
#######################################################
#                                                     #
#                        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   76 (  612),  selected   76 , name one
# Molecule2: number of CA atoms   83 (  673),  selected   76 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:B  -ch2:A  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    63      26_A - 88_A        4.57    15.99
  LCS_AVERAGE:     67.45

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    58      31_A - 88_A        1.99    16.76
  LCS_AVERAGE:     59.35

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    49      34_A - 82_A        0.99    16.88
  LCS_AVERAGE:     45.58

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     T    13_B     T    13_A     17   19   22     10   17   17   17   18   19   19   21   21   21   22   22   23   23   24   25   26   27   28   28 
LCS_GDT     W    14_B     W    14_A     17   19   22     15   17   17   17   18   19   19   21   21   21   22   22   23   23   24   25   26   27   28   31 
LCS_GDT     S    15_B     S    15_A     17   19   22     15   17   17   17   18   19   19   21   21   21   22   22   23   23   24   25   26   27   28   31 
LCS_GDT     K    16_B     K    16_A     17   19   22     15   17   17   17   18   19   19   21   21   21   22   22   23   23   24   25   26   27   28   31 
LCS_GDT     E    17_B     E    17_A     17   19   22     15   17   17   17   18   19   19   21   21   21   22   22   23   23   24   25   26   27   28   31 
LCS_GDT     E    18_B     E    18_A     17   19   22     15   17   17   17   18   19   19   21   21   21   22   22   23   23   24   25   26   27   28   31 
LCS_GDT     E    19_B     E    19_A     17   19   22     15   17   17   17   18   19   19   21   21   21   22   22   23   23   24   25   26   27   28   31 
LCS_GDT     E    20_B     E    20_A     17   19   22     15   17   17   17   18   19   19   21   21   21   22   22   23   23   24   25   26   27   28   31 
LCS_GDT     A    21_B     A    21_A     17   19   22     15   17   17   17   18   19   19   21   21   21   22   22   23   23   24   25   26   27   28   31 
LCS_GDT     L    22_B     L    22_A     17   19   22     15   17   17   17   18   19   19   21   21   21   22   22   23   23   24   25   26   27   28   33 
LCS_GDT     V    23_B     V    23_A     17   19   22     15   17   17   17   18   19   19   21   21   21   22   22   23   23   24   25   26   31   33   37 
LCS_GDT     E    24_B     E    24_A     17   19   22     15   17   17   17   18   19   19   21   21   21   22   22   23   23   24   25   33   33   34   37 
LCS_GDT     G    25_B     G    25_A     17   19   22     15   17   17   17   18   19   19   21   21   21   22   22   23   23   26   30   38   40   42   42 
LCS_GDT     L    26_B     L    26_A     17   19   63     15   17   17   17   18   19   19   21   21   21   22   22   23   25   29   38   40   41   50   53 
LCS_GDT     K    27_B     K    27_A     17   19   63     15   17   17   17   18   19   19   21   21   21   22   25   30   35   41   46   51   55   59   61 
LCS_GDT     E    28_B     E    28_A     17   19   63     15   17   17   17   18   19   19   21   21   21   22   26   30   35   43   48   52   56   59   61 
LCS_GDT     V    29_B     V    29_A     17   19   63      9   17   17   17   18   19   19   21   27   34   39   50   55   59   60   60   60   60   60   61 
LCS_GDT     G    30_B     G    30_A      4   57   63      3    4    6   10   18   23   29   35   43   51   56   57   58   59   60   60   60   60   60   61 
LCS_GDT     P    31_B     P    31_A      5   58   63      3    4   13   20   28   35   45   53   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     S    32_B     S    32_A     40   58   63      3   11   25   35   48   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     W    33_B     W    33_A     45   58   63      3   28   38   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     S    34_B     S    34_A     49   58   63     27   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     K    35_B     K    35_A     49   58   63     27   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     I    36_B     I    36_A     49   58   63     27   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     L    37_B     L    37_A     49   58   63     27   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     D    38_B     D    38_A     49   58   63     27   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     L    39_B     L    39_A     49   58   63     27   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     Y    40_B     Y    40_A     49   58   63     27   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     G    41_B     G    41_A     49   58   63     27   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     P    42_B     P    42_A     49   58   63     27   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     G    43_B     G    43_A     49   58   63     27   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     G    44_B     G    44_A     49   58   63     27   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     K    45_B     K    45_A     49   58   63     21   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     I    46_B     I    46_A     49   58   63     21   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   60 
