
#######################################################
#                                                     #
#                        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        2.46     2.46
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    76      22_A - 97_A        2.00     2.48
  LONGEST_CONTINUOUS_SEGMENT:    76      23_A - 98_A        1.71     2.55
  LCS_AVERAGE:     96.27

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    39      46_A - 84_A        0.99     2.62
  LCS_AVERAGE:     38.03

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   14   15   19   22   39   45   72   73   74   78   78   78   78   78 
LCS_GDT     Q    22_A     Q    22_A      4   76   78      3    4    5    6    9   13   18   28   42   70   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     G    23_A     G    23_A      4   76   78      3    4    6    9   33   54   73   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     Q    24_A     Q    24_A      9   76   78      3   11   39   66   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     Q    25_A     Q    25_A     12   76   78     15   36   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     D    26_A     D    26_A     12   76   78     20   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     K    27_A     K    27_A     12   76   78      9   34   57   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     L    28_A     L    28_A     24   76   78     12   36   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     V    29_A     V    29_A     26   76   78     20   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     L    30_A     L    30_A     26   76   78     20   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     R    31_A     R    31_A     26   76   78     20   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     V    32_A     V    32_A     26   76   78      9   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     D    33_A     D    33_A     26   76   78      9   31   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     G    34_A     G    34_A     26   76   78      5   32   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     I    35_A     I    35_A     26   76   78      6   35   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     L    36_A     L    36_A     26   76   78      5   30   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     N    37_A     N    37_A     26   76   78     14   25   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     E    38_A     E    38_A     26   76   78     14   22   58   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     L    39_A     L    39_A     26   76   78     14   25   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     D    40_A     D    40_A     36   76   78     14   33   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     A    41_A     A    41_A     36   76   78     14   25   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     Q    42_A     Q    42_A     36   76   78     14   25   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     V    43_A     V    43_A     38   76   78     14   32   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     L    44_A     L    44_A     38   76   78     14   33   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     E    45_A     E    45_A     38   76   78     14   24   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     G    46_A     G    46_A     39   76   78     14   26   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     I    47_A     I    47_A     39   76   78     14   35   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     L    48_A     L    48_A     39   76   78     14   20   58   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     T    49_A     T    49_A     39   76   78     14   23   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     R    50_A     R    50_A     39   76   78     14   35   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     L    51_A     L    51_A     39   76   78      4   34   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     N    52_A     N    52_A     39   76   78      9   34   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     G    53_A     G    53_A     39   76   78     20   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     V    54_A     V    54_A     39   76   78     20   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     R    55_A     R    55_A     39   76   78     20   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     Q    56_A     Q    56_A     39   76   78     20   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     F    57_A     F    57_A     39   76   78     16   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     R    58_A     R    58_A     39   76   78     18   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     L    59_A     L    59_A     39   76   78     20   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     D    60_A     D    60_A     39   76   78     10   