
#######################################################
#                                                     #
#                        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   76 (  632),  selected   76 , name one
# Molecule2: number of CA atoms  594 ( 4909),  selected   76 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:A  -ch2:B  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    76      13_B - 88_B        3.88     3.88
  LCS_AVERAGE:     12.79

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    41      13_B - 53_B        1.92     4.33
  LONGEST_CONTINUOUS_SEGMENT:    41      14_B - 54_B        1.90     4.33
  LCS_AVERAGE:      4.86

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    28      25_B - 52_B        0.96     6.06
  LONGEST_CONTINUOUS_SEGMENT:    28      26_B - 53_B        0.99     5.43
  LCS_AVERAGE:      2.69

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:   76
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     L    13_A     L    13_B      4   41   76      3    3   24   31   39   46   54   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     F    14_A     F    14_B      4   41   76      3    3   19   20   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     K    15_A     K    15_B      4   41   76      3    3    4    5   17   22   49   62   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     N    16_A     N    16_B      9   41   76      4   12   20   33   42   51   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     S    17_A     S    17_B      9   41   76      4   12   24   40   50   54   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     N    18_A     N    18_B     15   41   76      6   19   35   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     I    19_A     I    19_B     15   41   76     12   24   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     F    20_A     F    20_B     15   41   76     10   24   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     Y    21_A     Y    21_B     15   41   76     10   24   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     T    22_A     T    22_B     15   41   76      5   22   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     P    23_A     P    23_B     15   41   76      5   21   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     T    24_A     T    24_B     15   41   76      5   15   34   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     Y    25_A     Y    25_B     28   41   76      3   10   22   36   41   53   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     Q    26_A     Q    26_B     28   41   76      4   13   31   42   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     R    27_A     R    27_B     28   41   76      8   21   34   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     D    28_A     D    28_B     28   41   76      8   24   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     Y    29_A     Y    29_B     28   41   76     10   25   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     S    30_A     S    30_B     28   41   76     13   25   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     W    31_A     W    31_B     28   41   76     13   25   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     E    32_A     E    32_B     28   41   76     13   25   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     D    33_A     D    33_B     28   41   76     10   23   29   43   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     E    34_A     E    34_B     28   41   76     10   21   30   39   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     Q    35_A     Q    35_B     28   41   76      8   25   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     I    36_A     I    36_B     28   41   76     13   25   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     E    37_A     E    37_B     28   41   76     13   25   36   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     Q    38_A     Q    38_B     28   41   76     13   25   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     F    39_A     F    39_B     28   41   76     13   25   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     C    40_A     C    40_B     28   41   76     13   25   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     N    41_A     N    41_B     28   41   76     13   25   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     D    42_A     D    42_B     28   41   76     13   25   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     I    43_A     I    43_B     28   41   76     13   25   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     Q    44_A     Q    44_B     28   41   76     13   25   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     D    45_A     D    45_B     28   41   76     13   25   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     A    46_A     A    46_B     28   41   76     13   25   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     L    47_A     L    47_B     28   41   76     13   25   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     V    48_A     V    48_B     28   41   76     13   25   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     K    49_A     K    49_B     28   41   76     13   25   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     K    50_A     K    50_B     28   41   76     13   25   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     K    51_A     K    51_B     28   41   76     13   25   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     S    52_A     S    52_B     28   41   76     13   25   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     K    53_A     K    53_B     28   41   76      3   16   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     K    54_A     K    54_B      6   41   76      3    4   17   37   43   53   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     S    55_A     S    55_B      6   40   76      3    5    6    9   21   29   37   48   63   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     C    56_A     C    56_B      6   40   76      3    5    6   10   32   55   60   64   65   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     E    57_A     E    57_B      6   12   76      3    5    8   22   35   46   58   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     H    58_A     H    58_B      6   12   76      3    5    6    7   40   45   49   58   63   67   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     F    59_A     F    59_B      6   12   76      3    5    7   15   43   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     F    60_A     F    60_B      6   12   76      3    4    7   16   40   46   55   61   65   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     G    61_A     G    61_B      7   12   76      5   11   14   35   41   52   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     G    62_A     G    62_B      7   12   76      5   11   30   38   46   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     V    63_A     V    63_B      7   12   76      5   21   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     V    64_A     V    64_B      7   12   76      8   21   34   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     C    65_A     C    65_B      7   12   76      8   21   34   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     A    66_A     A    66_B      7   12   76      5   21   32   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     Q    67_A     Q    67_B      7   12   76      5   13   21   39   49   55   60   64   65   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     E    68_A     E    68_B      4    8   76      3    6   13   26   44   51   58   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     K    69_A     K    69_B      4    7   76      3    3    8   12   16   29   46   58   65   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     T    70_A     T    70_B      4    7   76      3    3    4    5    9    9    9   13   16   20   23   34   41   61   69   76   76   76   76   76 
LCS_GDT     F    71_A     F    71_B      4    5   76      3    3    4    4    5    6   10   13   18   22   32   38   46   59   68   76   76   76   76   76 
LCS_GDT     G    72_A     G    72_B      4    5   76      3    3    4    5    5    9   12   15   25   30   38   44   54   65   72   76   76   76   76   76 
LCS_GDT     G    73_A     G    73_B      4    5   76      3    3    4    4    8   15   19   30   38   52   68   73   73   73   73   76   76   76   76   76 
LCS_GDT     H    74_A     H    74_B      8   15   76      3    7   15   23   30   35   48   57   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     R    75_A     R    75_B      8   15   76      3    7   15   23   30   35   48   54   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     R    76_A     R    76_B      8   15   76      3    7   11   20   30   35   45   54   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     I    77_A     I    77_B      8   15   76      3    7   15   23   36   46   56   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     E    78_A     E    78_B     11   15   76      4   19   31   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     N    79_A     N    79_B     11   15   76     12   24   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     L    80_A     L    80_B     11   15   76      7   21   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     L    81_A     L    81_B     11   15   76      8   21   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     V    82_A     V    82_B     11   15   76      5   21   34   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     D    83_A     D    83_B     11   15   76      7   21   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     G    84_A     G    84_B     11   15   76      5   18   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     Q    85_A     Q    85_B     11   15   76      5   25   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     Q    86_A     Q    86_B     11   15   76      6   25   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     R    87_A     R    87_B     11   15   76     10   25   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_GDT     L    88_A     L    88_B     11   15   76      6   21   37   46   50   55   60   64   66   70   72   73   73   73   73   76   76   76   76   76 
LCS_AVERAGE  LCS_A:   6.78  (   2.69    4.86   12.79 )

