
#######################################################
#                                                     #
#                        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   83 (  654),  selected   81 , name one
# Molecule2: number of CA atoms   81 (  640),  selected   81 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:B  -ch2:B  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    81       3_B - 83_B        1.50     1.50
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    81       3_B - 83_B        1.50     1.50
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    79       5_B - 83_B        0.95     1.56
  LCS_AVERAGE:     95.24

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:   81
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     G     3_B     G     3_B      4   81   81      3    4    5    7   20   32   37   75   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     M     4_B     M     4_B      4   81   81      3    4    5    7   11   30   36   76   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     E     5_B     E     5_B     79   81   81     20   55   71   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     K     6_B     K     6_B     79   81   81     20   56   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     V     7_B     V     7_B     79   81   81     24   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     T     8_B     T     8_B     79   81   81     25   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     V     9_B     V     9_B     79   81   81     25   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     V    10_B     V    10_B     79   81   81     20   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     L    11_B     L    11_B     79   81   81     24   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     Y    12_B     Y    12_B     79   81   81     24   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     V    13_B     V    13_B     79   81   81     19   56   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     N    14_B     N    14_B     79   81   81      5   56   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     G    15_B     G    15_B     79   81   81     20   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     D    16_B     D    16_B     79   81   81     14   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     E    17_B     E    17_B     79   81   81     27   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     V    18_B     V    18_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     A    19_B     A    19_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     L    20_B     L    20_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     V    21_B     V    21_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     H    22_B     H    22_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     A    23_B     A    23_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     F    24_B     F    24_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     M    25_B     M    25_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     T    26_B     T    26_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     T    27_B     T    27_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     A    28_B     A    28_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     S    29_B     S    29_B     79   81   81     26   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     L    30_B     L    30_B     79   81   81     30   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     L    31_B     L    31_B     79   81   81     32   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     A    32_B     A    32_B     79   81   81     30   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     K    33_B     K    33_B     79   81   81     23   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     E    34_B     E    34_B     79   81   81     24   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     G    35_B     G    35_B     79   81   81      6   56   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     K    36_B     K    36_B     79   81   81     14   56   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     L    37_B     L    37_B     79   81   81     14   48   70   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     V    38_B     V    38_B     79   81   81     19   56   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     E    39_B     E    39_B     79   81   81     21   56   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     K    40_B     K    40_B     79   81   81     24   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     L    41_B     L    41_B     79   81   81     30   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     I    42_B     I    42_B     79   81   81     25   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     L    43_B     L    43_B     79   81   81     25   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     T    44_B     T    44_B     79   81   81     16   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     S    45_B     S    45_B     79   81   81      4   39   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     N    46_B     N    46_B     79   81   81      7   49   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     F    47_B     F    47_B     79   81   81     18   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     T    48_B     T    48_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     E    49_B     E    49_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     R    50_B     R    50_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     T    51_B     T    51_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     V    52_B     V    52_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     R    53_B     R    53_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     R    54_B     R    54_B     79   81   81     33   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     A    55_B     A    55_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     F    56_B     F    56_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     D    57_B     D    57_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     L    58_B     L    58_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     V    59_B     V    59_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     R    60_B     R    60_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     E    61_B     E    61_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     L    62_B     L    62_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     L    63_B     L    63_B     79   81   81     14   56   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     P    64_B     P    64_B     79   81   81     14   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     A    65_B     A    65_B     79   81   81     14   53   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     K    66_B     K    66_B     79   81   81     14   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     A    67_B     A    67_B     79   81   81      8   53   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     E    68_B     E    68_B     79   81   81      8   53   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     I    69_B     I    69_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     I    70_B     I    70_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     D    71_B     D    71_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     A    72_B     A    72_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     L    73_B     L    73_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     R    74_B     R    74_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     E    75_B     E    75_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     E    76_B     E    76_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     A    77_B     A    77_B     79   81   81     34   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     E    78_B     E    78_B     79   81   81      8   57   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     K    79_B     K    79_B     79   81   81     18   53   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     Y    80_B     Y    80_B     79   81   81     18   49   69   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     F    81_B     F    81_B     79   81   81     18   53   72   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     A    82_B     A    82_B     79   81   81      5   53   69   78   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_GDT     E    83_B     E    83_B     79   81   81      3   14   66   77   79   79   79   79   81   81   81   81   81   81   81   81   81   81   81   81 
LCS_AVERAGE  LCS_A:  98.41  (  95.24  100.00  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     34     57     72     78     79     79     79     79     81     81     81     81     81     81     81     81     81     81     81     81 
GDT PERCENT_AT  41.98  70.37  88.89  96.30  97.53  97.53  97.53  97.53 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00
GDT RMS_LOCAL    0.32   0.61   0.80   0.91   0.95   0.95   0.95   0.95   1.50   1.50   1.50   1.50   1.50   1.50   1.50   1.50   1.50   1.50   1.50   1.50
GDT RMS_ALL_AT   1.84   1.59   1.57   1.55   1.56   1.56   1.56   1.56   1.50   1.50   1.50   1.50   1.50   1.50   1.50   1.50   1.50   1.50   1.50   1.50

