
#######################################################
#                                                     #
#                        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        2.94     2.94
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    75      24_A - 98_A        1.79     3.12
  LCS_AVERAGE:     92.64

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    53      26_A - 78_A        0.99     3.28
  LCS_AVERAGE:     61.21

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      1    3    4    5    5    5    6    7    7    8   25   27   28   30   33   62   66   78   78   78 
LCS_GDT     Q    22_A     Q    22_A      3    4   78      0    3    4    5    5    5   11   15   28   59   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     G    23_A     G    23_A      3    4   78      0    3    3    5    5    5   11   34   46   65   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     Q    24_A     Q    24_A      3   75   78      1    3    3    4    4    6    6   10   46   59   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     Q    25_A     Q    25_A      3   75   78      1    3    3   23   37   60   72   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     D    26_A     D    26_A     53   75   78     20   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     K    27_A     K    27_A     53   75   78     20   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     L    28_A     L    28_A     53   75   78     20   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     V    29_A     V    29_A     53   75   78     20   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     L    30_A     L    30_A     53   75   78     10   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     R    31_A     R    31_A     53   75   78     20   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     V    32_A     V    32_A     53   75   78     18   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     D    33_A     D    33_A     53   75   78     13   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     G    34_A     G    34_A     53   75   78     13   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     I    35_A     I    35_A     53   75   78     11   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     L    36_A     L    36_A     53   75   78     15   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     N    37_A     N    37_A     53   75   78     15   39   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     E    38_A     E    38_A     53   75   78     15   37   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     L    39_A     L    39_A     53   75   78     15   40   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     D    40_A     D    40_A     53   75   78     15   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     A    41_A     A    41_A     53   75   78     15   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     Q    42_A     Q    42_A     53   75   78     15   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     V    43_A     V    43_A     53   75   78     15   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     L    44_A     L    44_A     53   75   78     15   40   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     E    45_A     E    45_A     53   75   78     15   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     G    46_A     G    46_A     53   75   78     15   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     I    47_A     I    47_A     53   75   78     15   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     L    48_A     L    48_A     53   75   78     15   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     T    49_A     T    49_A     53   75   78     15   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     R    50_A     R    50_A     53   75   78     16   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     L    51_A     L    51_A     53   75   78      3   40   62   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     N    52_A     N    52_A     53   75   78      3   22   57   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     G    53_A     G    53_A     53   75   78     20   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     V    54_A     V    54_A     53   75   78     20   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     R    55_A     R    55_A     53   75   78     20   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     Q    56_A     Q    56_A     53   75   78     20   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     F    57_A     F    57_A     53   75   78     20   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     R    58_A     R    58_A     53   75   78     20   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     L    59_A     L    59_A     53   75   78     20   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     D    60_A     D    60_A     53   75   78      9   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     R    61_A     R    61_A     53   75   78      5   37   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     I    62_A     I    62_A     53   75   78      5   16   55   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     S    63_A     S    63_A     53   75   78      5   34   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     G    64_A     G    64_A     53   75   78      8   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     E    65_A     E    65_A     53   75   78     10   39   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     L    66_A     L    66_A     53   75   78     20   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     E    67_A     E    67_A     53   75   78     20   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     V    68_A     V    68_A     53   75   78     20   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     V    69_A     V    69_A     53   75   78     20   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     F    70_A     F    70_A     53   75   78     20   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     D    71_A     D    71_A     53   75   78     14   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     P    72_A     P    72_A     53   75   78      9   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     E    73_A     E    73_A     53   75   78      8   38   66   72   73   73   73   74   74   74   74   77   77   77   77   77   77   78   78   78 
LCS_GDT     V    74_A     V    74_A     53   75   78      9   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     V    75_A     V    75_A     53   75   78      6   38   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     S    76_A     S    76_A     53   75   78     11   38   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     S    77_A     S    77_A     53   75   78     11   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     R    78_A     R    78_A     53   75   78     11   38   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     S    79_A     S    79_A     45   75   78      9   23   60   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     L    80_A     L    80_A     45   75   78      9   21   59   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     V    81_A     V    81_A     45   75   78      9   38   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     D    82_A     D    82_A     45   75   78     11   38   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     G    83_A     G    83_A     45   75   78      9   38   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     I    84_A     I    84_A     45   75   78      9   35   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     E    85_A     E    85_A     45   75   78      9   31   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     E    86_A     E    86_A     45   75   78      9   39   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     D    87_A     D    87_A     45   75   78      8   30   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     G    88_A     G    88_A     45   75   78      9   30   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     F    89_A     F    89_A     45   75   78      4   16   43   71   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     G    90_A     G    90_A     45   75   78      4   30   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     K    91_A     K    91_A     45   75   78      4   30   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     F    92_A     F    92_A     45   75   78     11   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     K    93_A     K    93_A     45   75   78      9   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     L    94_A     L    94_A     45   75   78      9   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     R    95_A     R    95_A     45   75   78     20   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     V    96_A     V    96_A     45   75   78     20   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     M    97_A     M    97_A     45   75   78     20   41   66   72   73   73   73   74   74   74   75   77   77   77   77   77   77   78   78   78 
LCS_GDT     S    98_A     S    98_A     45   75   78      0   30   66   72   73   73   73   74   74   74   74   77   77   77   77   77   77   78   78   78 
LCS_AVERAGE  LCS_A:  84.62  (  61.21   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     20     41     66     72     73     73     73     74     74     74     75     77     77     77     77     77     77     78     78     78 
GDT PERCENT_AT  25.64  52.56  84.62  92.31  93.59  93.59  93.59  94.87  94.87  94.87  96.15  98.72  98.72  98.72  98.72  98.72  98.72 100.00 100.00 100.00
GDT RMS_LOCAL    0.34   0.72   1.01   1.10   1.13   1.13   1.13   1.35   1.35   1.35   2.40   2.39   2.39   2.39   2.39   2.39   2.39   2.94   2.94   2.94
GDT RMS_ALL_AT   3.40   3.29   3.30   3.29   3.29   3.29   3.29   3.22   3.22   3.22   2.97   2.98   2.98   2.98   2.98   2.98   2.98   2.94   2.94   2.94

