
#######################################################
#                                                     #
#                        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        2.78     2.78
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    75      24_A - 98_A        1.81     2.93
  LCS_AVERAGE:     92.64

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    49      26_A - 74_A        1.00     3.08
  LCS_AVERAGE:     52.93

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    3   78      3    3    3    3    3    4    5    5   17   18   23   27   28   29   31   78   78   78   78   78 
LCS_GDT     Q    22_A     Q    22_A      3    4   78      3    3    3    6    7   20   27   43   71   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     G    23_A     G    23_A      3    4   78      3    3    3    4    4    4   13   41   60   73   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     Q    24_A     Q    24_A      3   75   78      1    3    3    4    4    5    7    8   12   70   73   77   77   77   77   78   78   78   78   78 
LCS_GDT     Q    25_A     Q    25_A      3   75   78      0    3    4   25   37   64   72   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     D    26_A     D    26_A     49   75   78     18   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     K    27_A     K    27_A     49   75   78     18   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     L    28_A     L    28_A     49   75   78     10   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     V    29_A     V    29_A     49   75   78     12   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     L    30_A     L    30_A     49   75   78     18   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     R    31_A     R    31_A     49   75   78     18   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     V    32_A     V    32_A     49   75   78     18   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     D    33_A     D    33_A     49   75   78     15   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     G    34_A     G    34_A     49   75   78      9   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     I    35_A     I    35_A     49   75   78      9   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     L    36_A     L    36_A     49   75   78     14   39   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     N    37_A     N    37_A     49   75   78     14   27   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     E    38_A     E    38_A     49   75   78     14   27   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     L    39_A     L    39_A     49   75   78     14   35   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     D    40_A     D    40_A     49   75   78     14   39   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     A    41_A     A    41_A     49   75   78     14   39   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     Q    42_A     Q    42_A     49   75   78     14   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     V    43_A     V    43_A     49   75   78     14   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     L    44_A     L    44_A     49   75   78     14   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     E    45_A     E    45_A     49   75   78     14   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     G    46_A     G    46_A     49   75   78     14   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     I    47_A     I    47_A     49   75   78     14   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     L    48_A     L    48_A     49   75   78     14   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     T    49_A     T    49_A     49   75   78     18   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     R    50_A     R    50_A     49   75   78     18   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     L    51_A     L    51_A     49   75   78     10   40   61   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     N    52_A     N    52_A     49   75   78      3   28   55   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     G    53_A     G    53_A     49   75   78     18   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     V    54_A     V    54_A     49   75   78     18   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     R    55_A     R    55_A     49   75   78     18   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     Q    56_A     Q    56_A     49   75   78     18   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     F    57_A     F    57_A     49   75   78     18   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     R    58_A     R    58_A     49   75   78     18   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     L    59_A     L    59_A     49   75   78     18   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     D    60_A     D    60_A     49   75   78      9   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     