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     R    61_A     R    61_A     39   76   78      5   32   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     I    62_A     I    62_A     39   76   78      4   32   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     S    63_A     S    63_A     39   76   78      6   35   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     G    64_A     G    64_A     39   76   78      9   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     E    65_A     E    65_A     39   76   78     20   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     L    66_A     L    66_A     39   76   78     20   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     E    67_A     E    67_A     39   76   78     20   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     V    68_A     V    68_A     39   76   78     20   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     V    69_A     V    69_A     39   76   78     20   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     F    70_A     F    70_A     39   76   78     20   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     D    71_A     D    71_A     39   76   78     20   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     P    72_A     P    72_A     39   76   78     20   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     E    73_A     E    73_A     39   76   78     20   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     V    74_A     V    74_A     39   76   78     20   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     V    75_A     V    75_A     39   76   78     20   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     S    76_A     S    76_A     39   76   78     15   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     S    77_A     S    77_A     39   76   78     15   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     R    78_A     R    78_A     39   76   78     15   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     S    79_A     S    79_A     39   76   78     10   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     L    80_A     L    80_A     39   76   78     10   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     V    81_A     V    81_A     39   76   78     10   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     D    82_A     D    82_A     39   76   78     10   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     G    83_A     G    83_A     39   76   78     20   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     I    84_A     I    84_A     39   76   78     10   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     E    85_A     E    85_A     38   76   78     10   29   48   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     E    86_A     E    86_A     38   76   78     10   34   52   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     D    87_A     D    87_A     38   76   78     10   36   57   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     G    88_A     G    88_A     25   76   78      6   13   27   46   67   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     F    89_A     F    89_A      5   76   78      3    3    5    5   26   72   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     G    90_A     G    90_A      5   76   78      4    4   43   67   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     K    91_A     K    91_A      7   76   78      4   17   33   55   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     F    92_A     F    92_A      7   76   78      5   16   51   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     K    93_A     K    93_A      7   76   78      9   16   58   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     L    94_A     L    94_A      7   76   78      9   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     R    95_A     R    95_A      7   76   78     20   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     V    96_A     V    96_A      7   76   78     10   37   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     M    97_A     M    97_A      7   76   78      9   35   59   69   71   73   74   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_GDT     S    98_A     S    98_A      7   76   78      3   13   24   29   58   72   73   75   75   75   76   77   77   77   77   78   78   78   78   78 
LCS_AVERAGE  LCS_A:  78.10  (  38.03   96.27  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     20     37     59     69     71     73     74     75     75     75     76     77     77     77     77     78     78     78     78     78 
GDT PERCENT_AT  25.64  47.44  75.64  88.46  91.03  93.59  94.87  96.15  96.15  96.15  97.44  98.72  98.72  98.72  98.72 100.00 100.00 100.00 100.00 100.00
GDT RMS_LOCAL    0.36   0.64   1.03   1.17   1.24   1.35   1.40   1.48   1.48   1.48   1.71   2.06   2.06   2.06   2.06   2.46   2.46   2.46   2.46   2.46
GDT RMS_ALL_AT   2.67   2.67   2.64   2.64   2.64   2.60   2.61   2.62   2.62   2.62   2.55   2.49   2.49   2.49   2.49   2.46   2.46   2.46   2.46   2.46

