
#######################################################
#                                                     #
#                        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  100 (  812),  selected   78 , name one
# Molecule2: number of CA atoms   78 (  613),  selected   78 , 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:    78      21_A - 98_A        2.51     2.51
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    77      22_A - 98_A        1.94     2.55
  LCS_AVERAGE:     97.53

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    35      50_A - 84_A        0.99     2.68
  LONGEST_CONTINUOUS_SEGMENT:    35      52_A - 86_A        0.99     2.69
  LONGEST_CONTINUOUS_SEGMENT:    35      53_A - 87_A        0.98     2.71
  LCS_AVERAGE:     35.03

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:   78
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     F    21_A     F    21_A      3    5   78      3    3    3    4    4    5    5    5   16   16   17   28   30   32   35   47   58   70   78   78 
LCS_GDT     Q    22_A     Q    22_A      4   77   78      3    5    6    9   14   28   53   71   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     G    23_A     G    23_A      4   77   78      3    5   10   26   43   66   72   74   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     Q    24_A     Q    24_A      9   77   78      4   13   43   65   70   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     Q    25_A     Q    25_A     12   77   78     14   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     D    26_A     D    26_A     12   77   78     14   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     K    27_A     K    27_A     12   77   78     14   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     L    28_A     L    28_A     27   77   78     15   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     V    29_A     V    29_A     28   77   78     15   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     L    30_A     L    30_A     28   77   78     14   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     R    31_A     R    31_A     28   77   78     13   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     V    32_A     V    32_A     28   77   78     13   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     D    33_A     D    33_A     28   77   78      9   35   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     G    34_A     G    34_A     28   77   78      9   32   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     I    35_A     I    35_A     28   77   78      5   35   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     L    36_A     L    36_A     28   77   78     15   33   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     N    37_A     N    37_A     28   77   78     15   30   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     E    38_A     E    38_A     28   77   78     15   30   61   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     L    39_A     L    39_A     28   77   78     15   31   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     D    40_A     D    40_A     28   77   78     15   33   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     A    41_A     A    41_A     28   77   78     15   32   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     Q    42_A     Q    42_A     28   77   78     15   32   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     V    43_A     V    43_A     28   77   78     15   33   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     L    44_A     L    44_A     33   77   78     15   33   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     E    45_A     E    45_A     33   77   78     15   31   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     G    46_A     G    46_A     33   77   78     15   32   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     I    47_A     I    47_A     33   77   78     15   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     L    48_A     L    48_A     33   77   78     15   25   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     T    49_A     T    49_A     33   77   78     15   30   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     R    50_A     R    50_A     35   77   78     15   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     L    51_A     L    51_A     35   77   78     14   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     N    52_A     N    52_A     35   77   78     14   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     G    53_A     G    53_A     35   77   78     14   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     V    54_A     V    54_A     35   77   78     15   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     R    55_A     R    55_A     35   77   78     14   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     Q    56_A     Q    56_A     35   77   78     15   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     F    57_A     F    57_A     35   77   78     14   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     R    58_A     R    58_A     35   77   78     14   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     L    59_A     