
#######################################################
#                                                     #
#                        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   87 (  694),  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        3.18     3.18
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    76      23_A - 98_A        1.81     3.31
  LCS_AVERAGE:     95.10

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    74      25_A - 98_A        0.96     3.51
  LCS_AVERAGE:     90.25

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      2    3    3    5    5    5    6    9   10   11   15   19   23   27   28   29   35   43   45   54 
LCS_GDT     Q    22_A     Q    22_A      4    5   78      0    3    4    5    6    8    9   11   17   20   23   33   50   75   77   77   77   77   77   77 
LCS_GDT     G    23_A     G    23_A      4   76   78      2    3    4    5    7   15   36   49   60   70   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     Q    24_A     Q    24_A      4   76   78      3    5   14   25   46   64   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     Q    25_A     Q    25_A     74   76   78      3    3    4    5    8   24   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     D    26_A     D    26_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     K    27_A     K    27_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     L    28_A     L    28_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     V    29_A     V    29_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     L    30_A     L    30_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     R    31_A     R    31_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     V    32_A     V    32_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     D    33_A     D    33_A     74   76   78     13   67   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     G    34_A     G    34_A     74   76   78     44   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     I    35_A     I    35_A     74   76   78     44   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     L    36_A     L    36_A     74   76   78     42   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     N    37_A     N    37_A     74   76   78     48   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     E    38_A     E    38_A     74   76   78     44   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     L    39_A     L    39_A     74   76   78     47   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     D    40_A     D    40_A     74   76   78     44   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     A    41_A     A    41_A     74   76   78     44   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     Q    42_A     Q    42_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     V    43_A     V    43_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     L    44_A     L    44_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     E    45_A     E    45_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     G    46_A     G    46_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     I    47_A     I    47_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     L    48_A     L    48_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     T    49_A     T    49_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     R    50_A     R    50_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     L    51_A     L    51_A     74   76   78     31   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     N    52_A     N    52_A     74   76   78     22   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     G    53_A     G    53_A     74   76   78     22   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     V    54_A     V    54_A     74   76   78     47   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     R    55_A     R    55_A     74   76   78     47   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     Q    56_A     Q    56_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     F    57_A     F    57_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     R    58_A     R    58_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     L    59_A     L    59_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     D    60_A     D    60_A     74   76   78      9   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     R    61_A     R    61_A     74   76   78      9   29   53   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     I    62_A     I    62_A     74   76   78      8   18   27   71   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     S    63_A     S    63_A     74   76   78      9   31   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     G    64_A     G    64_A     74   76   78     12   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     E    65_A     E    65_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     L    66_A     L    66_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     E    67_A     E    67_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     V    68_A     V    68_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     V    69_A     V    69_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     F    70_A     F    70_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     D    71_A     D    71_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     P    72_A     P    72_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     E    73_A     E    73_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     V    74_A     V    74_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     V    75_A     V    75_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     S    76_A     S    76_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     S    77_A     S    77_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     R    78_A     R    78_A     74   76   78     31   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     S    79_A     S    79_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     L    80_A     L    80_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     V    81_A     V    81_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     D    82_A     D    82_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     G    83_A     G    83_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     I    84_A     I    84_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     E    85_A     E    85_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     E    86_A     E    86_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     D    87_A     D    87_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     G    88_A     G    88_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     F    89_A     F    89_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     G    90_A     G    90_A     74   76   78     42   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     K    91_A     K    91_A     74   76   78     22   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     F    92_A     F    92_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     K    93_A     K    93_A     74   76   78     24   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     L    94_A     L    94_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     R    95_A     R    95_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     V    96_A     V    96_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     M    97_A     M    97_A     74   76   78     49   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_GDT     S    98_A     S    98_A     74   76   78     31   69   71   72   73   73   73   75   75   75   76   76   76   76   77   77   77   77   77   77 
LCS_AVERAGE  LCS_A:  95.12  (  90.25   95.10  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     49     69     71     72     73     73     73     75     75     75     76     76     76     76     77     77     77     77     77     77 
GDT PERCENT_AT  62.82  88.46  91.03  92.31  93.59  93.59  93.59  96.15  96.15  96.15  97.44  97.44  97.44  97.44  98.72  98.72  98.72  98.72  98.72  98.72
GDT RMS_LOCAL    0.33   0.50   0.55   0.59   0.67   0.67   0.67   1.25   1.25   1.25   1.81   1.81   1.81   1.81   2.41   2.41   2.41   2.41   2.41   2.41
GDT RMS_ALL_AT   3.57   3.56   3.57   3.57   3.58   3.58   3.58   3.43   3.43   3.43   3.31   3.31   3.31   3.31   3.22   3.22   3.22   3.22   3.22   3.22