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     13     25     37     46     50     55     60     64     66     70     72     73     73     73     73     76     76     76     76     76 
GDT PERCENT_AT   2.19   4.21   6.23   7.74   8.42   9.26  10.10  10.77  11.11  11.78  12.12  12.29  12.29  12.29  12.29  12.79  12.79  12.79  12.79  12.79
GDT RMS_LOCAL    0.25   0.58   0.96   1.22   1.39   1.66   1.91   2.16   2.52   2.71   2.83   3.03   3.03   3.03   3.03   3.88   3.88   3.88   3.88   3.88
GDT RMS_ALL_AT   4.63   4.82   4.45   4.44   4.42   4.46   4.37   4.25   4.05   4.03   4.02   3.97   3.97   3.97   3.97   3.88   3.88   3.88   3.88   3.88

# Checking swapping
#   possible swapping detected:  F    14_A      F    14_B
#   possible swapping detected:  F    20_A      F    20_B
#   possible swapping detected:  Y    29_A      Y    29_B
#   possible swapping detected:  E    34_A      E    34_B
#   possible swapping detected:  F    39_A      F    39_B
#   possible swapping detected:  E    57_A      E    57_B
#   possible swapping detected:  F    59_A      F    59_B
#   possible swapping detected:  E    68_A      E    68_B
#   possible swapping detected:  F    71_A      F    71_B
#   possible swapping detected:  E    78_A      E    78_B

