
#######################################################
#                                                     #
#                        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        2.26     2.26
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    77      22_A - 98_A        1.81     2.28
  LCS_AVERAGE:     97.50

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    35      50_A - 84_A        0.99     2.39
  LCS_AVERAGE:     34.11

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      0    3    3    3    4    4    4    4    4   10   13   25   26   45   49   60   75   78   78   78 
LCS_GDT     Q    22_A     Q    22_A      3   77   78      0    3    7    9   11   27   62   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     G    23_A     G    23_A      8   77   78      3    7   20   41   67   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     Q    24_A     Q    24_A      9   77   78      3   14   31   63   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     Q    25_A     Q    25_A     11   77   78      6   35   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     D    26_A     D    26_A     11   77   78     18   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     K    27_A     K    27_A     11   77   78     13   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     L    28_A     L    28_A     28   77   78     13   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     V    29_A     V    29_A     28   77   78     18   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     L    30_A     L    30_A     28   77   78     15   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     R    31_A     R    31_A     28   77   78     15   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     V    32_A     V    32_A     28   77   78     18   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     D    33_A     D    33_A     28   77   78     15   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     G    34_A     G    34_A     28   77   78      3   15   47   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     I    35_A     I    35_A     28   77   78      9   35   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     L    36_A     L    36_A     28   77   78      3   20   47   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     N    37_A     N    37_A     28   77   78      8   24   53   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     E    38_A     E    38_A     28   77   78     12   26   55   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     L    39_A     L    39_A     28   77   78     12   35   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     D    40_A     D    40_A     28   77   78     12   36   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     A    41_A     A    41_A     28   77   78     12   36   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     Q    42_A     Q    42_A     28   77   78     12   35   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     V    43_A     V    43_A     28   77   78     12   36   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     L    44_A     L    44_A     28   77   78     12   36   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     E    45_A     E    45_A     28   77   78     12   36   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     G    46_A     G    46_A     28   77   78     12   36   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     I    47_A     I    47_A     29   77   78     18   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     L    48_A     L    48_A     29   77   78      7   20   56   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     T    49_A     T    49_A     29   77   78      5   19   50   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     R    50_A     R    50_A     35   77   78     11   36   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     L    51_A     L    51_A     35   77   78     13   36   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     N    52_A     N    52_A     35   77   78     13   36   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     G    53_A     G    53_A     35   77   78     16   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     V    54_A     V    54_A     35   77   78     18   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     R    55_A     R    55_A     35   77   78     18   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     Q    56_A     Q    56_A     35   77   78     18   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     F    57_A     F    57_A     35   77   78     15   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     R    58_A     R    58_A     35   77   78     18   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     L    59_A     L    59_A     35   77   78     15   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     D    60_A     D    60_A     35   77   78     15   36   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     R    61_A     R    61_A     35   77   78     15   28   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     I    62_A     I    62_A     35   77   78      5   22   52   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     S    63_A     S    63_A     35   77   78     15   28   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     G    64_A     G    64_A     35   77   78      5   31   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     E    65_A     E    65_A     35   77   78      9   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     L    66_A     L    66_A     35   77   78     18   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     E    67_A     E    67_A     35   77   78     18   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     V    68_A     V    68_A     35   77   78     18   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     V    69_A     V    69_A     35   77   78     18   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     F    70_A     F    70_A     35   77   78     18   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     D    71_A     D    71_A     35   77   78     18   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     P    72_A     P    72_A     35   77   78     18   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     E    73_A     E    73_A     35   77   78     18   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     V    74_A     V    74_A     35   77   78     17   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     V    75_A     V    75_A     35   77   78     18   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     S    76_A     S    76_A     35   77   78     11   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     S    77_A     S    77_A     35   77   78     11   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     R    78_A     R    78_A     35   77   78     11   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     S    79_A     S    79_A     35   77   78     11   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     L    80_A     L    80_A     35   77   78     11   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     V    81_A     V    81_A     35   77   78     11   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     D    82_A     D    82_A     35   77   78     13   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     G    83_A     G    83_A     35   77   78     11   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     I    84_A     I    84_A     35   77   78     12   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     E    85_A     E    85_A     34   77   78     11   32   55   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     E    86_A     E    86_A     25   77   78     11   35   55   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     D    87_A     D    87_A     25   77   78     11   34   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     G    88_A     G    88_A     25   77   78      5   13   24   46   67   72   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     F    89_A     F    89_A      5   77   78      3    5    5    7    8   13   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     G    90_A     G    90_A      5   77   78      3    5    7   56   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     K    91_A     K    91_A      7   77   78      3    5   50   66   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     F    92_A     F    92_A      7   77   78      9   21   56   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     K    93_A     K    93_A      7   77   78      9   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     L    94_A     L    94_A      7   77   78     18   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     R    95_A     R    95_A      7   77   78     18   37   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     V    96_A     V    96_A      7   77   78     15   36   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     M    97_A     M    97_A      7   77   78     15   29   57   68   71   73   74   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_GDT     S    98_A     S    98_A      7   77   78      0    3   23   27   53   72   73   75   76   76   77   77   77   77   77   77   77   78   78   78 
LCS_AVERAGE  LCS_A:  77.20  (  34.11   97.50  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     37     57     68     71     73     74     75     76     76     77     77     77     77     77     77     77     78     78     78 
GDT PERCENT_AT  23.08  47.44  73.08  87.18  91.03  93.59  94.87  96.15  97.44  97.44  98.72  98.72  98.72  98.72  98.72  98.72  98.72 100.00 100.00 100.00
GDT RMS_LOCAL    0.33   0.66   0.97   1.16   1.26   1.41   1.45   1.51   1.58   1.58   1.81   1.81   1.81   1.81   1.81   1.81   1.81   2.26   2.26   2.26
GDT RMS_ALL_AT   2.56   2.51   2.35   2.37   2.38   2.32   2.32   2.32   2.34   2.34   2.28   2.28   2.28   2.28   2.28   2.28   2.28   2.26   2.26   2.26