R    61_A     R    61_A     49   75   78      6   36   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     I    62_A     I    62_A     49   75   78      6    8   56   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     S    63_A     S    63_A     49   75   78     10   38   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     G    64_A     G    64_A     49   75   78      7   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     E    65_A     E    65_A     49   75   78     18   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     L    66_A     L    66_A     49   75   78     18   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     E    67_A     E    67_A     49   75   78     17   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     V    68_A     V    68_A     49   75   78     18   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     V    69_A     V    69_A     49   75   78     18   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     F    70_A     F    70_A     49   75   78     18   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     D    71_A     D    71_A     49   75   78     12   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     P    72_A     P    72_A     49   75   78     12   39   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     E    73_A     E    73_A     49   75   78      8   31   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     V    74_A     V    74_A     49   75   78      8   39   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     V    75_A     V    75_A     45   75   78      7   30   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     S    76_A     S    76_A     36   75   78      8   36   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     S    77_A     S    77_A     36   75   78     12   39   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     R    78_A     R    78_A     36   75   78      6   31   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     S    79_A     S    79_A     36   75   78      9   22   58   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     L    80_A     L    80_A     36   75   78      9   20   56   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     V    81_A     V    81_A     36   75   78      9   36   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     D    82_A     D    82_A     36   75   78      9   36   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     G    83_A     G    83_A     36   75   78      9   27   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     I    84_A     I    84_A     36   75   78      9   31   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     E    85_A     E    85_A     36   75   78      9   36   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     E    86_A     E    86_A     36   75   78      9   37   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     D    87_A     D    87_A     36   75   78      7   31   62   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     G    88_A     G    88_A     36   75   78      9   29   62   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     F    89_A     F    89_A     36   75   78      4    6   41   70   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     G    90_A     G    90_A     31   75   78      4   20   53   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     K    91_A     K    91_A     31   75   78     10   31   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     F    92_A     F    92_A     31   75   78     10   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     K    93_A     K    93_A     31   75   78     10   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     L    94_A     L    94_A     31   75   78     10   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     R    95_A     R    95_A     28   75   78     18   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     V    96_A     V    96_A     24   75   78     18   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     M    97_A     M    97_A     24   75   78     10   40   63   71   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_GDT     S    98_A     S    98_A     24   75   78      0   12   43   70   73   73   73   73   74   74   75   77   77   77   77   78   78   78   78   78 
LCS_AVERAGE  LCS_A:  81.85  (  52.93   92.64  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     18     40     63     71     73     73     73     73     74     74     75     77     77     77     77     78     78     78     78     78 
GDT PERCENT_AT  23.08  51.28  80.77  91.03  93.59  93.59  93.59  93.59  94.87  94.87  96.15  98.72  98.72  98.72  98.72 100.00 100.00 100.00 100.00 100.00
GDT RMS_LOCAL    0.36   0.73   1.04   1.15   1.20   1.20   1.20   1.20   1.41   1.41   1.79   2.28   2.28   2.28   2.28   2.78   2.78   2.78   2.78   2.78
GDT RMS_ALL_AT   3.27   3.14   3.06   3.06   3.09   3.09   3.09   3.09   3.01   3.01   2.90   2.81   2.81   2.81   2.81   2.78   2.78   2.78   2.78   2.78