# Checking swapping
#   possible swapping detected:  F    57_A      F    57_A
#   possible swapping detected:  F    70_A      F    70_A
#   possible swapping detected:  E    86_A      E    86_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    13.646     0    0.202   0.515    16.373    0.000    4.286
LGA    Q    22_A      Q    22_A    11.119     4    0.080   0.111    11.496    0.833    0.370
LGA    G    23_A      G    23_A     7.912     0    0.035   0.035     9.268    9.762    9.762
LGA    Q    24_A      Q    24_A     3.508     0    0.642   1.275     6.292   42.500   38.360
LGA    Q    25_A      Q    25_A     0.816     0    0.159   0.584     2.754   83.810   76.296
LGA    D    26_A      D    26_A     0.987     0    0.217   0.454     2.739   88.214   79.643
LGA    K    27_A      K    27_A     1.571     0    0.151   0.651     3.908   71.071   65.503
LGA    L    28_A      L    28_A     1.029     0    0.042   0.107     1.100   85.952   87.083
LGA    V    29_A      V    29_A     0.891     0    0.036   0.064     1.509   90.476   85.374
LGA    L    30_A      L    30_A     0.737     0    0.037   0.589     2.385   90.476   85.060
LGA    R    31_A      R    31_A     0.759     0    0.065   0.661     3.652   90.476   71.126
LGA    V    32_A      V    32_A     1.001     0    0.121   0.196     1.844   85.952   81.565
LGA    D    33_A      D    33_A     1.314     0    0.140   0.185     2.296   75.119   78.274
LGA    G    34_A      G    34_A     1.528     0    0.040   0.040     1.599   77.143   77.143
LGA    I    35_A      I    35_A     0.899     0    0.090   0.140     1.585   81.548   86.012
LGA    L    36_A      L    36_A     1.644     0    0.093   0.087     2.724   75.000   68.988
LGA    N    37_A      N    37_A     1.493     0    0.107   0.807     4.144   79.286   66.786
LGA    E    38_A      E    38_A     2.015     0    0.014   0.302     3.022   70.833   63.280
LGA    L    39_A      L    39_A     1.612     0    0.060   0.892     4.049   77.143   71.607
LGA    D    40_A      D    40_A     1.123     0    0.037   0.081     1.442   81.429   81.429
LGA    A    41_A      A    41_A     1.286     0    0.013   0.021     1.381   81.429   81.429
LGA    Q    42_A      Q    42_A     1.437     0    0.028   0.191     1.803   81.429   78.571
LGA    V    43_A      V    43_A     1.147     0    0.016   0.051     1.325   85.952   84.014
LGA    L    44_A      L    44_A     0.934     0    0.037   1.420     3.686   85.952   74.048
LGA    E    45_A      E    45_A     1.397     0    0.070   0.785     4.186   79.286   65.873
LGA    G    46_A      G    46_A     1.274     0    0.028   0.028     1.338   81.429   81.429
LGA    I    47_A      I    47_A     0.886     0    0.016   0.677     2.517   83.690   84.107
LGA    L    48_A      L    48_A     1.663     0    0.026   0.090     2.567   75.000   69.940
LGA    T    49_A      T    49_A     1.587     0    0.080   0.074     1.728   75.000   74.082
LGA    R    50_A      R    50_A     0.902     0    0.042   1.399     4.542   90.476   64.719
LGA    L    51_A      L    51_A     1.406     0    0.053   1.323     3.343   83.690   77.619
LGA    N    52_A      N    52_A     1.482     0    0.664   0.739     4.265   68.214   70.595
LGA    G    53_A      G    53_A     0.436     0    0.097   0.097     0.468  100.000  100.000
LGA    V    54_A      V    54_A     0.576     0    0.041   0.059     0.602   90.476   93.197
LGA    R    55_A      R    55_A     0.484     0    0.015   1.303     7.313   95.238   67.143
LGA    Q    56_A      Q    56_A     0.571     0    0.068   0.990     4.361   90.476   79.894
LGA    F    57_A      F    57_A     1.472     0    0.087   1.210     5.209   77.143   64.459
LGA    R    58_A      R    58_A     1.476     0    0.082   1.038     7.349   77.143   54.589
LGA    L    59_A      L    59_A     0.718     0    0.055   0.957     2.412   85.952   81.786
LGA    D    60_A      D    60_A     0.406     0    0.097   0.467     2.238   95.238   88.512
LGA    R    61_A      R    61_A     1.298     0    0.084   1.352     9.125   81.548   46.190
LGA    I    62_A      I    62_A     1.543     0    0.037   0.668     1.939   75.000   73.929
LGA    S    63_A      S    63_A     1.034     0    0.016   0.639     2.210   85.952   83.175