LCS_GDT     T    47_B     T    47_A     49   58   63     27   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     E    48_B     E    48_A     49   58   63     27   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     N    49_B     N    49_A     49   58   63     27   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     L    50_B     L    50_A     49   58   63     27   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     K    51_B     K    51_A     49   58   63     27   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     N    52_B     N    52_A     49   58   63     27   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     R    53_B     R    53_A     49   58   63     27   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     T    54_B     T    54_A     49   58   63     27   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     Q    55_B     Q    55_A     49   58   63     26   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     V    56_B     V    56_A     49   58   63     23   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     Q    57_B     Q    57_A     49   58   63     27   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     L    58_B     L    58_A     49   58   63     27   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     K    59_B     K    59_A     49   58   63     27   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     D    60_B     D    60_A     49   58   63     27   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     K    61_B     K    61_A     49   58   63     27   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     A    62_B     A    62_A     49   58   63     27   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     R    63_B     R    63_A     49   58   63     27   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     N    64_B     N    64_A     49   58   63     27   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     W    65_B     W    65_A     49   58   63     25   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     K    66_B     K    66_A     49   58   63     25   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     L    67_B     L    67_A     49   58   63     21   37   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     Q    68_B     Q    68_A     49   58   63     17   37   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     Y    69_B     Y    69_A     49   58   63     17   34   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     L    70_B     L    70_A     49   58   63     17   34   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     K    71_B     K    71_A     49   58   63     17   32   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     S    72_B     S    72_A     49   58   63     17   28   39   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     G    73_B     G    73_A     49   58   63     17   27   35   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     K    74_B     K    74_A     49   58   63     17   28   39   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     P    75_B     P    75_A     49   58   63     17   28   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     L    76_B     L    76_A     49   58   63     17   37   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     P    77_B     P    77_A     49   58   63     17   34   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     D    78_B     D    78_A     49   58   63     17   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     Y    79_B     Y    79_A     49   58   63     15   36   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     L    80_B     L    80_A     49   58   63     22   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     I    81_B     I    81_A     49   58   63     27   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     K    82_B     K    82_A     49   58   63     27   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     V    83_B     V    83_A     38   58   63     17   38   44   49   51   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     T    84_B     T    84_A     37   58   63      3    7   23   28   47   53   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     G    85_B     G    85_A      4   58   63      3    4    4    7   40   46   51   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     N    86_B     N    86_A      4   58   63      3    4    4   39   42   49   54   55   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     L    87_B     L    87_A      4   58   63      3    4    4    4    9   12   16   35   56   57   58   58   58   59   60   60   60   60   60   61 
LCS_GDT     E    88_B     E    88_A      4   58   63      3    4    4    4    4    9   15   22   34   44   58   58   58   59   60   60   60   60   60   61 
LCS_AVERAGE  LCS_A:  57.46  (  45.58   59.35   67.45 )