# Checking swapping
#   possible swapping detected:  F    21_A      F    21_A
#   possible swapping detected:  E    38_A      E    38_A
#   possible swapping detected:  F    57_A      F    57_A
#   possible swapping detected:  F    70_A      F    70_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    12.817     0    0.599   1.166    16.184    0.000    0.000
LGA    Q    22_A      Q    22_A     8.100     4    0.612   0.594     9.236   12.381    6.614
LGA    G    23_A      G    23_A     4.343     0    0.665   0.665     5.668   51.548   51.548
LGA    Q    24_A      Q    24_A     3.029     0    0.461   1.117     6.655   52.262   41.164
LGA    Q    25_A      Q    25_A     1.137     0    0.132   0.962     5.623   83.810   62.434
LGA    D    26_A      D    26_A     0.854     0    0.225   0.360     2.288   88.214   80.595
LGA    K    27_A      K    27_A     1.345     0    0.134   0.655     3.755   77.262   68.254
LGA    L    28_A      L    28_A     0.851     0    0.049   0.159     0.943   90.476   90.476
LGA    V    29_A      V    29_A     0.970     0    0.044   0.056     1.679   90.476   84.150
LGA    L    30_A      L    30_A     1.066     0    0.106   1.406     3.541   79.286   70.476
LGA    R    31_A      R    31_A     0.659     0    0.056   1.112     3.104   90.476   71.039
LGA    V    32_A      V    32_A     0.536     0    0.082   0.121     1.085   95.238   91.905
LGA    D    33_A      D    33_A     0.720     0    0.076   0.288     1.756   85.952   82.679
LGA    G    34_A      G    34_A     2.243     0    0.120   0.120     2.243   70.833   70.833
LGA    I    35_A      I    35_A     1.147     0    0.591   0.582     2.739   75.357   76.250
LGA    L    36_A      L    36_A     2.673     0    0.075   0.200     3.590   59.048   54.583
LGA    N    37_A      N    37_A     2.076     0    0.057   0.343     2.656   68.810   67.857
LGA    E    38_A      E    38_A     1.697     0    0.034   0.756     3.731   77.143   61.640
LGA    L    39_A      L    39_A     1.305     0    0.049   1.106     4.617   81.429   72.024
LGA    D    40_A      D    40_A     0.961     0    0.020   0.129     1.321   88.214   85.952
LGA    A    41_A      A    41_A     0.812     0    0.008   0.017     0.944   90.476   90.476
LGA    Q    42_A      Q    42_A     1.142     0    0.007   0.156     2.105   81.429   77.672
LGA    V    43_A      V    43_A     0.907     0    0.013   0.033     1.265   88.214   87.891
LGA    L    44_A      L    44_A     0.472     0    0.024   1.422     3.426   92.857   79.524
LGA    E    45_A      E    45_A     1.010     0    0.079   0.846     4.482   83.690   68.677
LGA    G    46_A      G    46_A     1.016     0    0.013   0.013     1.018   85.952   85.952
LGA    I    47_A      I    47_A     0.616     0    0.016   0.676     3.008   85.952   82.024
LGA    L    48_A      L    48_A     1.793     0    0.024   1.370     5.246   72.976   65.179
LGA    T    49_A      T    49_A     1.845     0    0.070   0.061     2.203   70.833   69.388
LGA    R    50_A      R    50_A     0.727     0    0.053   1.481     5.336   90.476   68.182
LGA    L    51_A      L    51_A     1.197     0    0.020   0.322     3.039   83.690   72.440
LGA    N    52_A      N    52_A     1.087     0    0.042   0.497     2.412   79.286   78.274
LGA    G    53_A      G    53_A     0.654     0    0.045   0.045     0.703   90.476   90.476
LGA    V    54_A      V    54_A     0.633     0    0.028   0.053     0.748   90.476   90.476
LGA    R    55_A      R    55_A     0.806     0    0.009   1.295     6.353   88.214   70.087
LGA    Q    56_A      Q    56_A     0.891     0    0.062   0.995     4.420   85.952   77.037
LGA    F    57_A      F    57_A     1.784     0    0.086   1.128     4.770   75.000   63.853
LGA    R    58_A      R    58_A     1.551     0    0.100   1.050     7.363   75.000   53.810
LGA    L    59_A      L    59_A     0.826     0    0.049   0.805     2.684   90.476   81.012
LGA    D    60_A      D    60_A     0.610     0    0.112   0.482     2.781   88.214   81.845
LGA    R    61_A      R    61_A     1.432     0    0.058   1.386     9.296   77.143   44.589
LGA    I    62_A      I    62_A     1.834     0    0.031   0.665     2.343   72.976   71.905
LGA    S    63_A      S    63_A     1.453     0    0.028   0.644     2.242   81.429   78.651
