_GDT     V    87_B     V    87_B     20   26   31     11   15   19   22   23   24   25   26   26   27   27   27   28   30   30   30   30   30   31   32 
LCS_GDT     F    88_B     F    88_B     20   26   31     11   15   19   22   23   24   25   26   26   27   27   27   28   30   30   30   30   32   35   38 
LCS_GDT     R    89_B     R    89_B     20   26   31     11   15   19   22   23   24   25   26   26   27   27   27   28   30   30   31   33   36   36   38 
LCS_GDT     E    90_B     E    90_B     20   26   31     11   15   19   22   23   24   25   26   26   27   27   27   28   30   30   33   33   37   40   41 
LCS_GDT     Y    91_B     Y    91_B     20   26   31     11   15   19   22   23   24   25   26   26   27   27   27   28   30   33   36   37   38   40   43 
LCS_GDT     N    92_B     N    92_B     20   26   31     11   15   19   22   23   24   25   26   26   27   27   27   28   30   33   36   37   38   42   43 
LCS_GDT     A    93_B     A    93_B     18   26   31      4    4   14   20   23   24   25   26   26   27   27   27   28   30   33   36   37   38   42   43 
LCS_GDT     R    94_B     R    94_B      4   26   31      4    4    5   10   19   21   25   26   26   27   27   27   32   33   34   36   38   39   42   43 
LCS_GDT     F    95_B     F    95_B      4   26   31      4    4   11   20   21   24   25   26   26   27   27   27   32   33   34   36   38   39   42   43 
LCS_GDT     L    96_B     L    96_B     16   17   31      5   15   16   16   16   16   20   25   26   27   27   27   32   33   34   36   38   39   42   43 
LCS_GDT     A    97_B     A    97_B     16   17   31      3   15   16   16   16   16   17   18   21   22   24   27   32   33   34   35   38   39   42   43 
LCS_GDT     E    98_B     E    98_B     16   17   31      3   15   16   16   16   16   17   18   21   22   24   27   32   33   34   35   38   39   41   43 
LCS_GDT     F    99_B     F    99_B     16   17   31      3   15   16   16   16   16   17   19   21   22   24   27   32   33   34   36   38   39   42   43 
LCS_GDT     D   100_B     D   100_B     16   17   31      4   15   16   16   16   16   17   19   21   22   24   27   32   33   34   36   38   39   42   43 
LCS_GDT     A   101_B     A   101_B     16   17   26      5   15   16   16   16   16   17   19   21   22   24   27   32   33   34   35   38   39   42   43 
LCS_GDT     L   102_B     L   102_B     16   17   26      9   15   16   16   16   16   17   19   21   22   24   27   32   33   34   35   38   39   42   43 
LCS_GDT     I   103_B     I   103_B     16   17   26      9   15   16   16   16   16   17   19   21   22   24   27   32   33   34   36   38   39   42   43 
LCS_GDT     D   104_B     D   104_B     16   17   26      9   15   16   16   16   16   17   19   21   22   24   27   32   33   34   36   38   39   42   43 
LCS_GDT     Q   105_B     Q   105_B     16   17   26      7   15   16   16   16   16   17   19   21   22   24   24   27   33   34   35   38   39   42   43 
LCS_GDT     A   106_B     A   106_B     16   17   26      9   15   16   16   16   16   17   19   21   22   24   27   28   28   32   35   38   39   42   43 
LCS_GDT     F   107_B     F   107_B     16   17   26      9   15   16   16   16   16   17   19   21   22   24   27   32   33   34   36   38   39   42   43 
LCS_GDT     A   108_B     A   108_B     16   17   26      9   15   16   16   16   16   17   19   21   22   24   27   32   33   34   36   38   39   42   43 
LCS_GDT     R   109_B     R   109_B     16   17   26      9   15   16   16   16   16   17   19   21   22   24   24   26   28   30   31   35   38   40   42 
LCS_GDT     L   110_B     L   110_B     16   17   26      9   15   16   16   16   16   17   19   21   22   24   27   28   28   32   36   38   39   42   43 