# Checking swapping
#   possible swapping detected:  F    21_A      F    21_A
#   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    17.728     0    0.537   1.466    18.986    0.000    0.000
LGA    Q    22_A      Q    22_A    11.814     4    0.589   0.583    13.624    0.000    0.053
LGA    G    23_A      G    23_A    10.419     0    0.512   0.512    10.520    0.833    0.833
LGA    Q    24_A      Q    24_A    10.476     0    0.617   0.678    16.429    0.833    0.370
LGA    Q    25_A      Q    25_A     6.300     0    0.623   0.918    12.004   27.738   13.598
LGA    D    26_A      D    26_A     0.864     0    0.678   1.264     6.260   84.524   57.024
LGA    K    27_A      K    27_A     0.970     0    0.053   0.596     3.055   85.952   78.254
LGA    L    28_A      L    28_A     0.849     0    0.047   0.752     2.070   90.476   86.131
LGA    V    29_A      V    29_A     1.077     0    0.018   0.061     1.884   88.214   81.633
LGA    L    30_A      L    30_A     1.079     0    0.083   1.387     3.173   79.286   71.310
LGA    R    31_A      R    31_A     0.764     0    0.052   0.559     2.142   90.476   84.113
LGA    V    32_A      V    32_A     0.886     0    0.070   0.106     1.440   88.214   85.306
LGA    D    33_A      D    33_A     0.609     0    0.059   0.744     3.233   95.238   80.417
LGA    G    34_A      G    34_A     0.410     0    0.021   0.021     0.541   97.619   97.619
LGA    I    35_A      I    35_A     0.714     0    0.033   0.082     1.241   90.476   87.083
LGA    L    36_A      L    36_A     0.679     0    0.014   0.046     1.018   88.214   92.917
LGA    N    37_A      N    37_A     1.239     0    0.058   0.071     1.276   81.429   81.429
LGA    E    38_A      E    38_A     1.314     0    0.033   0.860     2.954   81.429   74.974
LGA    L    39_A      L    39_A     1.259     0    0.015   1.106     5.355   81.429   67.560
LGA    D    40_A      D    40_A     1.024     0    0.018   0.067     1.136   81.429   82.560
LGA    A    41_A      A    41_A     1.031     0    0.027   0.030     1.053   81.429   81.429
LGA    Q    42_A      Q    42_A     1.084     0    0.011   0.140     1.393   81.429   81.429
LGA    V    43_A      V    43_A     1.242     0    0.021   0.022     1.332   81.429   81.429
LGA    L    44_A      L    44_A     1.172     0    0.031   1.374     2.774   81.429   75.357
LGA    E    45_A      E    45_A     1.054     0    0.050   0.318     1.587   81.429   82.487
LGA    G    46_A      G    46_A     1.218     0    0.013   0.013     1.289   81.429   81.429
LGA    I    47_A      I    47_A     1.126     0    0.011   0.040     1.239   81.429   82.560
LGA    L    48_A      L    48_A     1.212     0    0.007   0.069     1.779   81.429   80.357
LGA    T    49_A      T    49_A     1.093     0    0.082   0.073     1.458   81.429   81.429
LGA    R    50_A      R    50_A     1.215     0    0.018   1.144     8.128   81.429   47.403
LGA    L    51_A      L    51_A     1.621     0    0.022   1.311     2.995   79.286   74.345
LGA    N    52_A      N    52_A     2.075     0    0.658   0.746     4.968   56.548   60.714
LGA    G    53_A      G    53_A     1.012     0    0.084   0.084     1.012   88.214   88.214
LGA    V    54_A      V    54_A     0.887     0    0.020   0.059     0.958   90.476   90.476
LGA    R    55_A      R    55_A     0.734     0    0.013   1.341     7.830   90.476   62.987
LGA    Q    56_A      Q    56_A     0.600     0    0.051   1.079     2.574   90.476   80.952
LGA    F    57_A      F    57_A     0.817     0    0.063   0.193     1.949   85.952   82.381
LGA    R    58_A      R    58_A     1.324     0    0.081   1.099     7.353   81.429   54.589
LGA    L    59_A      L    59_A     0.859     0    0.069   0.898     2.580   85.952   81.845
LGA    D    60_A      D    60_A     0.574     0    0.112   0.475     2.840   90.476   81.845
LGA    R    61_A      R    61_A     1.129     0    0.045   1.329     4.971   81.548   67.403
LGA    I    62_A      I    62_A     1.741     0    0.017   0.033     2.644   75.000   68.929
LGA    S    63_A      S    63_A     1.268     0    0.023   0.643     1.930   85.952   83.016