# Checking swapping
#   possible swapping detected:  D    26_A      D    26_A
#   possible swapping detected:  E    67_A      E    67_A
#   possible swapping detected:  F    70_A      F    70_A
#   possible swapping detected:  F    89_A      F    89_A
#   possible swapping detected:  F    92_A      F    92_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    F    21_A      F    21_A    16.726     0    0.647   0.807    19.264    0.000    0.000
LGA    Q    22_A      Q    22_A    10.486     4    0.060   0.071    12.489    0.000    0.529
LGA    G    23_A      G    23_A     9.737     0    0.434   0.434     9.737    1.310    1.310
LGA    Q    24_A      Q    24_A    10.464     0    0.588   0.888    16.545    0.357    0.159
LGA    Q    25_A      Q    25_A     6.639     0    0.610   0.859    10.798   24.405   14.180
LGA    D    26_A      D    26_A     1.086     0    0.654   1.298     5.684   80.476   57.024
LGA    K    27_A      K    27_A     1.210     0    0.079   0.573     3.432   77.262   72.593
LGA    L    28_A      L    28_A     1.328     0    0.083   1.359     4.625   83.690   73.155
LGA    V    29_A      V    29_A     1.173     0    0.016   0.057     2.252   85.952   78.027
LGA    L    30_A      L    30_A     0.941     0    0.071   0.969     2.710   83.810   80.774
LGA    R    31_A      R    31_A     0.721     0    0.049   0.548     1.819   90.476   85.628
LGA    V    32_A      V    32_A     0.997     0    0.042   0.066     1.583   85.952   81.565
LGA    D    33_A      D    33_A     0.759     0    0.049   0.741     3.236   95.238   80.417
LGA    G    34_A      G    34_A     0.410     0    0.054   0.054     0.595   97.619   97.619
LGA    I    35_A      I    35_A     0.707     0    0.017   0.064     1.369   90.476   87.083
LGA    L    36_A      L    36_A     0.841     0    0.024   0.059     1.391   85.952   88.214
LGA    N    37_A      N    37_A     1.500     0    0.054   0.084     1.564   77.143   78.214
LGA    E    38_A      E    38_A     1.551     0    0.021   0.852     2.798   77.143   72.116
LGA    L    39_A      L    39_A     1.361     0    0.034   0.904     3.746   81.429   73.512
LGA    D    40_A      D    40_A     0.985     0    0.030   0.048     1.131   83.690   85.952
LGA    A    41_A      A    41_A     1.093     0    0.025   0.031     1.131   81.429   81.429
LGA    Q    42_A      Q    42_A     1.159     0    0.014   0.219     1.553   81.429   80.476
LGA    V    43_A      V    43_A     1.282     0    0.021   0.020     1.399   81.429   81.429
LGA    L    44_A      L    44_A     1.197     0    0.033   1.372     2.786   81.429   75.357
LGA    E    45_A      E    45_A     1.135     0    0.048   0.306     1.710   81.429   81.481
LGA    G    46_A      G    46_A     1.323     0    0.015   0.015     1.402   81.429   81.429
LGA    I    47_A      I    47_A     1.215     0    0.014   0.041     1.347   81.429   82.560
LGA    L    48_A      L    48_A     1.289     0    0.009   0.074     1.856   81.429   78.214
LGA    T    49_A      T    49_A     1.178     0    0.084   0.073     1.509   81.429   80.204
LGA    R    50_A      R    50_A     1.358     0    0.017   1.140     8.225   81.429   47.403
LGA    L    51_A      L    51_A     1.729     0    0.014   1.312     2.918   77.143   73.274
LGA    N    52_A      N    52_A     1.997     0    0.657   0.746     4.827   58.571   63.690
LGA    G    53_A      G    53_A     1.046     0    0.086   0.086     1.046   88.214   88.214
LGA    V    54_A      V    54_A     0.832     0    0.024   0.053     0.994   90.476   90.476
LGA    R    55_A      R    55_A     0.667     0    0.018   1.323     7.631   90.476   64.502
LGA    Q    56_A      Q    56_A     0.379     0    0.074   1.297     5.175   97.619   78.148
LGA    F    57_A      F    57_A     0.710     0    0.079   0.218     2.158   88.214   83.333
LGA    R    58_A      R    58_A     1.301     0    0.074   1.103     7.292   81.429   54.589
LGA    L    59_A      L    59_A     0.895     0    0.067   0.893     2.517   85.952   81.845
LGA    D    60_A      D    60_A     0.583     0    0.081   0.442     2.724   90.476   84.048
LGA    R    61_A      R    61_A     1.151     0    0.122   1.354     4.511   81.548   70.303
LGA    I    62_A      I    62_A     1.635     0    0.023   0.643     2.251   77.143   74.048