LCS_GDT     K   111_B     K   111_B     16   17   26      9   15   16   16   16   16   17   18   20   22   24   27   32   33   34   36   38   39   42   43 
LCS_GDT     A   112_B     A   112_B      4   17   26      3    3    7    9    9   13   15   19   21   22   24   27   32   33   34   36   38   39   42   43 
LCS_GDT     D   113_B     D   113_B      4    4   26      3    6    9   10   12   14   15   18   20   22   24   27   32   33   34   36   38   39   42   43 
LCS_GDT     S   114_B     S   114_B      3    4   26      3    3    4    4    8   12   15   18   18   20   21   24   28   30   33   36   38   39   42   43 
LCS_GDT     L   115_B     L   115_B      3    4   26      2    3    4    4    4    7   10   12   16   18   20   23   25   29   32   33   38   38   40   43 
LCS_GDT     T   116_B     T   116_B      3    8   26      3    3    5    7    8    9   11   13   15   18   20   23   26   28   30   31   34   36   40   43 
LCS_GDT     L   117_B     L   117_B      7    8   26      4    6    7    7    8    9   11   13   15   18   20   23   25   28   30   31   34   36   40   43 
LCS_GDT     K   118_B     K   118_B      7    8   21      4    6    7    7    8    8    9    9   10   10   10   14   22   28   29   31   33   36   40   43 
LCS_GDT     I   119_B     I   119_B      7    8   12      4    6    7    7    8    8    9    9   10   10   10   11   16   22   25   28   30   35   40   43 
LCS_GDT     H   120_B     H   120_B      7    8   12      4    6    7    7    8    8    9    9   10   10   10   15   19   23   25   28   30   31   40   43 
LCS_GDT     L   121_B     L   121_B      7    8   12      4    6    7    7    8    8    9    9   10   10   10   12   16   23   25   28   30   31   33   33 
LCS_GDT     S   122_B     S   122_B      7    8   13      4    6    7    7    8    8    9    9   10   10   10   12   19   23   25   28   30   31   33   33 
LCS_GDT     Q   123_B     Q   123_B      7    8   22      3    5    7    7    8    8    9    9   10   10   10   11   12   16   23   27   30   30   32   33 
LCS_GDT     G   124_B     G   124_B      4    5   23      3    4    4    4    5    7    9    9   10   15   19   21   22   23   25   28   30   31   33   33 
LCS_GDT     K   125_B     K   125_B      4   13   23      3    4    4    6   11   13   15   16   18   19   20   21   23   25   27   30   32   33   38   40 
LCS_GDT     G   126_B     G   126_B     11   13   23      3    9   11   11   12   14   15   18   18   20   23   26   28   30   33   36   37   38   42   43 
LCS_GDT     S   127_B     S   127_B     11   13   23      3    6   11   11   12   14   15   18   18   20   23   26   28   30   33   36   37   38   42   43 
LCS_GDT     Y   128_B     Y   128_B     11   13   23      7    9   11   11   12   14   15   18   19   21   24   27   28   30   34   36   38   39   42   43 
LCS_GDT     E   129_B     E   129_B     11   13   23      7    8   11   11   12   14   15   18   20   22   24   27   32   33   34   36   38   39   42   43 
LCS_GDT     I   130_B     I   130_B     11   13   23      7    9   11   11   12   14   15   18   20   22   24   27   32   33   34   36   38   39   42   43 
LCS_GDT     I   131_B     I   131_B     11   13   23      7    9   11   11   12   14   15   18   20   22   24   27   32   33   34   36   38   39   42   43 
LCS_GDT     F   132_B     F   132_B     11   13   23      7    9   11   11   12   14   15   18   20   22   24   27   32   33   34   36   38   39   42   43 
LCS_GDT     P   133_B     P   133_B     11   13   23      7    9   11   11   12   14   15   18   20   22   24   27   32   33   34   36   38   39   42   43 
LCS_GDT     P   134_B     P   134_B     11   13   23      7    9   11   11   12   14   15   18   20   22   24   27   32   33   34   36   38   39   42   43 
