
#######################################################
#                                                     #
#                        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  153 ( 1254),  selected   76 , name one
# Molecule2: number of CA atoms   76 (  627),  selected   76 , 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:    29      11_A - 39_A        4.85    19.60
  LCS_AVERAGE:     32.55

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    15      62_A - 76_A        1.87    22.96
  LCS_AVERAGE:     11.25

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    13      62_A - 74_A        0.72    23.25
  LCS_AVERAGE:      8.64

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:   76
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     M     1_A     M     1_A      4    5   14      4    4    4    4    4    5    7   11   11   13   17   18   22   27   31   36   39   43   46   47 
LCS_GDT     K     2_A     K     2_A      4    5   14      4    4    4    5    7    8    9   11   11   15   17   18   23   27   31   36   39   43   46   47 
LCS_GDT     I     3_A     I     3_A      4    5   24      4    4    4    5    5    8    8   11   11   15   17   18   23   27   31   36   39   43   46   49 
LCS_GDT     H     4_A     H     4_A      4    5   24      4    4    4    5    7    8    9   11   12   15   17   18   25   28   31   36   41   46   48   52 
LCS_GDT     E     5_A     E     5_A      3    5   25      3    3    4    5    7    8   10   12   18   21   24   29   32   38   42   46   50   51   52   53 
LCS_GDT     F     6_A     F     6_A      3    4   25      3    3    4    8    9   12   15   19   22   26   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     G     7_A     G     7_A      3    4   25      3    3    4    5    7    8    9   11   17   22   26   30   33   40   45   46   50   51   52   54 
LCS_GDT     L     8_A     L     8_A      3    4   25      3    3    4    5    5    6    7    9   11   17   22   26   30   35   42   46   50   51   52   53 
LCS_GDT     A     9_A     A     9_A      3    4   25      3    3    4    5    7    8   13   19   22   26   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     L    10_A     L    10_A      3    5   27      3    3    4    5    8   12   16   19   22   26   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     F    11_A     F    11_A      4    5   29      3    4    6    8    9   12   16   19   22   26   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     G    12_A     G    12_A      4    5   29      3    4    4    5   12   15   16   19   22   26   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     E    13_A     E    13_A      4    5   29      3    4    4    4    9   12   12   17   21   26   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     H    14_A     H    14_A      4    5   29      3    4    4    4    7    8   13   19   22   26   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     Y    15_A     Y    15_A      3   11   29      3   11   14   14   14   15   15   17   21   23   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     S    16_A     S    16_A      9   11   29      4    9    9    9   11   12   15   17   21   26   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     A    17_A     A    17_A      9   11   29      7    9   10   10   11   13   15   17   22   26   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     N    18_A     N    18_A      9   11   29      7    9   10   10   11   13   16   19   22   26   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     Q    19_A     Q    19_A      9   11   29      7    9   10   10   11   13   16   19   22   26   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     F    20_A     F    20_A      9   11   29      7    9   10   10   11   13   15   19   22   26   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     A    21_A     A    21_A      9   11   29      7    9   10   10   11   13   16   19   22   26   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     K    22_A     K    22_A      9   11   29      7    9   10   10   11   13   16   19   22   26   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     I    23_A     I    23_A      9   11   29      7    9   10   10   11   13   15   19   22   26   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     L    24_A     L    24_A      9   11   29      7    9   10   10   11   13   16   19   22   26   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     I    25_A     I    25_A      9   11   29      3    3    4    9   11   13   16   19   22   26   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     N    26_A     N    26_A      5    6   29      4    4    5    5    7    9   11   13   16   20   25   26   28   33   40   41   46   50   52   54 