LGA    S    63_A      S    63_A     1.019     0    0.034   0.648     1.886   85.952   83.016
LGA    G    64_A      G    64_A     0.678     0    0.146   0.146     1.159   88.214   88.214
LGA    E    65_A      E    65_A     1.197     0    0.037   0.134     2.728   88.214   76.243
LGA    L    66_A      L    66_A     1.004     0    0.016   0.984     3.720   85.952   75.774
LGA    E    67_A      E    67_A     1.100     0    0.050   0.767     2.186   85.952   75.979
LGA    V    68_A      V    68_A     0.757     0    0.066   1.169     2.590   90.476   82.041
LGA    V    69_A      V    69_A     0.399     0    0.019   0.068     0.483  100.000  100.000
LGA    F    70_A      F    70_A     0.557     0    0.035   0.120     1.299   97.619   89.784
LGA    D    71_A      D    71_A     0.312     0    0.033   0.093     0.693  100.000   96.429
LGA    P    72_A      P    72_A     0.745     0    0.010   0.025     1.166   90.595   93.265
LGA    E    73_A      E    73_A     1.216     0    0.036   0.378     2.080   83.690   77.725
LGA    V    74_A      V    74_A     0.652     0    0.052   0.064     0.946   90.476   93.197
LGA    V    75_A      V    75_A     1.332     0    0.100   0.945     2.941   83.690   76.803
LGA    S    76_A      S    76_A     1.050     0    0.029   0.084     1.288   81.429   81.429
LGA    S    77_A      S    77_A     0.835     0    0.030   0.080     1.177   85.952   85.952
LGA    R    78_A      R    78_A     1.328     0    0.064   1.254     7.380   81.429   56.623
LGA    S    79_A      S    79_A     1.767     0    0.040   0.069     2.538   72.857   68.889
LGA    L    80_A      L    80_A     1.815     0    0.016   0.877     2.109   72.857   72.917
LGA    V    81_A      V    81_A     1.124     0    0.017   0.032     1.406   81.429   81.429
LGA    D    82_A      D    82_A     1.074     0    0.053   0.157     2.072   81.429   77.202
LGA    G    83_A      G    83_A     1.487     0    0.052   0.052     1.487   81.429   81.429
LGA    I    84_A      I    84_A     1.480     0    0.020   0.090     2.130   81.429   74.107
LGA    E    85_A      E    85_A     1.107     0    0.056   0.138     1.869   83.690   79.577
LGA    E    86_A      E    86_A     0.781     0    0.066   0.701     3.170   90.476   77.302
LGA    D    87_A      D    87_A     1.714     0    0.041   0.341     2.659   72.976   67.917
LGA    G    88_A      G    88_A     1.695     0    0.677   0.677     2.450   70.833   70.833
LGA    F    89_A      F    89_A     2.419     0    0.138   0.157     3.562   62.857   57.359
LGA    G    90_A      G    90_A     1.916     0    0.049   0.049     2.039   70.833   70.833
LGA    K    91_A      K    91_A     1.461     0    0.068   0.487     1.904   77.143   77.619
LGA    F    92_A      F    92_A     0.946     0    0.013   0.132     1.072   85.952   88.009
LGA    K    93_A      K    93_A     0.794     0    0.064   0.768     4.499   90.476   79.630
LGA    L    94_A      L    94_A     0.806     0    0.078   0.744     2.697   90.476   84.107
LGA    R    95_A      R    95_A     0.774     0    0.043   0.958     5.410   90.476   68.658
LGA    V    96_A      V    96_A     0.964     0    0.044   0.065     1.582   83.810   81.565
LGA    M    97_A      M    97_A     0.865     0    0.290   0.733     2.428   88.214   87.321
LGA    S    98_A      S    98_A     2.342     1    0.641   0.606     3.156   66.786   52.857

# 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):     2.778          2.730                  3.426           78.718   73.289

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  100   78    4.0     73    1.20    83.974    89.961     5.597

LGA_LOCAL      RMSD:   1.204  Number of atoms:   73  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   3.088  Number of assigned atoms:   78 
Std_ASGN_ATOMS RMSD:   2.778  Standard rmsd on all 78 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.198970 * X  +   0.979996 * Y  +   0.004308 * Z  +  15.206284
  Y_new =   0.693044 * X  +   0.137599 * Y  +   0.707641 * Z  + -49.333088
  Z_new =   0.692893 * X  +   0.143785 * Y  +  -0.706559 * Z  +  -3.218432 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  1.850373 -0.765494  2.940834   [DEG:  106.0186  -43.8596  168.4974 ]
ZXZ:  3.135505  2.355420  1.366187   [DEG:  179.6512  134.9556   78.2767 ]
 
# END of job
