
#######################################################
#                                                     #
#                        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  102 (  824),  selected   83 , name one
# Molecule2: number of CA atoms   83 (  673),  selected   83 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:B  -ch2:A  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    83       6_A - 88_A        2.72     2.72
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    81       6_A - 86_A        1.84     2.79
  LCS_AVERAGE:     95.38

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    72      13_A - 84_A        1.00     3.09
  LCS_AVERAGE:     79.62

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:   83
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     R     6_B     R     6_A      3   81   83      7   17   22   32   48   58   68   77   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     K     7_B     K     7_A      4   81   83      3    3    4   39   62   71   76   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     P     8_B     P     8_A      4   81   83      3    4    5   59   67   75   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     K     9_B     K     9_A     69   81   83      3   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     A    10_B     A    10_A     69   81   83      3   11   64   69   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     K    11_B     K    11_A     69   81   83      6   42   64   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     R    12_B     R    12_A     71   81   83      6   46   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     T    13_B     T    13_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     W    14_B     W    14_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     S    15_B     S    15_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     K    16_B     K    16_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     E    17_B     E    17_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     E    18_B     E    18_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     E    19_B     E    19_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     E    20_B     E    20_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     A    21_B     A    21_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     L    22_B     L    22_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     V    23_B     V    23_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     E    24_B     E    24_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     G    25_B     G    25_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     L    26_B     L    26_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     K    27_B     K    27_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     E    28_B     E    28_A     72   81   83     33   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     V    29_B     V    29_A     72   81   83     32   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     G    30_B     G    30_A     72   81   83     17   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     P    31_B     P    31_A     72   81   83     32   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     S    32_B     S    32_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     W    33_B     W    33_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     S    34_B     S    34_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     K    35_B     K    35_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     I    36_B     I    36_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     L    37_B     L    37_A     72   81   83     12   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     D    38_B     D    38_A     72   81   83      7   46   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     L    39_B     L    39_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     Y    40_B     Y    40_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     G    41_B     G    41_A     72   81   83      4    7   64   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     P    42_B     P    42_A     72   81   83      4    7   47   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     G    43_B     G    43_A     72   81   83      3   43   64   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     G    44_B     G    44_A     72   81   83      4    5   64   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     K    45_B     K    45_A     72   81   83     13   50   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     I    46_B     I    46_A     72   