
#######################################################
#                                                     #
#                        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        2.80     2.80
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    81       6_A - 86_A        1.86     2.87
  LCS_AVERAGE:     95.34

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    71      12_A - 82_A        0.99     3.14
  LCS_AVERAGE:     78.49

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      4   81   83      2    4    5    6   10   12   14   19   78   79   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     K     7_B     K     7_A      4   81   83      3    4   40   63   69   74   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     P     8_B     P     8_A     64   81   83      3    4   54   66   74   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     K     9_B     K     9_A     69   81   83      3   32   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     A    10_B     A    10_A     69   81   83      3   39   56   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     K    11_B     K    11_A     70   81   83      3   39   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     R    12_B     R    12_A     71   81   83     21   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     T    13_B     T    13_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     W    14_B     W    14_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     S    15_B     S    15_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     K    16_B     K    16_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     E    17_B     E    17_A     71   81   83     30   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     E    18_B     E    18_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     E    19_B     E    19_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     E    20_B     E    20_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     A    21_B     A    21_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     L    22_B     L    22_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     V    23_B     V    23_A     71   81   83     16   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     E    24_B     E    24_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     G    25_B     G    25_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     L    26_B     L    26_A     71   81   83     30   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     K    27_B     K    27_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     E    28_B     E    28_A     71   81   83     28   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     V    29_B     V    29_A     71   81   83     24   52   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     G    30_B     G    30_A     71   81   83      9   51   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     P    31_B     P    31_A     71   81   83      5   52   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     S    32_B     S    32_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     W    33_B     W    33_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     S    34_B     S    34_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     K    35_B     K    35_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     I    36_B     I    36_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     L    37_B     L    37_A     71   81   83      8   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     D    38_B     D    38_A     71   81   83     16   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     L    39_B     L    39_A     71   81   83     30   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     Y    40_B     Y    40_A     71   81   83     28   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     G    41_B     G    41_A     71   81   83      5   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     P    42_B     P    42_A     71   81   83      5   28   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     G    43_B     G    43_A     71   81   83      3   51   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     G    44_B     G    44_A     71   81   83      3   51   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     K    45_B     K    45_A     71   81   83     30   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     I    46_B     I    46_A     71   81   83     14   52   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     T    47_B     T    47_A     71   81   83      6   48   65   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     E    48_B     E    48_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     N    49_B     N    49_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     L    50_B     L    50_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     K    51_B     K    51_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     N    52_B     N    52_A     71   81   83     24   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     R    53_B     R    53_A     71   81   83     29   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     T    54_B     T    54_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     Q    55_B     Q    55_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     V    56_B     V    56_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     Q    57_B     Q    57_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     L    58_B     L    58_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     K    59_B     K    59_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     D    60_B     D    60_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     K    61_B     K    61_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     A    62_B     A    62_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     R    63_B     R    63_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     N    64_B     N    64_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     W    65_B     W    65_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     K    66_B     K    66_A     71   81   83     13   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     L    67_B     L    67_A     71   81   83     13   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     Q    68_B     Q    68_A     71   81   83     13   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     Y    69_B     Y    69_A     71   81   83     13   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     L    70_B     L    70_A     71   81   83     11   37   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     K    71_B     K    71_A     71   81   83     11   29   60   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     S    72_B     S    72_A     71   81   83     11   29   50   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     G    73_B     G    73_A     71   81   83     11   35   61   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     K    74_B     K    74_A     71   81   83     16   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     P    75_B     P    75_A     71   81   83     27   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     L    76_B     L    76_A     71   81   83     11   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     P    77_B     P    77_A     71   81   83     16   46   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     D    78_B     D    78_A     71   81   83     11   36   56   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     Y    79_B     Y    79_A     71   81   83     11   43   58   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     L    80_B     L    80_A     71   81   83     16   49   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     I    81_B     I    81_A     71   81   83     15   46   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     K    82_B     K    82_A     71   81   83     32   53   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     V    83_B     V    83_A     37   81   83      6   48   63   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     T    84_B     T    84_A     37   81   83     21   52   67   73   76   77   78   78   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     G    85_B     G    85_A      3   81   83      2    3    8   11   31   38   64   72   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     N    86_B     N    86_A      3   81   83      3    3    3    8   20   49   59   72   78   80   81   81   81   81   81   81   81   81   83   83 
LCS_GDT     L    87_B     L    87_A      3    4   83      3    3    3    5    5    7    8    9   21   23   39   45   51   57   61   71   81   81   83   83 
LCS_GDT     E    88_B     E    88_A      3    3   83      3    3    3    4    5    7    7   18   21   23   39   45   51   57   61   64   76   77   83   83 
LCS_AVERAGE  LCS_A:  91.28  (  78.49   95.34  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     32     53     67     73     76     77     78     78     78     80     81     81     81     81     81     81     81     81     83     83 
GDT PERCENT_AT  38.55  63.86  80.72  87.95  91.57  92.77  93.98  93.98  93.98  96.39  97.59  97.59  97.59  97.59  97.59  97.59  97.59  97.59 100.00 100.00
GDT RMS_LOCAL    0.33   0.60   0.82   0.96   1.05   1.13   1.29   1.29   1.29   1.66   1.86   1.86   1.86   1.86   1.86   1.86   1.86   1.86   2.80   2.80
GDT RMS_ALL_AT   3.02   3.07   3.08   3.12   3.15   3.09   3.02   3.02   3.02   2.92   2.87   2.87   2.87   2.87   2.87   2.87   2.87   2.87   2.80   2.80