L    59_A     35   77   78     13   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     D    60_A     D    60_A     35   77   78      7   35   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     R    61_A     R    61_A     35   77   78      7   30   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     I    62_A     I    62_A     35   77   78      7   12   59   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     S    63_A     S    63_A     35   77   78      6   32   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     G    64_A     G    64_A     35   77   78      9   36   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     E    65_A     E    65_A     35   77   78      9   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     L    66_A     L    66_A     35   77   78     14   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     E    67_A     E    67_A     35   77   78     15   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     V    68_A     V    68_A     35   77   78     15   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     V    69_A     V    69_A     35   77   78     15   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     F    70_A     F    70_A     35   77   78     15   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     D    71_A     D    71_A     35   77   78     15   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     P    72_A     P    72_A     35   77   78     15   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     E    73_A     E    73_A     35   77   78     15   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     V    74_A     V    74_A     35   77   78     15   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     V    75_A     V    75_A     35   77   78     15   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     S    76_A     S    76_A     35   77   78     15   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     S    77_A     S    77_A     35   77   78     15   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     R    78_A     R    78_A     35   77   78     11   37   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     S    79_A     S    79_A     35   77   78     11   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     L    80_A     L    80_A     35   77   78     10   37   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     V    81_A     V    81_A     35   77   78     12   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     D    82_A     D    82_A     35   77   78     14   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     G    83_A     G    83_A     35   77   78     10   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     I    84_A     I    84_A     35   77   78     10   37   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     E    85_A     E    85_A     35   77   78     10   35   60   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     E    86_A     E    86_A     35   77   78     10   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     D    87_A     D    87_A     35   77   78     10   35   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     G    88_A     G    88_A     26   77   78      7   12   27   47   69   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     F    89_A     F    89_A      5   77   78      3    3    5    5    7    9   72   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     G    90_A     G    90_A      5   77   78      4    4   48   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     K    91_A     K    91_A      8   77   78      4    8   32   49   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     F    92_A     F    92_A      8   77   78      7   18   34   64   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     K    93_A     K    93_A      8   77   78      7   18   53   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     L    94_A     L    94_A      8   77   78     13   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     R    95_A     R    95_A      8   77   78     13   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     V    96_A     V    96_A      8   77   78     14   40   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     M    97_A     M    97_A      8   77   78      9   35   62   69   71   73   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_GDT     S    98_A     S    98_A      8   77   78      0    3   16   21   50   71   73   75   75   76   77   77   77   77   77   77   77   77   78   78 
LCS_AVERAGE  LCS_A:  77.52  (  35.03   97.53  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     15     40     62     69     71     73     73     75     75     76     77     77     77     77     77     77     77     77     78     78 
GDT PERCENT_AT  19.23  51.28  79.49  88.46  91.03  93.59  93.59  96.15  96.15  97.44  98.72  98.72  98.72  98.72  98.72  98.72  98.72  98.72 100.00 100.00
GDT RMS_LOCAL    0.21   0.69   1.06   1.16   1.24   1.33   1.33   1.47   1.47   1.66   1.94   1.94   1.94   1.94   1.94   1.94   1.94   1.94   2.51   2.51
GDT RMS_ALL_AT   3.34   2.77   2.66   2.68   2.69   2.66   2.66   2.68   2.68   2.61   2.55   2.55   2.55   2.55   2.55   2.55   2.55   2.55   2.51   2.51