LCS_GDT     E   135_B     E   135_B     11   13   23      6    9   11   11   12   14   15   18   19   22   24   27   32   33   34   36   38   39   42   43 
LCS_GDT     V   136_B     V   136_B     11   13   23      4    9   11   11   12   14   15   18   21   22   24   27   32   33   34   36   38   39   42   43 
LCS_GDT     Q   137_B     Q   137_B      3   13   23      3    3    4    5    8   12   15   19   21   22   24   27   32   33   34   36   38   39   42   43 
LCS_GDT     A   138_B     A   138_B      9   10   23      3    6    9    9    9   12   14   19   21   22   24   27   32   33   34   36   38   39   42   43 
LCS_GDT     D   139_B     D   139_B      9   10   23      8    8    9    9    9   14   15   18   20   22   24   27   32   33   34   36   38   39   42   43 
LCS_GDT     P   140_B     P   140_B      9   10   23      8    8    9    9   12   14   15   18   20   22   24   27   32   33   34   36   38   39   42   43 
LCS_GDT     E   141_B     E   141_B      9   10   23      8    8    9    9    9   12   15   18   18   20   23   27   32   33   34   36   38   39   42   43 
LCS_GDT     R   142_B     R   142_B      9   10   23      8    8    9    9    9   10   13   18   18   20   21   25   32   33   34   36   38   39   42   43 
LCS_GDT     A   143_B     A   143_B      9   10   23      8    8    9    9    9   10   13   18   18   21   24   27   32   33   34   36   38   39   42   43 
LCS_GDT     A   144_B     A   144_B      9   10   23      8    8    9    9    9   10   12   14   18   20   20   25   32   33   34   36   38   39   42   43 
LCS_GDT     A   145_B     A   145_B      9   10   23      8    8    9    9    9   10   10   12   14   19   20   23   25   30   31   33   38   39   42   43 
LCS_GDT     I   146_B     I   146_B      9   10   23      8    8    9    9    9   10   10   12   13   14   19   23   25   30   31   33   38   39   42   43 
LCS_AVERAGE  LCS_A:   9.10  (   6.40    8.19   12.70 )

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     11     15     19     22     23     24     25     26     26     27     27     27     32     33     34     36     38     39     42     43 
GDT PERCENT_AT   5.31   7.25   9.18  10.63  11.11  11.59  12.08  12.56  12.56  13.04  13.04  13.04  15.46  15.94  16.43  17.39  18.36  18.84  20.29  20.77
GDT RMS_LOCAL    0.22   0.44   0.80   1.12   1.19   1.56   1.66   1.90   1.90   2.28   2.28   2.28   4.64   4.71   4.81   5.30   5.37   5.47   6.07   6.92
GDT RMS_ALL_AT  40.09  39.63  39.36  39.53  39.71  38.21  38.37  37.85  37.85  36.98  36.98  36.98  19.08  19.16  19.10  17.39  18.93  18.92  18.13  16.89

# Checking swapping
#   possible swapping detected:  E    70_B      E    70_B
#   possible swapping detected:  F    95_B      F    95_B
#   possible swapping detected:  E    98_B      E    98_B
#   possible swapping detected:  D   100_B      D   100_B
#   possible swapping detected:  D   104_B      D   104_B
#   possible swapping detected:  F   107_B      F   107_B
#   possible swapping detected:  Y   128_B      Y   128_B
#   possible swapping detected:  E   129_B      E   129_B
#   possible swapping detected:  E   141_B      E   141_B

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    E    70_B      E    70_B     3.476     0    0.027   0.652     6.072   53.810   43.069
LGA    M    71_B      M    71_B     2.447     0    0.020   0.829     6.151   64.881   49.643
LGA    K    72_B      K    72_B     2.293     0    0.137   0.346     5.083   69.048   52.381
LGA    A    73_B      A    73_B     2.032     0    0.047   0.055     2.670   70.952   68.190
LGA    A    74_B      A    74_B     1.263     0    0.050   0.049     1.594   83.810   83.333
LGA    L    75_B      L    75_B     0.802     0    0.042   1.304     3.865   88.214   78.036
LGA    A    76_B      A    76_B     1.237     0    0.027   0.024     2.052   77.381   78.190