# Checking swapping
#   possible swapping detected:  F    21_A      F    21_A
#   possible swapping detected:  D    26_A      D    26_A
#   possible swapping detected:  E    45_A      E    45_A
#   possible swapping detected:  F    57_A      F    57_A
#   possible swapping detected:  E    65_A      E    65_A
#   possible swapping detected:  E    67_A      E    67_A
#   possible swapping detected:  E    73_A      E    73_A
#   possible swapping detected:  E    85_A      E    85_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    F    21_A      F    21_A    20.622     0    0.525   0.764    22.660    0.000    0.000
LGA    Q    22_A      Q    22_A    15.330     4    0.095   0.129    16.999    0.000    0.000
LGA    G    23_A      G    23_A    11.815     0    0.667   0.667    12.587    1.548    1.548
LGA    Q    24_A      Q    24_A     6.855     0    0.220   0.821     9.073    7.738   12.593
LGA    Q    25_A      Q    25_A     5.477     0    0.502   1.314    13.546   36.190   17.249
LGA    D    26_A      D    26_A     1.015     0    0.668   1.030     6.607   83.810   53.810
LGA    K    27_A      K    27_A     0.701     0    0.097   0.645     2.603   90.476   83.069
LGA    L    28_A      L    28_A     0.501     0    0.055   0.136     0.676   90.476   95.238
LGA    V    29_A      V    29_A     0.773     0    0.027   0.047     1.298   90.476   86.599
LGA    L    30_A      L    30_A     0.514     0    0.047   0.085     0.816   90.476   92.857
LGA    R    31_A      R    31_A     0.369     0    0.044   0.752     2.804  100.000   89.394
LGA    V    32_A      V    32_A     0.236     0    0.132   0.151     0.844   97.619   97.279
LGA    D    33_A      D    33_A     1.151     0    0.159   0.323     2.222   85.952   78.452
LGA    G    34_A      G    34_A     0.708     0    0.030   0.030     0.792   90.476   90.476
LGA    I    35_A      I    35_A     0.629     0    0.051   0.044     0.777   90.476   91.667
LGA    L    36_A      L    36_A     0.815     0    0.052   0.136     1.317   90.476   87.083
LGA    N    37_A      N    37_A     0.317     0    0.040   1.186     3.916  100.000   84.940
LGA    E    38_A      E    38_A     0.390     0    0.042   0.956     3.599  100.000   81.958
LGA    L    39_A      L    39_A     0.290     0    0.034   0.848     2.055  100.000   92.202
LGA    D    40_A      D    40_A     0.392     0    0.020   0.149     1.077  100.000   95.298
LGA    A    41_A      A    41_A     0.392     0    0.019   0.019     0.425  100.000  100.000
LGA    Q    42_A      Q    42_A     0.286     0    0.034   0.117     0.592  100.000   98.942
LGA    V    43_A      V    43_A     0.304     0    0.024   0.060     0.414  100.000  100.000
LGA    L    44_A      L    44_A     0.315     0    0.021   0.111     0.325  100.000  100.000
LGA    E    45_A      E    45_A     0.381     0    0.069   0.466     1.816   97.619   93.810
LGA    G    46_A      G    46_A     0.442     0    0.064   0.064     0.931   95.238   95.238
LGA    I    47_A      I    47_A     0.468     0    0.026   0.030     0.661   95.238   96.429
LGA    L    48_A      L    48_A     0.581     0    0.016   0.105     0.627   90.476   90.476
LGA    T    49_A      T    49_A     0.905     0    0.040   0.073     1.175   88.214   89.184
LGA    R    50_A      R    50_A     0.847     0    0.024   0.716     5.032   90.476   71.991
LGA    L    51_A      L    51_A     0.567     0    0.083   1.302     2.696   92.857   84.286
LGA    N    52_A      N    52_A     0.972     0    0.024   0.787     3.071   85.952   73.750
LGA    G    53_A      G    53_A     0.999     0    0.012   0.012     1.013   88.214   88.214
LGA    V    54_A      V    54_A     0.650     0    0.027   0.034     0.699   90.476   91.837
LGA    R    55_A      R    55_A     0.543     0    0.034   1.398     7.124   95.238   69.177
LGA    Q    56_A      Q    56_A     0.547     0    0.041   0.525     2.546   90.476   79.259
LGA    F    57_A      F    57_A     0.937     0    0.014   0.189     1.366   90.476   86.364
LGA    R    58_A      R    58_A     0.762     0    0.030   1.169     6.516   92.857   67.749
LGA    L    59_A      L    59_A     0.324     0    0.049   0.077     1.167  100.000   95.298
LGA    D    60_A      D    60_A     0.940     0    0.028   0.593     2.440   88.214   80.595
LGA    R    61_A      R    61_A     1.850     0    0.057   0.104     2.635   69.048   72.338