# Checking swapping
#   possible swapping detected:  F    57_A      F    57_A
#   possible swapping detected:  F    70_A      F    70_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    F    21_A      F    21_A    15.839     0    0.323   0.984    19.134    0.000    0.000
LGA    Q    22_A      Q    22_A     9.882     4    0.688   0.638    11.593    3.810    2.222
LGA    G    23_A      G    23_A     7.022     0    0.043   0.043     8.319   13.333   13.333
LGA    Q    24_A      Q    24_A     3.471     0    0.654   1.045     5.547   42.143   44.497
LGA    Q    25_A      Q    25_A     0.943     0    0.083   0.930     2.502   81.548   81.799
LGA    D    26_A      D    26_A     1.180     0    0.205   0.390     2.779   83.690   76.369
LGA    K    27_A      K    27_A     1.414     0    0.156   0.656     3.758   75.119   68.254
LGA    L    28_A      L    28_A     1.047     0    0.040   0.164     1.248   81.429   82.560
LGA    V    29_A      V    29_A     1.311     0    0.012   0.032     1.888   83.690   79.048
LGA    L    30_A      L    30_A     1.199     0    0.093   1.406     3.669   79.286   68.631
LGA    R    31_A      R    31_A     0.840     0    0.049   0.841     3.521   90.476   74.545
LGA    V    32_A      V    32_A     0.955     0    0.116   0.154     1.512   88.214   84.082
LGA    D    33_A      D    33_A     1.107     0    0.192   0.962     2.713   79.524   73.333
LGA    G    34_A      G    34_A     1.377     0    0.011   0.011     1.396   81.429   81.429
LGA    I    35_A      I    35_A     0.722     0    0.081   0.083     0.879   90.476   90.476
LGA    L    36_A      L    36_A     1.025     0    0.047   0.063     1.813   81.548   80.417
LGA    N    37_A      N    37_A     1.650     0    0.064   0.079     1.750   75.000   75.000
LGA    E    38_A      E    38_A     1.761     0    0.030   0.242     2.088   72.857   69.259
LGA    L    39_A      L    39_A     1.608     0    0.024   1.098     5.125   77.143   65.238
LGA    D    40_A      D    40_A     1.099     0    0.027   0.107     1.352   81.429   81.429
LGA    A    41_A      A    41_A     1.170     0    0.020   0.023     1.309   81.429   81.429
LGA    Q    42_A      Q    42_A     1.383     0    0.019   0.188     1.492   81.429   81.429
LGA    V    43_A      V    43_A     1.205     0    0.017   0.044     1.380   81.429   81.429
LGA    L    44_A      L    44_A     0.937     0    0.024   1.416     3.315   83.690   75.655
LGA    E    45_A      E    45_A     1.290     0    0.062   0.821     4.345   79.286   66.720
LGA    G    46_A      G    46_A     1.206     0    0.028   0.028     1.278   81.429   81.429
LGA    I    47_A      I    47_A     0.628     0    0.016   0.672     2.846   90.476   87.500
LGA    L    48_A      L    48_A     1.412     0    0.031   0.099     2.325   79.286   74.048
LGA    T    49_A      T    49_A     1.422     0    0.076   0.073     1.637   79.286   77.755
LGA    R    50_A      R    50_A     0.822     0    0.054   1.271     5.137   90.476   74.113
LGA    L    51_A      L    51_A     1.329     0    0.056   1.319     3.627   83.690   76.726
LGA    N    52_A      N    52_A     1.256     0    0.046   0.802     1.752   81.429   80.417
LGA    G    53_A      G    53_A     1.076     0    0.011   0.011     1.106   85.952   85.952
LGA    V    54_A      V    54_A     0.858     0    0.032   0.066     0.930   90.476   90.476
LGA    R    55_A      R    55_A     0.714     0    0.007   0.829     5.093   90.476   71.385
LGA    Q    56_A      Q    56_A     0.514     0    0.066   0.995     3.939   90.476   82.381
LGA    F    57_A      F    57_A     1.512     0    0.097   1.181     4.704   79.286   67.576
LGA    R    58_A      R    58_A     1.423     0    0.091   1.025     7.035   79.286   58.398
LGA    L    59_A      L    59_A     0.709     0    0.054   0.911     2.354   88.214   82.917
LGA    D    60_A      D    60_A     0.582     0    0.101   0.456     2.747   92.857   85.238
LGA    R    61_A      R    61_A     1.317     0    0.021   1.199     9.860   81.548   47.316
LGA    I    62_A      I    62_A     1.727     0    0.028   0.666     2.115   75.000   71.905
LGA    S    63_A      S    63_A     1.202     0    0.025   0.643     2.136   85.952   81.667