LGA    G    64_A      G    64_A     0.597     0    0.135   0.135     1.059   88.214   88.214
LGA    E    65_A      E    65_A     1.235     0    0.041   0.145     3.036   85.952   71.746
LGA    L    66_A      L    66_A     1.086     0    0.026   0.989     3.619   85.952   75.774
LGA    E    67_A      E    67_A     1.135     0    0.106   0.435     2.660   85.952   74.286
LGA    V    68_A      V    68_A     0.800     0    0.064   1.167     2.732   90.476   81.905
LGA    V    69_A      V    69_A     0.416     0    0.024   0.062     0.523   97.619   98.639
LGA    F    70_A      F    70_A     0.547     0    0.029   0.106     1.140   97.619   90.606
LGA    D    71_A      D    71_A     0.140     0    0.035   0.167     0.655  100.000   98.810
LGA    P    72_A      P    72_A     0.601     0    0.010   0.022     0.871   92.857   94.558
LGA    E    73_A      E    73_A     0.851     0    0.032   0.379     1.556   90.476   85.503
LGA    V    74_A      V    74_A     0.388     0    0.055   0.067     0.737   92.857   95.918
LGA    V    75_A      V    75_A     1.319     0    0.095   0.942     3.145   83.690   75.782
LGA    S    76_A      S    76_A     0.996     0    0.025   0.079     1.301   85.952   84.444
LGA    S    77_A      S    77_A     0.538     0    0.019   0.049     1.022   88.214   90.556
LGA    R    78_A      R    78_A     1.263     0    0.074   1.255     7.256   81.429   56.623
LGA    S    79_A      S    79_A     1.782     0    0.037   0.065     2.549   72.857   68.889
LGA    L    80_A      L    80_A     1.717     0    0.022   0.886     1.890   77.143   78.274
LGA    V    81_A      V    81_A     0.881     0    0.023   0.076     1.104   88.214   89.184
LGA    D    82_A      D    82_A     0.994     0    0.035   0.167     2.001   88.214   81.667
LGA    G    83_A      G    83_A     1.425     0    0.046   0.046     1.425   81.429   81.429
LGA    I    84_A      I    84_A     1.463     0    0.025   0.083     2.296   81.429   74.107
LGA    E    85_A      E    85_A     1.203     0    0.061   0.133     2.132   81.429   76.720
LGA    E    86_A      E    86_A     0.869     0    0.066   0.704     3.251   88.214   76.296
LGA    D    87_A      D    87_A     1.699     0    0.043   0.341     2.690   72.976   67.917
LGA    G    88_A      G    88_A     1.645     0    0.672   0.672     2.491   75.119   75.119
LGA    F    89_A      F    89_A     2.425     0    0.128   0.157     3.438   62.857   58.658
LGA    G    90_A      G    90_A     1.749     0    0.042   0.042     1.960   72.857   72.857
LGA    K    91_A      K    91_A     1.713     0    0.049   0.797     2.120   75.000   73.862
LGA    F    92_A      F    92_A     0.944     0    0.046   0.178     1.107   85.952   86.364
LGA    K    93_A      K    93_A     0.803     0    0.057   0.803     4.254   90.476   81.587
LGA    L    94_A      L    94_A     0.602     0    0.070   0.222     2.013   92.857   84.048
LGA    R    95_A      R    95_A     0.510     0    0.038   1.302     8.341   97.619   61.948
LGA    V    96_A      V    96_A     0.665     0    0.051   0.052     1.231   88.214   87.891
LGA    M    97_A      M    97_A     0.938     0    0.313   0.849     2.920   86.071   82.976
LGA    S    98_A      S    98_A     1.675     1    0.629   0.595     2.339   77.143   62.222

# 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):     2.941          2.871                  3.544           79.657   73.866

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  100   78    4.0     74    1.35    84.615    90.467     5.106

LGA_LOCAL      RMSD:   1.349  Number of atoms:   74  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   3.216  Number of assigned atoms:   78 
Std_ASGN_ATOMS RMSD:   2.941  Standard rmsd on all 78 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.680790 * X  +   0.712924 * Y  +   0.168118 * Z  +  20.102518
  Y_new =   0.666231 * X  +   0.698070 * Y  +  -0.262364 * Z  + -51.610600
  Z_new =  -0.304404 * X  +  -0.066609 * Y  +  -0.950211 * Z  +   5.934073 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  2.367003  0.309312 -3.071608   [DEG:  135.6193   17.7223 -175.9901 ]
ZXZ:  0.569867  2.824710 -1.786220   [DEG:   32.6510  161.8440 -102.3429 ]
 
# END of job