LGA    A    77_B      A    77_B     2.076     0    0.121   0.142     2.496   70.833   69.619
LGA    A    78_B      A    78_B     1.419     0    0.072   0.080     1.655   79.286   78.000
LGA    K    79_B      K    79_B     0.926     0    0.132   1.267     4.606   88.214   69.630
LGA    T    80_B      T    80_B     1.015     0    0.154   0.890     2.142   83.690   80.408
LGA    P    81_B      P    81_B     0.925     0    0.041   0.344     2.661   90.476   83.129
LGA    E    82_B      E    82_B     0.801     4    0.068   0.084     1.001   90.476   49.259
LGA    E    83_B      E    83_B     0.733     4    0.010   0.015     1.009   90.476   49.259
LGA    K    84_B      K    84_B     0.797     0    0.065   0.571     2.210   90.476   79.841
LGA    I    85_B      I    85_B     1.213     0    0.070   1.080     2.326   83.690   76.250
LGA    A    86_B      A    86_B     1.116     0    0.073   0.075     1.315   88.214   86.857
LGA    V    87_B      V    87_B     0.519     0    0.062   0.148     0.897   92.857   91.837
LGA    F    88_B      F    88_B     1.278     0    0.017   0.078     2.762   83.690   70.303
LGA    R    89_B      R    89_B     1.738     0    0.013   0.679     3.825   77.143   65.238
LGA    E    90_B      E    90_B     1.020     0    0.089   0.930     3.500   85.952   75.397
LGA    Y    91_B      Y    91_B     0.768     0    0.162   1.349    10.540   83.810   45.238
LGA    N    92_B      N    92_B     2.163     0    0.021   1.023     2.856   64.881   66.964
LGA    A    93_B      A    93_B     2.307     0    0.185   0.206     4.330   54.167   52.000
LGA    R    94_B      R    94_B     4.654     0    0.030   1.094     7.318   33.333   20.563
LGA    F    95_B      F    95_B     3.297     0    0.546   1.164     8.272   50.119   31.255
LGA    L    96_B      L    96_B     7.398     0    0.610   1.384    11.023    7.976    4.464
LGA    A    97_B      A    97_B    13.992     0    0.564   0.571    15.629    0.000    0.000
LGA    E    98_B      E    98_B    15.450     0    0.107   1.244    16.724    0.000    0.000
LGA    F    99_B      F    99_B    13.344     0    0.084   0.233    17.572    0.000    0.000
LGA    D   100_B      D   100_B    18.336     0    0.031   1.195    22.547    0.000    0.000
LGA    A   101_B      A   101_B    22.941     0    0.069   0.065    25.388    0.000    0.000
LGA    L   102_B      L   102_B    21.576     0    0.118   0.696    25.197    0.000    0.000
LGA    I   103_B      I   103_B    24.010     0    0.032   0.777    28.598    0.000    0.000
LGA    D   104_B      D   104_B    29.294     0    0.037   1.141    33.300    0.000    0.000
LGA    Q   105_B      Q   105_B    31.688     0    0.074   1.037    34.870    0.000    0.000
LGA    A   106_B      A   106_B    31.766     0    0.052   0.057    36.175    0.000    0.000
LGA    F   107_B      F   107_B    36.001     0    0.080   0.915    40.638    0.000    0.000
LGA    A   108_B      A   108_B    40.468     0    0.138   0.150    44.153    0.000    0.000
LGA    R   109_B      R   109_B    41.455     0    0.018   1.222    45.034    0.000    0.000
LGA    L   110_B      L   110_B    43.891     3    0.210   0.224    48.180    0.000    0.000
LGA    K   111_B      K   111_B    48.424     2    0.350   0.634    51.722    0.000    0.000
LGA    A   112_B      A   112_B    48.465     0    0.603   0.588    48.695    0.000    0.000
LGA    D   113_B      D   113_B    49.517     0    0.122   0.379    50.088    0.000    0.000
LGA    S   114_B      S   114_B    50.136     0    0.684   0.600    54.031    0.000    0.000
LGA    L   115_B      L   115_B    53.138     0    0.620   0.745    54.385    0.000    0.000
LGA    T   116_B      T   116_B    52.565     0    0.528   0.547    55.910    0.000    0.000