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    L    13_A      L    13_B     4.215     0    0.270   1.303    10.002   45.238   25.714
LGA    F    14_A      F    14_B     3.023     0    0.114   1.451    12.832   54.048   22.944
LGA    K    15_A      K    15_B     4.989     0    0.625   0.635    15.223   42.024   20.317
LGA    N    16_A      N    16_B     3.461     0    0.551   1.235     7.193   45.119   31.369
LGA    S    17_A      S    17_B     2.492     0    0.279   0.262     3.583   66.905   61.349
LGA    N    18_A      N    18_B     1.344     0    0.094   1.316     3.519   83.810   75.714
LGA    I    19_A      I    19_B     0.366     0    0.185   0.787     2.467   92.976   85.179
LGA    F    20_A      F    20_B     0.585     0    0.055   0.267     0.977   95.238   92.208
LGA    Y    21_A      Y    21_B     0.549     0    0.080   1.261     5.646   92.857   70.238
LGA    T    22_A      T    22_B     1.023     0    0.158   0.175     1.633   83.690   81.497
LGA    P    23_A      P    23_B     1.221     0    0.035   0.265     1.645   79.286   77.755
LGA    T    24_A      T    24_B     1.540     0    0.641   1.359     3.299   72.976   67.415
LGA    Y    25_A      Y    25_B     3.694     0    0.218   1.392    13.788   53.810   23.016
LGA    Q    26_A      Q    26_B     2.418     0    0.098   1.193     4.619   64.881   54.603
LGA    R    27_A      R    27_B     1.275     0    0.069   1.090     5.334   79.286   57.273
LGA    D    28_A      D    28_B     0.846     0    0.133   0.773     2.787   88.214   80.774
LGA    Y    29_A      Y    29_B     0.098     0    0.114   0.226     0.618   97.619   96.032
LGA    S    30_A      S    30_B     0.616     0    0.196   0.684     2.495   86.071   83.254
LGA    W    31_A      W    31_B     0.685     0    0.089   0.207     1.593   90.476   86.633
LGA    E    32_A      E    32_B     1.042     0    0.055   0.878     4.200   75.119   71.005
LGA    D    33_A      D    33_B     2.825     0    0.112   0.877     3.724   57.262   52.798
LGA    E    34_A      E    34_B     2.954     0    0.075   0.879     4.738   57.143   49.630
LGA    Q    35_A      Q    35_B     1.352     0    0.061   1.128     3.481   81.548   73.651
LGA    I    36_A      I    36_B     1.230     0    0.052   0.905     3.465   81.429   74.345
LGA    E    37_A      E    37_B     1.757     0    0.096   0.726     2.955   75.000   70.265
LGA    Q    38_A      Q    38_B     1.234     0    0.063   1.244     6.216   85.952   64.603
LGA    F    39_A      F    39_B     0.651     0    0.056   0.222     3.922   90.476   71.255
LGA    C    40_A      C    40_B     0.973     0    0.064   0.082     1.604   90.476   86.032
LGA    N    41_A      N    41_B     0.980     0    0.094   0.996     2.631   90.476   84.048
LGA    D    42_A      D    42_B     1.250     0    0.074   1.180     3.031   81.548   78.750
LGA    I    43_A      I    43_B     1.668     0    0.086   0.172     2.196   75.000   72.917
LGA    Q    44_A      Q    44_B     1.435     0    0.052   1.062     5.117   77.143   60.741
LGA    D    45_A      D    45_B     1.775     0    0.032   0.669     4.437   72.857   64.464
LGA    A    46_A      A    46_B     1.811     0    0.036   0.048     2.147   70.833   71.238
LGA    L    47_A      L    47_B     1.888     0    0.057   0.802     2.787   68.810   69.940
LGA    V    48_A      V    48_B     1.903     0    0.022   1.203     4.381   70.833   65.442
LGA    K    49_A      K    49_B     2.282     0    0.090   1.075     6.587   64.762   51.534
LGA    K    50_A      K    50_B     2.511     0    0.014   0.884     5.887   59.048   48.942
LGA    K    51_A      K    51_B     2.396     0    0.252   1.318     8.408   62.857   45.344
LGA    S    52_A      S    52_B     2.607     0    0.108   0.621     5.071   62.976   54.683
LGA    K    53_A      K    53_B     1.116     0    0.257   0.770     2.924   83.690   70.635
LGA    K    54_A      K    54_B     3.357     0    0.608   1.378     8.811   44.167   24.974
LGA    S    55_A      S    55_B     5.575     0    0.263   0.701     8.195   29.048   21.349