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

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    R     6_B      R     6_A     8.688     0    0.635   1.720    13.313    3.214    1.255
LGA    K     7_B      K     7_A     5.190     0    0.130   0.973     6.622   35.238   28.836
LGA    P     8_B      P     8_A     3.081     0    0.017   0.030     5.274   62.500   51.088
LGA    K     9_B      K     9_A     1.991     0    0.090   1.114     7.800   75.000   49.630
LGA    A    10_B      A    10_A     2.676     0    0.046   0.069     3.588   55.357   52.952
LGA    K    11_B      K    11_A     1.853     0    0.065   0.997     7.344   72.976   52.751
LGA    R    12_B      R    12_A     0.769     0    0.603   0.819     7.132   75.833   58.485
LGA    T    13_B      T    13_A     0.463     0    0.173   1.118     2.512   90.595   83.469
LGA    W    14_B      W    14_A     0.246     0    0.067   0.254     1.903  100.000   88.163
LGA    S    15_B      S    15_A     0.695     0    0.020   0.058     0.855   90.476   90.476
LGA    K    16_B      K    16_A     0.855     0    0.042   1.147     4.623   90.476   79.418
LGA    E    17_B      E    17_A     1.011     0    0.011   0.759     2.972   88.214   78.942
LGA    E    18_B      E    18_A     0.607     0    0.032   0.171     1.062   90.476   90.529
LGA    E    19_B      E    19_A     0.614     0    0.013   0.212     1.446   90.476   90.529
LGA    E    20_B      E    20_A     0.848     0    0.063   0.163     1.717   88.214   84.497
LGA    A    21_B      A    21_A     0.566     0    0.029   0.034     0.632   90.476   90.476
LGA    L    22_B      L    22_A     0.548     0    0.077   0.891     2.749   92.857   84.286
LGA    V    23_B      V    23_A     0.913     0    0.022   0.060     1.476   90.476   86.599
LGA    E    24_B      E    24_A     0.794     0    0.022   0.156     1.160   92.857   88.519
LGA    G    25_B      G    25_A     0.353     0    0.093   0.093     0.540   97.619   97.619
LGA    L    26_B      L    26_A     0.578     0    0.015   0.118     1.141   92.857   89.405
LGA    K    27_B      K    27_A     0.300     0    0.071   0.587     2.014  100.000   93.968
LGA    E    28_B      E    28_A     0.687     0    0.015   0.234     1.279   90.595   87.513
LGA    V    29_B      V    29_A     0.914     0    0.053   0.080     1.331   85.952   87.891
LGA    G    30_B      G    30_A     1.241     0    0.075   0.075     1.241   83.690   83.690
LGA    P    31_B      P    31_A     1.162     0    0.107   0.134     1.723   83.690   79.048
LGA    S    32_B      S    32_A     0.070     0    0.052   0.706     2.620  100.000   92.857
LGA    W    33_B      W    33_A     0.222     0    0.043   0.307     2.576  100.000   82.755
LGA    S    34_B      S    34_A     0.346     0    0.043   0.642     1.931  100.000   93.889
LGA    K    35_B      K    35_A     0.485     0    0.029   0.656     3.002   97.619   86.190
LGA    I    36_B      I    36_A     0.400     0    0.042   0.129     0.680   97.619   97.619
LGA    L    37_B      L    37_A     0.902     0    0.093   1.379     2.897   88.214   80.833
LGA    D    38_B      D    38_A     1.017     0    0.018   0.093     1.326   85.952   83.690
LGA    L    39_B      L    39_A     0.487     0    0.059   0.260     1.116   92.857   90.536
LGA    Y    40_B      Y    40_A     0.490     0    0.046   0.161     2.474   95.238   83.254
LGA    G    41_B      G    41_A     0.961     0    0.102   0.102     1.159   85.952   85.952
LGA    P    42_B      P    42_A     1.421     0    0.027   0.288     1.828   81.429   78.980
LGA    G    43_B      G    43_A     1.344     0    0.078   0.078     1.362   81.429   81.429
LGA    G    44_B      G    44_A     1.311     0    0.206   0.206     1.824   79.286   79.286
LGA    K    45_B      K    45_A     1.029     0    0.056   0.592     3.355   85.952   72.011
LGA    I    46_B      I    46_A     1.190     0    0.481   1.284     2.691   79.524   74.405
LGA    T    47_B      T    47_A     1.650     0    0.225   1.237     4.163   68.929   61.293
LGA    E    48_B      E    48_A     0.478     0    0.144   0.409     1.479   97.619   92.698
LGA    N    49_B      N    49_A     0.291     0    0.041   0.248     1.246  100.000   92.976
LGA    L    50_B      L    50_A     0.269     0    0.018   0.111     0.357  100.000  100.000
LGA    K    51_B      K    51_A     0.325     0    0.101   0.812     3.348   97.619   81.799