LCS_GDT     K    27_A     K    27_A      5    6   29      4    4    5    5    7    9   11   12   14   16   20   22   23   25   31   36   39   43   46   49 
LCS_GDT     D    28_A     D    28_A      5    6   29      4    4    5    5    7    9   11   12   14   16   19   22   28   34   37   41   43   48   52   54 
LCS_GDT     G    29_A     G    29_A      5    6   29      4    4    5    7   11   13   16   19   22   26   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     S    30_A     S    30_A      5    6   29      1    4   10   10   11   13   16   19   22   26   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     N    31_A     N    31_A      5    6   29      3    4    5    5    7    9   11   16   17   25   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     V    32_A     V    32_A      5    6   29      3    4    5    5   11   13   15   17   18   24   29   30   35   41   45   46   50   51   52   54 
LCS_GDT     D    33_A     D    33_A      5    6   29      3    4    5    8   11   13   15   17   18   24   29   30   33   38   45   46   50   51   52   54 
LCS_GDT     R    34_A     R    34_A      5    6   29      3    4    5    6   11   13   15   17   18   23   25   30   33   38   45   46   50   51   52   54 
LCS_GDT     K    35_A     K    35_A      5    6   29      0    3   10   10   11   13   15   17   18   21   23   27   32   38   42   46   50   51   52   54 
LCS_GDT     T    36_A     T    36_A      4    4   29      3    5    7    9   10   11   11   12   14   20   23   27   32   38   45   46   50   51   52   54 
LCS_GDT     I    37_A     I    37_A      4    4   29      3    4    4    5    5    7    7   11   16   19   24   29   34   41   45   46   50   51   52   54 
LCS_GDT     Q    38_A     Q    38_A      4    4   29      3    4    4    5    5   11   15   16   22   26   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     N    39_A     N    39_A      4    5   29      3    4    5    8    9   12   16   19   22   26   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     W    40_A     W    40_A      4    5   28      3    4    4    6    9   10   12   19   22   26   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     I    41_A     I    41_A      4    5   25      3    4    4    4    5    7    9   11   14   16   19   25   30   35   43   46   50   51   52   54 
LCS_GDT     N    42_A     N    42_A      4    5   25      3    4    4    4    5    7    9   11   14   19   22   25   31   38   43   46   50   51   52   54 
LCS_GDT     R    43_A     R    43_A      4    5   25      4    4    5    8    9   12   16   19   22   26   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     D    44_A     D    44_A      3    3   25      4    4    5    8    9   12   16   19   22   26   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     Q    45_A     Q    45_A      3    3   25      3    3    3    5    9   12   16   19   22   26   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     D    46_A     D    46_A      3    3   25      3    3    6    6    9   12   16   19   22   26   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     L    47_A     L    47_A      3   10   25      3    5    6    8    9   12   16   19   22   26   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     N    48_A     N    48_A      8   10   25      3    6    8    9    9   10   10   11   17   24   29   30   35   41   45   46   50   51   52   54 
LCS_GDT     D    49_A     D    49_A      8   10   25      6    7    8    9    9   10   10   12   18   24   30   32   35   41   45   46   50   51   52   54 
LCS_GDT     W    50_A     W    50_A      8   10   25      6    7    8    9    9   10   10   12   18   23   25   30   35   41   45   46   50   51   52   54 
LCS_GDT     V    51_A     V    51_A      8   10   25      6    7    8    9    9   10   14   19   22   26   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     I    52_A     I    52_A      8   10   25      6    7    8    9    9   12   15   19   22   26   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     V    53_A     V    53_A      8   10   25      6    7    8    9    9   10   12   15   19   23   28   33   35   41   45   46   50   51   52   54 