LGA    C    56_A      C    56_B     3.602     0    0.121   0.542     7.686   40.357   33.333
LGA    E    57_A      E    57_B     4.223     0    0.229   0.799    10.607   37.262   20.053
LGA    H    58_A      H    58_B     5.637     0    0.363   0.451    11.045   25.119   11.095
LGA    F    59_A      F    59_B     3.449     0    0.045   1.278     7.638   40.714   31.732
LGA    F    60_A      F    60_B     5.053     0    0.369   1.626    13.433   31.667   14.502
LGA    G    61_A      G    61_B     3.563     0    0.239   0.239     4.658   43.690   43.690
LGA    G    62_A      G    62_B     2.964     0    0.336   0.336     3.067   59.167   59.167
LGA    V    63_A      V    63_B     1.160     0    0.032   1.276     2.855   77.143   74.286
LGA    V    64_A      V    64_B     1.390     0    0.156   1.094     3.405   79.286   75.714
LGA    C    65_A      C    65_B     1.638     0    0.114   0.875     2.548   71.071   71.667
LGA    A    66_A      A    66_B     1.958     0    0.102   0.099     3.314   63.214   65.143
LGA    Q    67_A      Q    67_B     3.001     0    0.481   0.702    10.745   67.976   34.921
LGA    E    68_A      E    68_B     4.164     0    0.185   0.851     9.756   39.286   21.429
LGA    K    69_A      K    69_B     7.225     0    0.610   0.461     9.554    7.262   11.376
LGA    T    70_A      T    70_B    13.785     0    0.551   1.084    16.889    0.000    0.000
LGA    F    71_A      F    71_B    14.947     0    0.604   1.399    17.010    0.000    0.000
LGA    G    72_A      G    72_B    15.026     0    0.586   0.586    15.026    0.000    0.000
LGA    G    73_A      G    73_B    10.871     0    0.092   0.092    12.384    1.071    1.071
LGA    H    74_A      H    74_B     7.114     0    0.598   1.181     7.912    9.286   10.095
LGA    R    75_A      R    75_B     7.098     0    0.080   1.354     7.153   11.667   15.844
LGA    R    76_A      R    76_B     7.131     0    0.077   1.677    16.769   14.643    6.234
LGA    I    77_A      I    77_B     4.843     0    0.130   0.240     6.568   33.333   29.821
LGA    E    78_A      E    78_B     1.928     0    0.055   1.296     6.135   71.071   53.122
LGA    N    79_A      N    79_B     0.249     0    0.090   1.232     3.565   97.619   85.893
LGA    L    80_A      L    80_B     0.927     0    0.243   0.402     1.842   83.810   82.679
LGA    L    81_A      L    81_B     0.802     0    0.067   0.369     1.887   85.952   83.750
LGA    V    82_A      V    82_B     1.540     0    0.246   0.227     3.218   83.810   72.449
LGA    D    83_A      D    83_B     0.577     0    0.161   0.814     2.882   88.214   82.917
LGA    G    84_A      G    84_B     1.181     0    0.238   0.238     1.181   90.595   90.595
LGA    Q    85_A      Q    85_B     1.387     0    0.100   1.345     5.195   77.143   60.212
LGA    Q    86_A      Q    86_B     1.270     0    0.049   0.942     2.625   83.690   77.831
LGA    R    87_A      R    87_B     0.871     0    0.057   1.341     6.760   85.952   59.351
LGA    L    88_A      L    88_B     1.436     0    0.170   0.251     2.004   75.119   76.131

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:       76     304    304  100.00     632    632  100.00               594
SUMMARY(RMSD_GDC):     3.877          3.799                  4.955            8.079    6.983

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)   76  594    4.0     64    2.16     8.880     8.316     2.828

LGA_LOCAL      RMSD:   2.163  Number of atoms:   64  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   4.252  Number of assigned atoms:   76 
Std_ASGN_ATOMS RMSD:   3.877  Standard rmsd on all 76 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.656122 * X  +  -0.668205 * Y  +   0.350723 * Z  + -19.187241
  Y_new =   0.400042 * X  +  -0.702041 * Y  +  -0.589156 * Z  + 185.316635
  Z_new =   0.639899 * X  +  -0.246254 * Y  +   0.727934 * Z  + -195.665482 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  2.594066 -0.694367 -0.326206   [DEG:  148.6290  -39.7843  -18.6902 ]
ZXZ:  0.536955  0.755492  1.938159   [DEG:   30.7652   43.2865  111.0484 ]
 
# END of job