LGA    N    52_B      N    52_A     0.705     0    0.009   1.111     3.091   90.476   83.155
LGA    R    53_B      R    53_A     0.502     0    0.035   0.074     0.714   92.857   91.342
LGA    T    54_B      T    54_A     0.166     0    0.035   0.067     0.214  100.000  100.000
LGA    Q    55_B      Q    55_A     0.150     0    0.022   0.306     1.704  100.000   94.868
LGA    V    56_B      V    56_A     0.186     0    0.049   0.053     0.292  100.000  100.000
LGA    Q    57_B      Q    57_A     0.277     0    0.003   0.242     1.226  100.000   96.878
LGA    L    58_B      L    58_A     0.210     0    0.008   0.237     0.842  100.000   96.429
LGA    K    59_B      K    59_A     0.137     0    0.025   0.775     5.496  100.000   79.683
LGA    D    60_B      D    60_A     0.121     0    0.032   0.792     3.292  100.000   86.964
LGA    K    61_B      K    61_A     0.088     0    0.018   0.535     1.492  100.000   94.815
LGA    A    62_B      A    62_A     0.281     0    0.011   0.014     0.386  100.000  100.000
LGA    R    63_B      R    63_A     0.409     0    0.016   0.922     4.486  100.000   78.701
LGA    N    64_B      N    64_A     0.293     0    0.019   0.168     0.453  100.000  100.000
LGA    W    65_B      W    65_A     0.248     0    0.025   1.309     5.504  100.000   72.415
LGA    K    66_B      K    66_A     0.730     0    0.041   0.105     2.290   90.595   79.894
LGA    L    67_B      L    67_A     1.162     0    0.030   0.047     1.580   83.690   81.488
LGA    Q    68_B      Q    68_A     1.125     0    0.037   0.080     1.496   81.429   81.429
LGA    Y    69_B      Y    69_A     0.867     0    0.022   0.205     1.499   85.952   85.952
LGA    L    70_B      L    70_A     1.531     0    0.035   0.127     2.159   72.976   72.917
LGA    K    71_B      K    71_A     2.278     0    0.002   1.396     5.574   64.881   60.159
LGA    S    72_B      S    72_A     2.466     0    0.004   0.059     2.657   62.857   63.492
LGA    G    73_B      G    73_A     2.155     0    0.083   0.083     2.171   66.786   66.786
LGA    K    74_B      K    74_A     0.842     0    0.006   0.970     6.165   88.214   68.624
LGA    P    75_B      P    75_A     0.797     0    0.023   0.037     1.017   90.476   89.184
LGA    L    76_B      L    76_A     1.123     0    0.030   1.283     2.890   75.119   71.131
LGA    P    77_B      P    77_A     1.853     0    0.035   0.050     2.045   72.976   75.374
LGA    D    78_B      D    78_A     2.709     0    0.012   0.257     3.087   59.048   58.155
LGA    Y    79_B      Y    79_A     2.296     0    0.152   0.227     2.436   64.762   66.786
LGA    L    80_B      L    80_A     1.471     0    0.169   0.182     1.773   75.000   80.476
LGA    I    81_B      I    81_A     1.762     0    0.042   0.668     2.655   75.000   73.155
LGA    K    82_B      K    82_A     0.393     0    0.299   0.818     3.064   92.857   83.175
LGA    V    83_B      V    83_A     1.790     0    0.634   0.613     4.008   66.071   64.422
LGA    T    84_B      T    84_A     1.028     0    0.644   1.362     5.044   64.286   53.810
LGA    G    85_B      G    85_A     6.832     0    0.604   0.604     7.060   17.024   17.024
LGA    N    86_B      N    86_A     7.212     0    0.635   1.445    11.500    5.833   12.083
LGA    L    87_B      L    87_A    14.008     0    0.032   1.096    17.517    0.000    0.000
LGA    E    88_B      E    88_A    15.998     0    0.046   1.050    20.811    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):     2.801          2.875                  3.382           81.500   76.184

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  102   83    4.0     78    1.29    85.843    91.125     5.621

LGA_LOCAL      RMSD:   1.288  Number of atoms:   78  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   3.017  Number of assigned atoms:   83 
Std_ASGN_ATOMS RMSD:   2.801  Standard rmsd on all 83 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.273844 * X  +  -0.960828 * Y  +  -0.042650 * Z  +  18.042728
  Y_new =   0.581586 * X  +  -0.130112 * Y  +  -0.803012 * Z  + -34.486191
  Z_new =   0.766008 * X  +  -0.244704 * Y  +   0.594434 * Z  +   6.945241 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  2.010859 -0.872607 -0.390517   [DEG:  115.2137  -49.9967  -22.3750 ]
ZXZ: -0.053063  0.934234  1.880004   [DEG:   -3.0403   53.5277  107.7163 ]
 
# END of job