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     27     38     44     49     51     53     54     55     56     57     58     58     58     59     60     60     60     60     60     61 
GDT PERCENT_AT  32.53  45.78  53.01  59.04  61.45  63.86  65.06  66.27  67.47  68.67  69.88  69.88  69.88  71.08  72.29  72.29  72.29  72.29  72.29  73.49
GDT RMS_LOCAL    0.28   0.48   0.74   0.96   1.05   1.21   1.33   1.45   1.58   1.76   1.99   1.99   1.99   2.29   2.74   2.74   2.74   2.74   2.74   4.14
GDT RMS_ALL_AT  16.79  16.76  16.82  16.85  16.85  16.81  16.80  16.78  16.74  16.75  16.76  16.76  16.76  16.66  16.51  16.51  16.51  16.51  16.51  16.08

# Checking swapping
#   possible swapping detected:  E    17_B      E    17_A
#   possible swapping detected:  E    19_B      E    19_A
#   possible swapping detected:  E    28_B      E    28_A
#   possible swapping detected:  Y    40_B      Y    40_A
#   possible swapping detected:  Y    79_B      Y    79_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    T    13_B      T    13_A    50.974     0    0.173   1.073    53.721    0.000    0.000
LGA    W    14_B      W    14_A    45.585     0    0.033   0.383    47.953    0.000    0.000
LGA    S    15_B      S    15_A    48.773     0    0.000   0.031    50.224    0.000    0.000
LGA    K    16_B      K    16_A    46.943     0    0.000   0.906    54.022    0.000    0.000
LGA    E    17_B      E    17_A    45.773     0    0.020   1.259    53.294    0.000    0.000
LGA    E    18_B      E    18_A    40.638     0    0.029   0.132    45.698    0.000    0.000
LGA    E    19_B      E    19_A    37.079     0    0.006   0.961    41.594    0.000    0.000
LGA    E    20_B      E    20_A    37.255     0    0.020   0.107    45.652    0.000    0.000
LGA    A    21_B      A    21_A    34.391     0    0.022   0.025    35.945    0.000    0.000
LGA    L    22_B      L    22_A    28.695     0    0.049   0.083    31.257    0.000    0.000
LGA    V    23_B      V    23_A    26.895     0    0.027   0.051    29.197    0.000    0.000
LGA    E    24_B      E    24_A    27.915     0    0.020   0.935    35.587    0.000    0.000
LGA    G    25_B      G    25_A    23.015     0    0.032   0.032    25.224    0.000    0.000
LGA    L    26_B      L    26_A    18.005     0    0.024   1.349    20.388    0.000    0.000
LGA    K    27_B      K    27_A    19.490     0    0.067   0.916    28.170    0.000    0.000
LGA    E    28_B      E    28_A    19.751     0    0.085   0.790    27.568    0.000    0.000
LGA    V    29_B      V    29_A    12.781     0    0.202   1.122    15.396    1.190    0.680
LGA    G    30_B      G    30_A     9.385     0    0.269   0.269    11.252    2.857    2.857
LGA    P    31_B      P    31_A     4.865     0    0.410   0.499     5.606   40.238   40.748
LGA    S    32_B      S    32_A     3.527     0    0.226   0.711     6.186   50.595   42.778
LGA    W    33_B      W    33_A     2.096     0    0.474   0.312     2.958   62.976   68.878
LGA    S    34_B      S    34_A     0.527     0    0.062   0.614     1.761   95.238   90.714
LGA    K    35_B      K    35_A     0.402     0    0.021   0.650     2.024   95.238   91.905
LGA    I    36_B      I    36_A     0.494     0    0.000   0.082     0.614   95.238   97.619
LGA    L    37_B      L    37_A     0.545     0    0.020   0.074     0.708   92.857   96.429
LGA    D    38_B      D    38_A     0.910     0    0.024   0.058     1.050   88.214   88.214
LGA    L    39_B      L    39_A     0.977     0    0.014   0.167     1.774   90.476   84.881
LGA    Y    40_B      Y    40_A     0.808     0    0.000   0.053     1.448   90.476   86.706
LGA    G    41_B      G    41_A     0.508     0    0.014   0.014     0.651   90.476   90.476
LGA    P    42_B      P    42_A     0.701     0    0.010   0.105     0.788   90.476   90.476
LGA    G    43_B      G    43_A     1.126     0    0.060   0.060     1.455   83.690   83.690
LGA    G    44_B      G    44_A     1.137     0    0.013   0.013     1.350   81.429   81.429
LGA    K    45_B      K    45_A     1.748     0    0.032   0.592     3.034   72.857   66.825
LGA    I    46_B      I    46_A     1.747     0    0.120   0.190     2.161   70.833   68.810
LGA    T    47_B      T    47_A     0.949     0    0.014   0.936     2.566   88.214   80.748
LGA    E    48_B      E    48_A     0.663     0    0.017   0.178     1.115   90.476   87.460
LGA    N    49_B      N    49_A     0.667     0    0.057   0.230     1.294   90.476   89.345
LGA    L    50_B      L    50_A     0.604     0    0.039   0.067     0.694   90.476   90.476