LGA    G    64_A      G    64_A     0.783     0    0.143   0.143     0.990   90.476   90.476
LGA    E    65_A      E    65_A     0.718     0    0.047   0.614     3.187   92.857   77.619
LGA    L    66_A      L    66_A     0.942     0    0.028   1.039     4.432   90.476   77.440
LGA    E    67_A      E    67_A     1.202     0    0.071   0.427     2.781   83.690   77.831
LGA    V    68_A      V    68_A     0.883     0    0.027   1.094     2.490   90.476   84.286
LGA    V    69_A      V    69_A     0.704     0    0.015   0.054     0.966   92.857   91.837
LGA    F    70_A      F    70_A     0.405     0    0.056   0.162     1.370  100.000   91.472
LGA    D    71_A      D    71_A     0.206     0    0.039   0.122     0.489  100.000  100.000
LGA    P    72_A      P    72_A     0.190     0    0.014   0.304     1.074  100.000   97.347
LGA    E    73_A      E    73_A     0.267     0    0.042   0.372     1.020  100.000   96.878
LGA    V    74_A      V    74_A     0.292     0    0.048   0.045     0.449  100.000  100.000
LGA    V    75_A      V    75_A     0.633     0    0.012   0.045     1.044   92.857   90.544
LGA    S    76_A      S    76_A     0.930     0    0.017   0.035     0.958   90.476   90.476
LGA    S    77_A      S    77_A     0.983     0    0.035   0.077     1.185   85.952   84.444
LGA    R    78_A      R    78_A     1.112     0    0.074   1.279     7.663   85.952   57.359
LGA    S    79_A      S    79_A     0.856     0    0.035   0.054     1.376   90.476   87.460
LGA    L    80_A      L    80_A     1.175     0    0.025   0.885     2.094   81.429   81.726
LGA    V    81_A      V    81_A     1.297     0    0.015   0.034     1.748   81.429   78.980
LGA    D    82_A      D    82_A     1.162     0    0.042   0.153     1.757   81.429   78.214
LGA    G    83_A      G    83_A     0.815     0    0.046   0.046     0.934   90.476   90.476
LGA    I    84_A      I    84_A     1.429     0    0.013   0.070     2.219   77.143   72.976
LGA    E    85_A      E    85_A     2.042     0    0.032   0.098     2.430   66.786   65.661
LGA    E    86_A      E    86_A     1.848     0    0.083   0.911     3.016   70.833   66.720
LGA    D    87_A      D    87_A     1.684     0    0.130   0.282     2.159   70.833   72.917
LGA    G    88_A      G    88_A     3.421     0    0.106   0.106     3.421   67.500   67.500
LGA    F    89_A      F    89_A     3.594     0    0.136   1.423     6.516   47.381   29.784
LGA    G    90_A      G    90_A     2.379     0    0.070   0.070     2.846   64.881   64.881
LGA    K    91_A      K    91_A     2.844     0    0.076   0.813     3.843   60.952   53.439
LGA    F    92_A      F    92_A     1.970     0    0.040   0.393     3.011   72.857   64.978
LGA    K    93_A      K    93_A     1.714     0    0.197   0.954     6.093   77.143   59.735
LGA    L    94_A      L    94_A     1.158     0    0.071   1.360     2.555   85.952   78.631
LGA    R    95_A      R    95_A     0.804     0    0.093   0.579     2.473   85.952   76.277
LGA    V    96_A      V    96_A     1.069     0    0.026   0.063     1.952   83.690   79.048
LGA    M    97_A      M    97_A     1.208     0    0.610   0.969     2.951   83.690   77.619
LGA    S    98_A      S    98_A     4.271     1    0.614   0.603     5.331   33.214   28.333

# 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):     2.465          2.482                  2.793           78.883   73.085

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  100   78    4.0     75    1.48    83.013    90.211     4.740

LGA_LOCAL      RMSD:   1.482  Number of atoms:   75  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   2.624  Number of assigned atoms:   78 
Std_ASGN_ATOMS RMSD:   2.465  Standard rmsd on all 78 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.013018 * X  +   0.863451 * Y  +   0.504264 * Z  +  39.944195
  Y_new =   0.999615 * X  +   0.001119 * Y  +  -0.027722 * Z  + -50.360878
  Z_new =  -0.024501 * X  +   0.504431 * Y  +  -0.863104 * Z  + -30.004658 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  1.557774  0.024503  2.612694   [DEG:   89.2539    1.4039  149.6964 ]
ZXZ:  1.515876  2.612181 -0.048533   [DEG:   86.8533  149.6669   -2.7808 ]
 
# END of job