81   83     21   49   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     T    47_B     T    47_A     72   81   83      3   44   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     E    48_B     E    48_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     N    49_B     N    49_A     72   81   83     33   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     L    50_B     L    50_A     72   81   83     32   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     K    51_B     K    51_A     72   81   83     31   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     N    52_B     N    52_A     72   81   83     31   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     R    53_B     R    53_A     72   81   83     31   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     T    54_B     T    54_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     Q    55_B     Q    55_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     V    56_B     V    56_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     Q    57_B     Q    57_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     L    58_B     L    58_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     K    59_B     K    59_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     D    60_B     D    60_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     K    61_B     K    61_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     A    62_B     A    62_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     R    63_B     R    63_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     N    64_B     N    64_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     W    65_B     W    65_A     72   81   83     35   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     K    66_B     K    66_A     72   81   83     18   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     L    67_B     L    67_A     72   81   83     10   51   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     Q    68_B     Q    68_A     72   81   83     15   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     Y    69_B     Y    69_A     72   81   83     28   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     L    70_B     L    70_A     72   81   83     10   39   64   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     K    71_B     K    71_A     72   81   83     10   18   58   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     S    72_B     S    72_A     72   81   83     10   25   58   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     G    73_B     G    73_A     72   81   83     10   39   62   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     K    74_B     K    74_A     72   81   83     31   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     P    75_B     P    75_A     72   81   83     31   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     L    76_B     L    76_A     72   81   83     19   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     P    77_B     P    77_A     72   81   83     16   50   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     D    78_B     D    78_A     72   81   83      8   30   59   70   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     Y    79_B     Y    79_A     72   81   83      8   47   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     L    80_B     L    80_A     72   81   83     19   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     I    81_B     I    81_A     72   81   83      4   47   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     K    82_B     K    82_A     72   81   83     33   52   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     V    83_B     V    83_A     72   81   83      6   18   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     T    84_B     T    84_A     72   81   83     21   50   65   73   76   76   77   78   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     G    85_B     G    85_A      3   81   83      3    3    7   15   43   58   63   76   80   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     N    86_B     N    86_A      3   81   83      3    4    9   15   43   58   63   75   79   81   81   81   81   81   81   82   82   82   83   83 
LCS_GDT     L    87_B     L    87_A      3    5   83      3    3    3    4    5    6    8    8   12   26   61   69   72   75   79   82   82   82   83   83 
LCS_GDT     E    88_B     E    88_A      3    5   83      3    3    3    3    5    6    8   10   12   15   17   24   36   40   79   79   81   82   83   83 
LCS_AVERAGE  LCS_A:  91.67  (  79.62   95.38  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     35     52     65     73     76     76     77     78     80     81     81     81     81     81     81     82     82     82     83     83 