LGA    G    64_A      G    64_A     0.668     0    0.123   0.123     0.983   90.476   90.476
LGA    E    65_A      E    65_A     1.010     0    0.056   0.130     3.075   90.595   75.661
LGA    L    66_A      L    66_A     1.271     0    0.036   0.995     4.113   81.429   70.774
LGA    E    67_A      E    67_A     1.374     0    0.088   0.480     3.234   81.429   74.180
LGA    V    68_A      V    68_A     1.123     0    0.026   1.095     2.767   81.429   76.735
LGA    V    69_A      V    69_A     0.738     0    0.015   0.053     0.907   90.476   91.837
LGA    F    70_A      F    70_A     0.403     0    0.052   0.136     1.500  100.000   90.693
LGA    D    71_A      D    71_A     0.249     0    0.027   0.149     0.738  100.000   98.810
LGA    P    72_A      P    72_A     0.400     0    0.028   0.066     0.598   97.619   97.279
LGA    E    73_A      E    73_A     0.618     0    0.048   0.541     2.486   92.857   87.672
LGA    V    74_A      V    74_A     0.582     0    0.084   0.106     0.900   90.476   90.476
LGA    V    75_A      V    75_A     0.318     0    0.050   1.192     2.526  100.000   88.844
LGA    S    76_A      S    76_A     0.900     0    0.019   0.049     1.110   90.476   87.460
LGA    S    77_A      S    77_A     1.141     0    0.031   0.083     1.573   81.429   80.000
LGA    R    78_A      R    78_A     1.465     0    0.069   1.271     8.166   81.429   52.121
LGA    S    79_A      S    79_A     0.965     0    0.057   0.096     1.778   88.214   84.524
LGA    L    80_A      L    80_A     1.299     0    0.028   0.866     2.735   81.429   79.583
LGA    V    81_A      V    81_A     1.226     0    0.008   0.026     1.416   81.429   81.429
LGA    D    82_A      D    82_A     0.935     0    0.040   0.163     1.310   88.214   87.083
LGA    G    83_A      G    83_A     1.002     0    0.014   0.014     1.035   83.690   83.690
LGA    I    84_A      I    84_A     1.334     0    0.024   0.056     2.041   81.429   76.131
LGA    E    85_A      E    85_A     1.694     0    0.030   0.134     2.159   75.000   71.111
LGA    E    86_A      E    86_A     1.434     0    0.070   0.736     3.257   77.143   74.127
LGA    D    87_A      D    87_A     1.575     0    0.144   0.149     1.904   75.000   73.929
LGA    G    88_A      G    88_A     3.006     0    0.095   0.095     3.006   72.024   72.024
LGA    F    89_A      F    89_A     4.008     0    0.119   1.413     7.135   43.690   26.234
LGA    G    90_A      G    90_A     2.282     0    0.062   0.062     2.898   62.857   62.857
LGA    K    91_A      K    91_A     3.006     0    0.080   0.827     3.538   55.476   54.127
LGA    F    92_A      F    92_A     2.497     0    0.080   0.331     3.676   64.762   56.710
LGA    K    93_A      K    93_A     1.749     0    0.016   0.974     7.308   75.119   54.815
LGA    L    94_A      L    94_A     0.682     0    0.059   0.178     2.650   95.238   81.131
LGA    R    95_A      R    95_A     0.330     0    0.072   1.325     8.443  100.000   63.680
LGA    V    96_A      V    96_A     0.654     0    0.060   0.089     1.050   90.476   87.891
LGA    M    97_A      M    97_A     0.947     0    0.646   0.971     2.881   85.952   81.786
LGA    S    98_A      S    98_A     4.130     1    0.640   0.612     4.840   38.929   32.143

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:       78     312    312  100.00     613    613  100.00                78
SUMMARY(RMSD_GDC):     2.514          2.475                  3.159           78.990   72.997

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  100   78    4.0     75    1.47    83.654    91.101     4.769

LGA_LOCAL      RMSD:   1.473  Number of atoms:   75  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   2.681  Number of assigned atoms:   78 
Std_ASGN_ATOMS RMSD:   2.514  Standard rmsd on all 78 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.089065 * X  +  -0.096835 * Y  +   0.991307 * Z  +  29.512676
  Y_new =  -0.398260 * X  +  -0.908777 * Y  +  -0.124555 * Z  + -23.836660
  Z_new =   0.912938 * X  +  -0.405891 * Y  +   0.042375 * Z  + -36.025528 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -1.790812 -1.150427 -1.466774   [DEG: -102.6059  -65.9146  -84.0400 ]
ZXZ:  1.445804  1.528409  1.989150   [DEG:   82.8385   87.5714  113.9699 ]
 
# END of job