LGA    G    64_A      G    64_A     1.250     0    0.165   0.165     1.662   79.286   79.286
LGA    E    65_A      E    65_A     1.263     0    0.041   0.181     3.157   85.952   72.646
LGA    L    66_A      L    66_A     1.195     0    0.088   1.324     3.649   83.690   70.000
LGA    E    67_A      E    67_A     1.304     0    0.009   0.450     2.813   81.429   76.825
LGA    V    68_A      V    68_A     0.912     0    0.043   1.132     2.600   88.214   81.905
LGA    V    69_A      V    69_A     0.850     0    0.016   0.048     1.012   90.476   89.184
LGA    F    70_A      F    70_A     0.513     0    0.056   0.264     1.800   95.238   88.182
LGA    D    71_A      D    71_A     0.318     0    0.031   0.099     0.581  100.000   98.810
LGA    P    72_A      P    72_A     0.249     0    0.024   0.048     0.550  100.000   95.918
LGA    E    73_A      E    73_A     0.353     0    0.043   0.378     1.331   97.619   95.820
LGA    V    74_A      V    74_A     0.632     0    0.065   0.079     0.940   90.476   90.476
LGA    V    75_A      V    75_A     0.392     0    0.087   1.184     2.869  100.000   88.844
LGA    S    76_A      S    76_A     1.131     0    0.019   0.049     1.131   83.690   84.444
LGA    S    77_A      S    77_A     1.241     0    0.029   0.062     1.450   81.429   81.429
LGA    R    78_A      R    78_A     1.143     0    0.050   1.272     7.593   85.952   57.359
LGA    S    79_A      S    79_A     0.756     0    0.040   0.682     3.343   90.476   83.730
LGA    L    80_A      L    80_A     1.126     0    0.026   0.952     1.940   81.429   80.536
LGA    V    81_A      V    81_A     1.366     0    0.013   0.038     1.776   81.429   78.980
LGA    D    82_A      D    82_A     1.058     0    0.047   0.170     1.554   81.429   80.357
LGA    G    83_A      G    83_A     0.946     0    0.011   0.011     1.074   85.952   85.952
LGA    I    84_A      I    84_A     1.396     0    0.013   0.037     1.939   77.143   75.000
LGA    E    85_A      E    85_A     1.920     0    0.028   0.121     2.189   70.833   68.360
LGA    E    86_A      E    86_A     1.755     0    0.072   0.731     3.323   70.833   69.471
LGA    D    87_A      D    87_A     1.810     0    0.126   0.214     2.214   68.810   70.833
LGA    G    88_A      G    88_A     3.284     0    0.099   0.099     3.284   69.762   69.762
LGA    F    89_A      F    89_A     3.882     0    0.139   1.396     6.426   45.833   28.745
LGA    G    90_A      G    90_A     2.687     0    0.078   0.078     2.842   60.952   60.952
LGA    K    91_A      K    91_A     2.552     0    0.066   0.803     3.350   62.976   58.201
LGA    F    92_A      F    92_A     1.764     0    0.069   0.343     2.897   77.143   67.186
LGA    K    93_A      K    93_A     1.159     0    0.052   0.899     6.577   83.810   63.228
LGA    L    94_A      L    94_A     0.586     0    0.074   0.173     2.448   92.857   82.917
LGA    R    95_A      R    95_A     0.550     0    0.090   0.585     3.040   95.238   78.355
LGA    V    96_A      V    96_A     1.135     0    0.034   0.066     1.706   81.548   80.272
LGA    M    97_A      M    97_A     1.612     0    0.566   1.132     3.732   79.405   73.571
LGA    S    98_A      S    98_A     4.562     1    0.607   0.598     5.683   29.405   25.794

# 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):     2.256          2.198                  2.929           79.104   72.477

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  100   78    4.0     75    1.51    82.372    90.367     4.668

LGA_LOCAL      RMSD:   1.507  Number of atoms:   75  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   2.323  Number of assigned atoms:   78 
Std_ASGN_ATOMS RMSD:   2.256  Standard rmsd on all 78 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.396527 * X  +  -0.915269 * Y  +  -0.071048 * Z  +  35.217628
  Y_new =  -0.596631 * X  +  -0.198114 * Y  +  -0.777678 * Z  + -43.473122
  Z_new =   0.697709 * X  +   0.350760 * Y  +  -0.624636 * Z  + -38.405773 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -0.984218 -0.772195  2.629930   [DEG:  -56.3915  -44.2435  150.6839 ]
ZXZ: -0.091106  2.245461  1.104967   [DEG:   -5.2200  128.6554   63.3099 ]
 
# END of job