GDT PERCENT_AT  42.17  62.65  78.31  87.95  91.57  91.57  92.77  93.98  96.39  97.59  97.59  97.59  97.59  97.59  97.59  98.80  98.80  98.80 100.00 100.00
GDT RMS_LOCAL    0.34   0.54   0.78   0.98   1.06   1.06   1.20   1.38   1.69   1.84   1.84   1.84   1.84   1.84   1.84   2.26   2.26   2.26   2.72   2.72
GDT RMS_ALL_AT   2.98   2.98   2.99   3.05   3.06   3.06   2.99   2.92   2.83   2.79   2.79   2.79   2.79   2.79   2.79   2.74   2.74   2.74   2.72   2.72

# Checking swapping
#   possible swapping detected:  Y    40_B      Y    40_A
#   possible swapping detected:  E    88_B      E    88_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    R     6_B      R     6_A     6.819     0    0.095   1.324    14.278   17.381    7.359
LGA    K     7_B      K     7_A     5.878     0    0.734   1.049    12.449   29.405   13.757
LGA    P     8_B      P     8_A     4.009     0    0.012   0.019     6.605   48.214   35.850
LGA    K     9_B      K     9_A     1.551     0    0.095   1.139     8.166   77.143   49.418
LGA    A    10_B      A    10_A     2.791     0    0.047   0.070     4.031   60.952   56.190
LGA    K    11_B      K    11_A     2.114     0    0.063   1.021     6.826   66.786   52.381
LGA    R    12_B      R    12_A     1.569     0    0.200   1.048     6.318   70.833   56.970
LGA    T    13_B      T    13_A     0.867     0    0.028   0.045     1.072   90.476   89.184
LGA    W    14_B      W    14_A     0.491     0    0.059   0.214     1.680   95.238   88.095
LGA    S    15_B      S    15_A     0.781     0    0.020   0.062     0.951   90.476   90.476
LGA    K    16_B      K    16_A     0.829     0    0.038   1.143     4.835   90.476   78.413
LGA    E    17_B      E    17_A     0.975     0    0.010   0.768     3.293   90.476   77.407
LGA    E    18_B      E    18_A     0.604     0    0.030   0.242     1.231   92.857   90.529
LGA    E    19_B      E    19_A     0.512     0    0.015   0.210     1.316   90.476   90.529
LGA    E    20_B      E    20_A     0.749     0    0.050   0.170     1.865   90.476   85.503
LGA    A    21_B      A    21_A     0.422     0    0.028   0.033     0.515   97.619   98.095
LGA    L    22_B      L    22_A     0.316     0    0.048   0.075     0.481  100.000  100.000
LGA    V    23_B      V    23_A     0.618     0    0.027   0.074     0.830   90.476   90.476
LGA    E    24_B      E    24_A     0.623     0    0.016   0.164     1.162   95.238   91.587
LGA    G    25_B      G    25_A     0.197     0    0.096   0.096     0.387  100.000  100.000
LGA    L    26_B      L    26_A     0.584     0    0.021   0.138     0.838   92.857   91.667
LGA    K    27_B      K    27_A     0.476     0    0.073   0.582     1.852   97.619   91.693
LGA    E    28_B      E    28_A     0.362     0    0.016   0.242     1.093   95.238   92.646
LGA    V    29_B      V    29_A     0.640     0    0.044   0.076     0.976   92.857   93.197
LGA    G    30_B      G    30_A     1.000     0    0.098   0.098     1.000   88.214   88.214
LGA    P    31_B      P    31_A     0.624     0    0.088   0.120     1.000   90.476   89.184
LGA    S    32_B      S    32_A     0.375     0    0.078   0.695     2.888  100.000   91.270
LGA    W    33_B      W    33_A     0.337     0    0.030   0.324     1.852  100.000   90.170
LGA    S    34_B      S    34_A     0.306     0    0.045   0.645     1.599  100.000   93.889
LGA    K    35_B      K    35_A     0.488     0    0.030   0.663     2.756   97.619   86.984
LGA    I    36_B      I    36_A     0.392     0    0.051   0.123     0.670   95.238   95.238
LGA    L    37_B      L    37_A     1.065     0    0.098   1.376     3.029   83.690   76.548
LGA    D    38_B      D    38_A     1.356     0    0.050   0.092     2.013   79.286   75.060
LGA    L    39_B      L    39_A     0.460     0    0.051   0.256     0.664   95.238   95.238
LGA    Y    40_B      Y    40_A     0.434     0    0.097   0.130     2.152   95.238   85.476
LGA    G    41_B      G    41_A     1.634     0    0.102   0.102     1.784   75.000   75.000
LGA    P    42_B      P    42_A     2.259     0    0.648   0.583     4.165   57.857   59.728
LGA    G    43_B      G    43_A     1.626     0    0.037   0.037     1.626   72.857   72.857
LGA    G    44_B      G    44_A     1.520     0    0.199   0.199     2.049   72.976   72.976
LGA    K    45_B      K    45_A     1.303     0    0.060   0.591     3.690   81.429   66.825
LGA    I    46_B      I    46_A     1.095     0    0.475   1.268     2.385   79.524   77.440
LGA    T    47_B      T    47_A     1.521     0    0.237   1.249     3.876   68.929   63.129
LGA    E    48_B      E    48_A     0.504     0    0.055   0.330     2.321   95.238   86.720