LGA    I    62_A      I    62_A     2.762     0    0.054   0.070     3.754   59.048   52.857
LGA    S    63_A      S    63_A     1.697     0    0.019   0.032     1.905   77.143   77.143
LGA    G    64_A      G    64_A     0.870     0    0.036   0.036     1.119   92.976   92.976
LGA    E    65_A      E    65_A     0.290     0    0.041   0.248     2.322  100.000   86.931
LGA    L    66_A      L    66_A     0.585     0    0.056   0.080     0.843   90.476   90.476
LGA    E    67_A      E    67_A     0.705     0    0.023   0.398     1.440   90.476   87.460
LGA    V    68_A      V    68_A     0.618     0    0.031   0.078     0.746   90.476   91.837
LGA    V    69_A      V    69_A     0.623     0    0.009   0.078     0.724   90.476   91.837
LGA    F    70_A      F    70_A     0.574     0    0.044   0.111     0.781   90.476   90.476
LGA    D    71_A      D    71_A     0.511     0    0.023   0.264     1.142   97.619   92.917
LGA    P    72_A      P    72_A     0.311     0    0.016   0.035     0.500  100.000  100.000
LGA    E    73_A      E    73_A     0.207     0    0.078   0.417     1.276   97.619   95.820
LGA    V    74_A      V    74_A     0.270     0    0.027   0.047     0.453  100.000  100.000
LGA    V    75_A      V    75_A     0.524     0    0.049   0.781     2.425   92.857   85.646
LGA    S    76_A      S    76_A     0.651     0    0.027   0.136     0.696   90.476   90.476
LGA    S    77_A      S    77_A     0.379     0    0.023   0.050     0.555   95.238   95.238
LGA    R    78_A      R    78_A     0.794     0    0.049   1.010     4.236   90.476   74.242
LGA    S    79_A      S    79_A     0.515     0    0.015   0.040     0.627   90.476   93.651
LGA    L    80_A      L    80_A     0.586     0    0.024   0.410     1.191   90.476   89.345
LGA    V    81_A      V    81_A     0.584     0    0.050   0.087     0.729   90.476   90.476
LGA    D    82_A      D    82_A     0.550     0    0.072   0.160     0.692   90.476   94.048
LGA    G    83_A      G    83_A     0.660     0    0.041   0.041     0.696   90.476   90.476
LGA    I    84_A      I    84_A     0.593     0    0.020   0.049     0.671   90.476   90.476
LGA    E    85_A      E    85_A     0.565     0    0.018   0.196     1.430   90.476   88.519
LGA    E    86_A      E    86_A     0.564     0    0.046   0.940     3.163   90.476   78.307
LGA    D    87_A      D    87_A     0.682     0    0.036   0.334     1.807   90.476   84.940
LGA    G    88_A      G    88_A     0.348     0    0.044   0.044     0.556   97.619   97.619
LGA    F    89_A      F    89_A     0.435     0    0.046   0.046     1.016   92.976   92.251
LGA    G    90_A      G    90_A     0.823     0    0.016   0.016     1.098   88.214   88.214
LGA    K    91_A      K    91_A     0.923     0    0.035   0.569     1.247   90.476   87.460
LGA    F    92_A      F    92_A     0.317     0    0.033   0.049     0.534  100.000   98.268
LGA    K    93_A      K    93_A     0.803     0    0.041   1.295     8.334   90.476   60.899
LGA    L    94_A      L    94_A     0.257     0    0.048   0.135     0.491  100.000  100.000
LGA    R    95_A      R    95_A     0.424     0    0.027   1.443     5.407  100.000   74.026
LGA    V    96_A      V    96_A     0.455     0    0.031   0.136     0.795   95.238   93.197
LGA    M    97_A      M    97_A     0.794     0    0.077   0.727     3.495   90.476   80.357
LGA    S    98_A      S    98_A     0.675     1    0.634   0.607     2.761   82.143   69.841

# 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):     3.183          3.109                  3.606           86.859   81.992

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)   87   78    4.0     75    1.25    93.910    94.496     5.544

LGA_LOCAL      RMSD:   1.253  Number of atoms:   75  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   3.430  Number of assigned atoms:   78 
Std_ASGN_ATOMS RMSD:   3.183  Standard rmsd on all 78 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.838878 * X  +  -0.535531 * Y  +   0.097420 * Z  +  -3.984811
  Y_new =   0.391793 * X  +   0.718307 * Y  +   0.574921 * Z  + -43.284130
  Z_new =  -0.377865 * X  +  -0.444119 * Y  +   0.812389 * Z  +  -6.439003 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  0.436937  0.387490 -0.500293   [DEG:   25.0347   22.2015  -28.6647 ]
ZXZ:  2.973737  0.622559 -2.436623   [DEG:  170.3826   35.6700 -139.6082 ]
 
# END of job