LGA    L   117_B      L   117_B    50.149     0    0.119   1.423    52.527    0.000    0.000
LGA    K   118_B      K   118_B    47.172     0    0.054   0.753    48.572    0.000    0.000
LGA    I   119_B      I   119_B    43.275     0    0.031   1.050    44.333    0.000    0.000
LGA    H   120_B      H   120_B    42.016     0    0.120   1.179    43.650    0.000    0.000
LGA    L   121_B      L   121_B    36.529     0    0.161   1.196    38.420    0.000    0.000
LGA    S   122_B      S   122_B    35.150     0    0.183   0.534    36.606    0.000    0.000
LGA    Q   123_B      Q   123_B    31.297     4    0.608   0.603    32.924    0.000    0.000
LGA    G   124_B      G   124_B    27.614     0    0.079   0.079    29.245    0.000    0.000
LGA    K   125_B      K   125_B    23.899     4    0.625   0.601    25.524    0.000    0.000
LGA    G   126_B      G   126_B    26.374     0    0.596   0.596    29.729    0.000    0.000
LGA    S   127_B      S   127_B    32.335     0    0.296   0.406    35.485    0.000    0.000
LGA    Y   128_B      Y   128_B    35.517     0    0.097   1.330    40.250    0.000    0.000
LGA    E   129_B      E   129_B    42.320     0    0.055   0.976    48.228    0.000    0.000
LGA    I   130_B      I   130_B    45.413     0    0.112   0.232    49.809    0.000    0.000
LGA    I   131_B      I   131_B    51.115     0    0.061   0.148    53.817    0.000    0.000
LGA    F   132_B      F   132_B    55.564     0    0.064   1.364    58.770    0.000    0.000
LGA    P   133_B      P   133_B    60.434     0    0.068   0.247    63.231    0.000    0.000
LGA    P   134_B      P   134_B    67.943     0    0.074   0.071    69.832    0.000    0.000
LGA    E   135_B      E   135_B    67.474     4    0.590   0.539    67.474    0.000    0.000
LGA    V   136_B      V   136_B    62.972     0    0.675   1.261    65.399    0.000    0.000
LGA    Q   137_B      Q   137_B    64.933     4    0.390   0.388    65.866    0.000    0.000
LGA    A   138_B      A   138_B    67.021     0    0.564   0.525    70.025    0.000    0.000
LGA    D   139_B      D   139_B    68.008     0    0.266   0.453    70.642    0.000    0.000
LGA    P   140_B      P   140_B    68.089     0    0.079   0.155    72.465    0.000    0.000
LGA    E   141_B      E   141_B    68.915     0    0.068   1.211    73.990    0.000    0.000
LGA    R   142_B      R   142_B    62.430     0    0.004   1.110    65.096    0.000    0.000
LGA    A   143_B      A   143_B    59.301     0    0.021   0.040    60.907    0.000    0.000
LGA    A   144_B      A   144_B    61.540     0    0.031   0.030    64.274    0.000    0.000
LGA    A   145_B      A   145_B    59.926     0    0.143   0.147    61.141    0.000    0.000
LGA    I   146_B      I   146_B    53.258     0    0.054   0.255    55.992    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:       77     308    308  100.00     571    571  100.00               207
SUMMARY(RMSD_GDC):    14.382         14.286                 14.420            9.651    8.205

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)   77  207    4.0     26    1.90    11.957    11.048     1.300

LGA_LOCAL      RMSD:   1.901  Number of atoms:   26  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  37.850  Number of assigned atoms:   77 
Std_ASGN_ATOMS RMSD:  14.382  Standard rmsd on all 77 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.104907 * X  +  -0.705153 * Y  +  -0.701252 * Z  +  81.226608
  Y_new =  -0.967495 * X  +   0.090787 * Y  +  -0.236030 * Z  +  68.759682
  Z_new =   0.230102 * X  +   0.703219 * Y  +  -0.672708 * Z  + -31.708694 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -1.462786 -0.232183  2.334023   [DEG:  -83.8115  -13.3031  133.7297 ]
ZXZ: -1.246123  2.308659  0.316232   [DEG:  -71.3976  132.2764   18.1187 ]
 
# END of job