LGA    K    51_B      K    51_A     0.633     0    0.049   0.599     1.600   90.476   88.519
LGA    N    52_B      N    52_A     0.462     0    0.097   0.939     4.277   95.238   75.357
LGA    R    53_B      R    53_A     0.418     0    0.066   1.118     4.104   97.619   75.065
LGA    T    54_B      T    54_A     0.099     0    0.023   0.055     0.670  100.000   97.279
LGA    Q    55_B      Q    55_A     0.434     0    0.055   0.995     4.288   95.238   81.164
LGA    V    56_B      V    56_A     0.534     0    0.032   0.039     0.835   97.619   94.558
LGA    Q    57_B      Q    57_A     0.322     0    0.021   1.039     2.234  100.000   92.169
LGA    L    58_B      L    58_A     0.444     0    0.018   1.359     3.901   97.619   81.071
LGA    K    59_B      K    59_A     0.568     0    0.019   0.747     4.590   97.619   80.529
LGA    D    60_B      D    60_A     0.421     0    0.035   0.165     0.528  100.000   98.810
LGA    K    61_B      K    61_A     0.397     0    0.014   1.053     5.017  100.000   83.228
LGA    A    62_B      A    62_A     0.598     0    0.017   0.017     0.763   92.857   92.381
LGA    R    63_B      R    63_A     0.483     0    0.041   1.231     3.108  100.000   82.294
LGA    N    64_B      N    64_A     0.278     0    0.026   0.210     0.762  100.000   98.810
LGA    W    65_B      W    65_A     0.308     0    0.030   1.306     5.636  100.000   72.959
LGA    K    66_B      K    66_A     0.152     0    0.051   0.591     2.584  100.000   93.122
LGA    L    67_B      L    67_A     0.492     0    0.053   1.405     4.104   95.238   76.964
LGA    Q    68_B      Q    68_A     0.680     0    0.015   0.119     1.454   90.595   87.513
LGA    Y    69_B      Y    69_A     1.317     0    0.019   0.259     2.337   81.548   76.548
LGA    L    70_B      L    70_A     1.526     0    0.032   1.408     4.365   72.976   65.595
LGA    K    71_B      K    71_A     1.657     0    0.016   1.002     3.078   70.833   73.280
LGA    S    72_B      S    72_A     2.243     0    0.050   0.642     2.988   62.976   62.302
LGA    G    73_B      G    73_A     2.690     0    0.071   0.071     3.159   57.262   57.262
LGA    K    74_B      K    74_A     2.261     0    0.013   0.975     7.154   68.810   52.222
LGA    P    75_B      P    75_A     1.858     0    0.022   0.027     2.301   70.833   68.231
LGA    L    76_B      L    76_A     1.083     0    0.032   1.318     3.251   81.429   75.476
LGA    P    77_B      P    77_A     1.158     0    0.039   0.065     1.434   85.952   84.014
LGA    D    78_B      D    78_A     0.934     0    0.037   0.277     1.149   85.952   87.083
LGA    Y    79_B      Y    79_A     1.680     0    0.174   1.188    10.987   72.976   39.246
LGA    L    80_B      L    80_A     0.629     0    0.093   0.117     0.860   90.476   90.476
LGA    I    81_B      I    81_A     0.573     0    0.115   0.667     1.263   95.238   91.726
LGA    K    82_B      K    82_A     0.271     0    0.156   0.723     2.355   92.976   85.767
LGA    V    83_B      V    83_A     1.214     0    0.107   0.155     1.916   85.952   81.565
LGA    T    84_B      T    84_A     2.927     0    0.103   1.072     7.262   52.262   40.272
LGA    G    85_B      G    85_A     4.434     0    0.251   0.251     4.434   48.571   48.571
LGA    N    86_B      N    86_A     4.057     0    0.104   1.111     7.422   34.524   26.250
LGA    L    87_B      L    87_A     6.269     0    0.163   0.427     8.729   15.952   13.333
LGA    E    88_B      E    88_A     7.495     0    0.565   1.473     8.833    7.262   12.646

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:       76     304    304  100.00     612    612  100.00                83
SUMMARY(RMSD_GDC):    13.549         13.328                 14.388           57.107   53.082

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)   76   83    4.0     55    1.45    60.843    61.958     3.538

LGA_LOCAL      RMSD:   1.454  Number of atoms:   55  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  16.775  Number of assigned atoms:   76 
Std_ASGN_ATOMS RMSD:  13.549  Standard rmsd on all 76 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.531720 * X  +  -0.568518 * Y  +   0.627743 * Z  +  71.149483
  Y_new =   0.733027 * X  +   0.062319 * Y  +   0.677338 * Z  + -25.415668
  Z_new =  -0.424199 * X  +   0.820307 * Y  +   0.383603 * Z  + -50.355503 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  2.198350  0.438077  1.133375   [DEG:  125.9562   25.1000   64.9376 ]
ZXZ:  2.394178  1.177101 -0.477252   [DEG:  137.1763   67.4429  -27.3445 ]
 
# END of job