# Checking swapping
#   possible swapping detected:  Y    12_B      Y    12_B
#   possible swapping detected:  E    17_B      E    17_B
#   possible swapping detected:  E    39_B      E    39_B
#   possible swapping detected:  E    49_B      E    49_B
#   possible swapping detected:  D    57_B      D    57_B
#   possible swapping detected:  D    71_B      D    71_B
#   possible swapping detected:  E    75_B      E    75_B
#   possible swapping detected:  E    76_B      E    76_B
#   possible swapping detected:  Y    80_B      Y    80_B

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    G     3_B      G     3_B     8.144     0    0.459   0.459     9.130   11.429   11.429
LGA    M     4_B      M     4_B     7.664     0    0.028   0.999    16.874   13.690    6.905
LGA    E     5_B      E     5_B     1.724     0    0.344   1.135     7.057   65.476   52.275
LGA    K     6_B      K     6_B     1.522     0    0.014   0.369     3.224   77.143   69.577
LGA    V     7_B      V     7_B     0.978     0    0.072   0.139     1.130   88.214   87.891
LGA    T     8_B      T     8_B     0.778     0    0.015   0.054     1.135   88.214   89.184
LGA    V     9_B      V     9_B     0.781     0    0.041   0.143     1.186   90.476   89.184
LGA    V    10_B      V    10_B     0.829     0    0.064   0.068     1.151   90.476   87.891
LGA    L    11_B      L    11_B     0.659     0    0.076   1.015     3.457   90.476   78.988
LGA    Y    12_B      Y    12_B     0.919     0    0.017   1.349     9.704   90.476   51.627
LGA    V    13_B      V    13_B     1.071     0    0.023   0.278     1.765   81.429   80.204
LGA    N    14_B      N    14_B     1.139     0    0.088   0.312     2.833   81.429   73.155
LGA    G    15_B      G    15_B     0.800     0    0.083   0.083     0.843   95.238   95.238
LGA    D    16_B      D    16_B     0.890     0    0.099   0.321     1.768   90.476   86.012
LGA    E    17_B      E    17_B     0.561     0    0.018   0.925     3.816   95.238   73.122
LGA    V    18_B      V    18_B     0.248     0    0.076   0.928     2.046  100.000   89.932
LGA    A    19_B      A    19_B     0.295     0    0.116   0.131     0.339  100.000  100.000
LGA    L    20_B      L    20_B     0.450     0    0.045   0.192     0.688  100.000   96.429
LGA    V    21_B      V    21_B     0.449     0    0.070   1.040     2.724   97.619   87.279
LGA    H    22_B      H    22_B     0.241     0    0.025   0.510     1.078  100.000   94.381
LGA    A    23_B      A    23_B     0.502     0    0.035   0.046     0.618   95.238   94.286
LGA    F    24_B      F    24_B     0.561     0    0.046   0.117     1.111   92.857   88.874
LGA    M    25_B      M    25_B     0.406     0    0.016   0.560     1.526  100.000   93.095
LGA    T    26_B      T    26_B     0.268     0    0.051   0.213     0.735  100.000   97.279
LGA    T    27_B      T    27_B     0.441     0    0.041   0.164     1.087  100.000   94.626
LGA    A    28_B      A    28_B     0.518     0    0.009   0.018     0.722   95.238   94.286
LGA    S    29_B      S    29_B     0.473     0    0.020   0.056     0.670   97.619   95.238
LGA    L    30_B      L    30_B     0.446     0    0.042   1.207     3.200   97.619   86.964
LGA    L    31_B      L    31_B     0.420     0    0.110   1.117     2.821   97.619   88.869
LGA    A    32_B      A    32_B     0.226     0    0.013   0.020     0.664   95.238   96.190
LGA    K    33_B      K    33_B     1.104     0    0.047   0.899     4.226   81.548   73.862
LGA    E    34_B      E    34_B     1.093     0    0.048   0.337     2.215   83.690   81.587
LGA    G    35_B      G    35_B     1.255     0    0.038   0.038     1.255   83.690   83.690
LGA    K    36_B      K    36_B     1.371     0    0.067   0.254     1.806   77.143   80.582
LGA    L    37_B      L    37_B     1.911     0    0.036   0.280     3.593   75.000   63.512
LGA    V    38_B      V    38_B     1.281     0    0.060   0.105     1.715   77.143   82.857
LGA    E    39_B      E    39_B     1.470     0    0.051   0.590     1.889   81.429   81.534
LGA    K    40_B      K    40_B     0.956     0    0.010   0.259     2.277   88.214   80.688
LGA    L    41_B      L    41_B     0.590     0    0.032   0.943     3.083   90.476   84.286
LGA    I    42_B      I    42_B     0.773     0    0.016   0.034     0.845   90.476   90.476
LGA    L    43_B      L    43_B     0.728     0    0.029   1.001     2.756   90.476   82.976
LGA    T    44_B      T    44_B     0.778     0    0.176   0.180     1.684   90.595   85.442
LGA    S    45_B      S    45_B     1.119     0    0.042   0.069     1.889   88.214   83.095