LCS_GDT     Q    54_A     Q    54_A      8   10   25      6    7    8    9    9   10   11   15   18   23   26   29   35   41   45   46   50   51   52   54 
LCS_GDT     L    55_A     L    55_A      8   10   22      3    7    8    9    9   10   11   15   19   22   26   30   35   41   45   46   50   51   52   54 
LCS_GDT     K    56_A     K    56_A      4   10   22      3    3    4    8    9   10   12   17   22   25   30   33   35   41   45   46   50   51   52   54 
LCS_GDT     E    57_A     E    57_A      3    4   22      3    3    3    5    5    7    9   11   18   23   26   31   35   41   45   46   50   51   52   54 
LCS_GDT     E    58_A     E    58_A      3    4   22      3    3    3    5    5    7    9   11   14   18   20   26   31   35   43   46   49   51   52   54 
LCS_GDT     L    59_A     L    59_A      3    5   22      0    3    3    4    5    7    9   10   13   18   20   23   30   35   43   45   48   50   52   54 
LCS_GDT     L    60_A     L    60_A      4    5   19      1    3    4    6    6    6    8   10   11   14   17   18   20   22   24   29   41   46   51   54 
LCS_GDT     K    61_A     K    61_A      4   14   19      3    4    5    6    6    8   12   14   16   17   18   21   23   23   25   26   29   31   38   43 
LCS_GDT     R    62_A     R    62_A     13   15   19      4   12   14   14   14   15   15   16   17   19   20   21   23   23   25   26   33   41   47   52 
LCS_GDT     E    63_A     E    63_A     13   15   19      4   12   14   14   14   15   15   16   17   19   20   21   23   23   26   34   42   46   51   54 
LCS_GDT     V    64_A     V    64_A     13   15   19      6   12   14   14   14   15   15   16   17   19   20   21   23   23   25   26   29   30   33   37 
LCS_GDT     I    65_A     I    65_A     13   15   19      6   12   14   14   14   15   15   16   17   19   20   21   23   23   25   26   29   30   36   37 
LCS_GDT     L    66_A     L    66_A     13   15   19      4   12   14   14   14   15   15   16   17   19   20   21   23   23   28   36   38   43   47   52 
LCS_GDT     K    67_A     K    67_A     13   15   19      4   12   14   14   14   15   15   16   17   19   20   21   23   24   28   36   38   43   47   52 
LCS_GDT     N    68_A     N    68_A     13   15   19      3    9   14   14   14   15   15   16   17   19   20   21   23   23   25   25   27   35   36   39 
LCS_GDT     L    69_A     L    69_A     13   15   19      6   12   14   14   14   15   15   16   17   19   20   21   23   23   25   25   26   28   36   37 
LCS_GDT     L    70_A     L    70_A     13   15   19      6   12   14   14   14   15   15   16   17   19   20   21   23   23   25   27   30   34   37   39 
LCS_GDT     T    71_A     T    71_A     13   15   19      6   12   14   14   14   15   15   16   17   19   20   21   23   23   25   27   30   33   37   39 
LCS_GDT     N    72_A     N    72_A     13   15   19      6   12   14   14   14   15   15   16   17   19   20   21   23   23   25   25   26   28   30   31 
LCS_GDT     L    73_A     L    73_A     13   15   19      6   12   14   14   14   15   15   16   17   19   20   21   23   23   25   25   26   28   30   31 
LCS_GDT     S    74_A     S    74_A     13   15   19      4   12   14   14   14   15   15   16   17   19   20   21   23   23   25   25   26   28   30   31 
LCS_GDT     Q    75_A     Q    75_A      4   15   19      3    3    4    4    5    8   12   15   17   19   20   21   23   23   25   25   26   28   30   31 
LCS_GDT     A    76_A     A    76_A      4   15   19      3    3    4    6    8   14   14   15   17   19   20   21   23   23   25   25   25   28   30   31 
LCS_AVERAGE  LCS_A:  17.48  (   8.64   11.25   32.55 )

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      7     12     14     14     14     15     16     19     22     26     30     33     35     41     45     46     50     51     52     54 
GDT PERCENT_AT   9.21  15.79  18.42  18.42  18.42  19.74  21.05  25.00  28.95  34.21  39.47  43.42  46.05  53.95  59.21  60.53  65.79  67.11  68.42  71.05
GDT RMS_LOCAL    0.22   0.63   0.78   0.78   0.78   1.24   2.69   2.90   3.14   3.53   3.90   4.26   4.42   4.91   5.21   5.39   5.68   5.77   5.86   6.54