LGA    N    49_B      N    49_A     0.287     0    0.051   0.221     1.262   97.619   92.917
LGA    L    50_B      L    50_A     0.349     0    0.058   0.103     0.393  100.000  100.000
LGA    K    51_B      K    51_A     0.533     0    0.024   0.601     2.569   90.476   86.772
LGA    N    52_B      N    52_A     0.550     0    0.024   1.114     2.475   90.476   84.048
LGA    R    53_B      R    53_A     0.499     0    0.041   0.080     0.684   97.619   93.074
LGA    T    54_B      T    54_A     0.195     0    0.040   0.076     0.280  100.000  100.000
LGA    Q    55_B      Q    55_A     0.073     0    0.023   0.307     1.467  100.000   96.878
LGA    V    56_B      V    56_A     0.024     0    0.061   0.059     0.295  100.000  100.000
LGA    Q    57_B      Q    57_A     0.169     0    0.011   0.227     1.015  100.000   95.820
LGA    L    58_B      L    58_A     0.251     0    0.013   0.189     0.698  100.000   98.810
LGA    K    59_B      K    59_A     0.238     0    0.037   0.770     5.168  100.000   81.270
LGA    D    60_B      D    60_A     0.207     0    0.036   0.152     0.478  100.000  100.000
LGA    K    61_B      K    61_A     0.209     0    0.012   0.531     1.791  100.000   94.921
LGA    A    62_B      A    62_A     0.144     0    0.016   0.024     0.191  100.000  100.000
LGA    R    63_B      R    63_A     0.334     0    0.024   1.149     2.222  100.000   86.320
LGA    N    64_B      N    64_A     0.370     0    0.021   0.194     0.639  100.000   98.810
LGA    W    65_B      W    65_A     0.145     0    0.024   0.085     1.306  100.000   93.299
LGA    K    66_B      K    66_A     0.917     0    0.021   0.095     2.382   85.952   77.831
LGA    L    67_B      L    67_A     1.415     0    0.026   0.034     2.010   79.286   75.060
LGA    Q    68_B      Q    68_A     1.180     0    0.041   0.159     1.644   81.429   80.476
LGA    Y    69_B      Y    69_A     0.649     0    0.014   0.143     1.427   88.214   89.048
LGA    L    70_B      L    70_A     1.636     0    0.036   0.137     2.535   72.976   67.917
LGA    K    71_B      K    71_A     2.450     0    0.006   1.401     5.316   60.952   58.942
LGA    S    72_B      S    72_A     2.352     0    0.005   0.058     2.405   64.762   64.762
LGA    G    73_B      G    73_A     1.885     0    0.084   0.084     1.971   75.000   75.000
LGA    K    74_B      K    74_A     0.481     0    0.010   0.979     5.818   95.238   74.921
LGA    P    75_B      P    75_A     1.214     0    0.017   0.035     1.521   83.690   81.497
LGA    L    76_B      L    76_A     1.300     0    0.023   1.277     3.029   75.119   69.167
LGA    P    77_B      P    77_A     1.897     0    0.035   0.050     2.060   70.833   74.150
LGA    D    78_B      D    78_A     2.776     0    0.008   0.253     3.275   59.048   55.417
LGA    Y    79_B      Y    79_A     1.873     0    0.170   0.203     2.133   70.833   74.325
LGA    L    80_B      L    80_A     1.234     0    0.151   0.176     1.704   79.286   83.750
LGA    I    81_B      I    81_A     1.890     0    0.055   0.700     2.800   75.000   70.060
LGA    K    82_B      K    82_A     0.631     0    0.256   0.794     2.840   90.476   81.958
LGA    V    83_B      V    83_A     1.610     0    0.628   0.607     3.869   67.619   68.707
LGA    T    84_B      T    84_A     0.964     0    0.662   1.337     5.003   68.095   55.102
LGA    G    85_B      G    85_A     6.338     0    0.252   0.252     6.338   28.214   28.214
LGA    N    86_B      N    86_A     7.274     0    0.446   1.121     9.214    6.071   23.512
LGA    L    87_B      L    87_A    13.110     0    0.317   1.294    16.684    0.000    0.000
LGA    E    88_B      E    88_A    15.654     0    0.009   1.354    18.657    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:       83     332    332  100.00     673    673  100.00                83
SUMMARY(RMSD_GDC):     2.720          2.740                  3.293           81.285   76.941

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  102   83    4.0     78    1.38    85.843    90.935     5.257

LGA_LOCAL      RMSD:   1.384  Number of atoms:   78  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   2.916  Number of assigned atoms:   83 
Std_ASGN_ATOMS RMSD:   2.720  Standard rmsd on all 83 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.880311 * X  +   0.144285 * Y  +   0.451922 * Z  +  10.494683
  Y_new =   0.441866 * X  +  -0.097302 * Y  +   0.891789 * Z  + -32.354610
  Z_new =   0.172644 * X  +   0.984741 * Y  +   0.021901 * Z  +  -0.432423 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  2.676392 -0.173514  1.548559   [DEG:  153.3460   -9.9416   88.7259 ]
ZXZ:  2.672552  1.548893  0.173556   [DEG:  153.1260   88.7450    9.9440 ]
 
# END of job