LGA    N    46_B      N    46_B     1.456     0    0.322   0.967     7.120   85.952   57.738
LGA    F    47_B      F    47_B     0.930     0    0.059   0.419     1.195   88.214   88.918
LGA    T    48_B      T    48_B     0.463     0    0.044   0.193     0.785   95.238   95.918
LGA    E    49_B      E    49_B     0.303     0    0.022   0.753     4.666   97.619   76.455
LGA    R    50_B      R    50_B     0.462     0    0.016   1.238     4.227   97.619   80.952
LGA    T    51_B      T    51_B     0.499     0    0.062   0.089     0.660   95.238   94.558
LGA    V    52_B      V    52_B     0.173     0    0.039   0.098     0.585  100.000   97.279
LGA    R    53_B      R    53_B     0.344     0    0.032   0.990     5.023   95.238   75.584
LGA    R    54_B      R    54_B     0.722     0    0.021   1.456     5.099   90.476   64.848
LGA    A    55_B      A    55_B     0.266     0    0.024   0.029     0.467  100.000  100.000
LGA    F    56_B      F    56_B     0.397     0    0.071   0.133     0.933  100.000   96.537
LGA    D    57_B      D    57_B     0.647     0    0.075   0.219     1.289   90.476   89.345
LGA    L    58_B      L    58_B     0.349     0    0.055   0.773     2.957  100.000   87.857
LGA    V    59_B      V    59_B     0.122     0    0.020   0.258     0.521  100.000   97.279
LGA    R    60_B      R    60_B     0.495     0    0.020   1.282     5.712   95.238   69.524
LGA    E    61_B      E    61_B     0.637     0    0.032   0.984     3.222   90.476   76.561
LGA    L    62_B      L    62_B     0.961     0    0.040   0.109     1.403   85.952   83.690
LGA    L    63_B      L    63_B     1.131     0    0.104   1.296     2.802   81.429   77.440
LGA    P    64_B      P    64_B     1.009     0    0.056   0.272     1.478   81.429   82.721
LGA    A    65_B      A    65_B     1.322     0    0.095   0.091     1.425   83.690   83.238
LGA    K    66_B      K    66_B     1.002     0    0.013   0.606     1.501   83.690   83.492
LGA    A    67_B      A    67_B     1.302     0    0.053   0.057     1.557   81.429   79.714
LGA    E    68_B      E    68_B     1.570     0    0.027   1.274     7.329   79.286   52.857
LGA    I    69_B      I    69_B     0.923     0    0.026   0.146     1.144   88.214   89.345
LGA    I    70_B      I    70_B     0.603     0    0.010   0.685     1.807   95.238   91.845
LGA    D    71_B      D    71_B     0.351     0    0.026   0.410     1.120  100.000   96.488
LGA    A    72_B      A    72_B     0.736     0    0.022   0.023     0.859   90.476   90.476
LGA    L    73_B      L    73_B     0.607     0    0.040   0.148     0.961   90.476   92.857
LGA    R    74_B      R    74_B     0.706     0    0.057   0.338     2.596   90.476   82.641
LGA    E    75_B      E    75_B     0.545     0    0.115   0.727     3.591   88.214   71.534
LGA    E    76_B      E    76_B     0.790     0    0.059   0.348     1.810   90.476   85.503
LGA    A    77_B      A    77_B     0.782     0    0.011   0.011     0.838   90.476   90.476
LGA    E    78_B      E    78_B     0.899     0    0.052   0.704     3.409   85.952   70.476
LGA    K    79_B      K    79_B     1.327     0    0.064   0.653     1.898   77.143   77.619
LGA    Y    80_B      Y    80_B     1.699     0    0.105   0.103     2.074   72.857   71.508
LGA    F    81_B      F    81_B     1.498     0    0.055   0.199     1.870   77.143   81.558
LGA    A    82_B      A    82_B     1.846     0    0.035   0.034     2.296   68.810   69.619
LGA    E    83_B      E    83_B     2.423     0    0.400   1.246     5.991   48.571   42.434

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:       81     324    324  100.00     640    640  100.00                81
SUMMARY(RMSD_GDC):     1.502          1.480                  2.208           87.287   81.258

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)   83   81    4.0     79    0.95    91.049    95.988     7.540

LGA_LOCAL      RMSD:   0.948  Number of atoms:   79  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   1.556  Number of assigned atoms:   81 
Std_ASGN_ATOMS RMSD:   1.502  Standard rmsd on all 81 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.783964 * X  +   0.609821 * Y  +   0.116271 * Z  +  30.027630
  Y_new =  -0.612661 * X  +   0.729746 * Y  +   0.303507 * Z  +   8.282683
  Z_new =   0.100237 * X  +  -0.309173 * Y  +   0.945708 * Z  +  -8.805099 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -0.663353 -0.100406 -0.315970   [DEG:  -38.0073   -5.7528  -18.1037 ]
ZXZ:  2.775748  0.331029  2.828075   [DEG:  159.0387   18.9666  162.0368 ]
 
# END of job