GDT RMS_ALL_AT  24.00  23.29  23.52  23.52  23.52  23.82  14.83  14.77  14.58  14.11  14.27  13.82  13.81  13.64  13.63  13.77  13.68  13.60  13.56  13.20

# Checking swapping
#   possible swapping detected:  E     5_A      E     5_A
#   possible swapping detected:  F     6_A      F     6_A
#   possible swapping detected:  F    11_A      F    11_A
#   possible swapping detected:  Y    15_A      Y    15_A
#   possible swapping detected:  D    28_A      D    28_A
#   possible swapping detected:  D    33_A      D    33_A
#   possible swapping detected:  D    46_A      D    46_A
#   possible swapping detected:  E    57_A      E    57_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    M     1_A      M     1_A    15.437     0    0.173   1.186    16.654    0.000    0.000
LGA    K     2_A      K     2_A    15.029     0    0.074   1.065    17.768    0.000    0.000
LGA    I     3_A      I     3_A    13.323     0    0.620   1.397    17.231    0.000    0.000
LGA    H     4_A      H     4_A    12.870     0    0.646   1.200    13.356    0.000    0.000
LGA    E     5_A      E     5_A     8.418     0    0.578   1.216    13.883    5.833    3.386
LGA    F     6_A      F     6_A     4.642     0    0.506   1.344     6.708   26.429   29.004
LGA    G     7_A      G     7_A     8.627     0    0.521   0.521    11.063    3.333    3.333
LGA    L     8_A      L     8_A    10.456     0    0.108   0.885    14.381    1.190    0.595
LGA    A     9_A      A     9_A     5.995     0    0.338   0.341     7.025   22.262   24.095
LGA    L    10_A      L    10_A     3.444     0    0.628   1.326     5.776   36.429   43.869
LGA    F    11_A      F    11_A     3.818     0    0.702   1.182    10.254   48.452   23.939
LGA    G    12_A      G    12_A     2.767     0    0.078   0.078     3.292   61.190   61.190
LGA    E    13_A      E    13_A     5.844     0    0.651   1.070     9.657   23.095   12.698
LGA    H    14_A      H    14_A     4.727     0    0.400   1.248    12.187   31.429   15.476
LGA    Y    15_A      Y    15_A     5.595     0    0.603   1.034    17.025   21.786    7.857
LGA    S    16_A      S    16_A     5.543     0    0.618   0.910     6.252   30.357   25.952
LGA    A    17_A      A    17_A     4.583     0    0.075   0.072     5.353   42.500   39.238
LGA    N    18_A      N    18_A     1.055     0    0.069   0.961     4.307   81.786   72.917
LGA    Q    19_A      Q    19_A     3.168     0    0.078   1.036     6.925   54.048   37.407
LGA    F    20_A      F    20_A     3.958     0    0.048   0.209     9.810   51.905   24.459
LGA    A    21_A      A    21_A     1.704     0    0.119   0.118     2.236   79.405   76.476
LGA    K    22_A      K    22_A     2.274     0    0.196   0.687     5.115   63.333   49.683
LGA    I    23_A      I    23_A     3.527     0    0.199   1.173     7.764   46.905   38.750
LGA    L    24_A      L    24_A     2.804     0    0.587   1.103     6.502   57.262   45.238
LGA    I    25_A      I    25_A     2.397     0    0.288   1.055     6.856   41.667   34.464
LGA    N    26_A      N    26_A     7.747     0    0.300   0.927    11.659   12.857    6.607
LGA    K    27_A      K    27_A    11.775     0    0.073   1.122    21.061    0.357    0.159
LGA    D    28_A      D    28_A    10.168     0    0.260   1.088    13.181    5.000    2.500
LGA    G    29_A      G    29_A     3.200     0    0.619   0.619     5.488   40.833   40.833
LGA    S    30_A      S    30_A     2.818     0    0.672   0.831     3.704   53.810   57.460
LGA    N    31_A      N    31_A     7.619     0    0.584   1.207    11.897   10.357    5.179
LGA    V    32_A      V    32_A     6.870     0    0.023   1.073     8.430   12.500   15.578
LGA    D    33_A      D    33_A     8.295     0    0.065   1.155    13.784    5.357    2.857
LGA    R    34_A      R    34_A     8.177     0    0.651   1.124    10.599    9.167    3.636
LGA    K    35_A      K    35_A     8.201     0    0.651   0.759    14.344    4.405    1.958
LGA    T    36_A      T    36_A     7.298     0    0.593   1.013    10.628   14.524    9.660
LGA    I    37_A      I    37_A     6.919     0    0.444   0.680     9.491   14.405    8.750
LGA    Q    38_A      Q    38_A     4.782     0    0.516   1.423     8.145   48.333   32.222
LGA    N    39_A      N    39_A     2.705     0    0.616   1.101     4.344   60.000   52.560
LGA    W    40_A      W    40_A     5.265     0    0.598   1.042    14.257   29.881    9.660
LGA    I    41_A      I    41_A     9.395     0    0.592   1.046    16.715    3.452    1.726
LGA    N    42_A      N    42_A     7.749     0    0.473   1.179    13.681   12.262    6.190
LGA    R    43_A      R    43_A     1.652     0    0.329   1.015    10.909   61.429   36.753
LGA    D    44_A      D    44_A     1.417     0    0.435   0.575     2.126   75.000   73.988
LGA    Q    45_A      Q    45_A     3.467     0    0.565   1.456     7.110   51.905   33.704
LGA    D    46_A      D    46_A     3.357     0    0.586   1.180     8.480   65.238   40.298
LGA    L    47_A      L    47_A     3.392     0    0.559   0.480     5.622   45.119   40.060
LGA    N    48_A      N    48_A     8.110     0    0.586   0.964    14.477    8.452    4.226
LGA    D    49_A      D    49_A     9.496     0    0.097   0.523    11.259    1.310    0.714
LGA    W    50_A      W    50_A    11.235     0    0.067   1.268    21.012    0.119    0.034
LGA    V    51_A      V    51_A     7.201     0    0.051   0.117     8.340    9.524   16.122
LGA    I    52_A      I    52_A     5.973     0    0.043   1.526     7.859   13.214   25.476
LGA    V    53_A      V    53_A    10.668     0    0.049   0.981    14.042    0.357    0.204
LGA    Q    54_A      Q    54_A    11.598     0    0.347   0.584    12.681    0.000    0.000
LGA    L    55_A      L    55_A     9.462     0    0.033   1.005     9.922    0.952    3.512
LGA    K    56_A      K    56_A     8.236     0    0.307   1.373    11.644    4.762    5.238
LGA    E    57_A      E    57_A     9.267     0    0.195   1.129    10.583    1.071    3.122
LGA    E    58_A      E    58_A    11.298     0    0.227   1.349    15.709    0.000    0.000
LGA    L    59_A      L    59_A    10.251     0    0.555   1.389    12.964    0.000    0.238
LGA    L    60_A      L    60_A    14.067     0    0.622   0.732    16.639    0.000    0.000
LGA    K    61_A      K    61_A    18.584     0    0.395   0.705    23.534    0.000    0.000
LGA    R    62_A      R    62_A    19.216     0    0.623   1.277    22.764    0.000    0.000
LGA    E    63_A      E    63_A    18.129     0    0.056   0.592    20.352    0.000    0.000
LGA    V    64_A      V    64_A    24.766     0    0.034   0.159    29.271    0.000    0.000
LGA    I    65_A      I    65_A    24.755     0    0.050   0.652    26.536    0.000    0.000
LGA    L    66_A      L    66_A    19.502     0    0.081   0.977    21.189    0.000    0.000
LGA    K    67_A      K    67_A    21.740     0    0.674   0.905    25.825    0.000    0.000
LGA    N    68_A      N    68_A    28.327     0    0.055   0.881    32.800    0.000    0.000
LGA    L    69_A      L    69_A    28.253     0    0.081   0.122    30.410    0.000    0.000
LGA    L    70_A      L    70_A    25.057     0    0.105   0.971    27.551    0.000    0.000
LGA    T    71_A      T    71_A    29.465     0    0.081   1.163    33.275    0.000    0.000
LGA    N    72_A      N    72_A    35.038     0    0.145   1.101    37.499    0.000    0.000
LGA    L    73_A      L    73_A    33.450     0    0.280   0.968    34.706    0.000    0.000
LGA    S    74_A      S    74_A    32.793     0    0.639   0.788    36.995    0.000    0.000
LGA    Q    75_A      Q    75_A    38.822     0    0.548   1.235    42.540    0.000    0.000
LGA    A    76_A      A    76_A    42.575     0    0.305   0.306    45.661    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:       76     304    304  100.00     627    627  100.00                76
SUMMARY(RMSD_GDC):    11.323         11.260                 12.297           19.823   15.938

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  153   76    4.0     19    2.90    29.934    24.593     0.633

LGA_LOCAL      RMSD:   2.903  Number of atoms:   19  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  14.771  Number of assigned atoms:   76 
Std_ASGN_ATOMS RMSD:  11.323  Standard rmsd on all 76 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.789280 * X  +  -0.606716 * Y  +   0.094514 * Z  +   2.461078
  Y_new =   0.518858 * X  +  -0.741307 * Y  +  -0.425736 * Z  +   7.619168
  Z_new =   0.328364 * X  +  -0.286986 * Y  +   0.899898 * Z  +  25.596004 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  2.560046 -0.334571 -0.308713   [DEG:  146.6798  -19.1695  -17.6880 ]
ZXZ:  0.218458  0.451261  2.289052   [DEG:   12.5167   25.8553  131.1530 ]
 
# END of job
