
#######################################################
#                                                     #
#                        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   89 (  636),  selected   89 , name one
# Molecule2: number of CA atoms   89 (  636),  selected   89 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:A  -ch2:A  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    89       1_A - 89_A        1.66     1.66
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    89       1_A - 89_A        1.66     1.66
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    87       2_A - 88_A        0.95     1.67
  LONGEST_CONTINUOUS_SEGMENT:    87       3_A - 89_A        0.88     1.70
  LCS_AVERAGE:     96.69

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:   89
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     1_A     G     1_A      3   89   89      0    3    3    5    6    7   10   12   13   14   37   40   51   59   88   88   89   89   89   89 
LCS_GDT     S     2_A     S     2_A     87   89   89      1    3    3    8   12   26   41   84   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     A     3_A     A     3_A     87   89   89      3   75   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     D     4_A     D     4_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     L     5_A     L     5_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     A     6_A     A     6_A     87   89   89     55   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     H     7_A     H     7_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     G     8_A     G     8_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     G     9_A     G     9_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     Q    10_A     Q    10_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     V    11_A     V    11_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     F    12_A     F    12_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     S    13_A     S    13_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     A    14_A     A    14_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     N    15_A     N    15_A     87   89   89     62   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     C    16_A     C    16_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     A    17_A     A    17_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     A    18_A     A    18_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     C    19_A     C    19_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     H    20_A     H    20_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     L    21_A     L    21_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     G    22_A     G    22_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     G    23_A     G    23_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     R    24_A     R    24_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     N    25_A     N    25_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     V    26_A     V    26_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     V    27_A     V    27_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     N    28_A     N    28_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     P    29_A     P    29_A     87   89   89     60   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     A    30_A     A    30_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     K    31_A     K    31_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     T    32_A     T    32_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     L    33_A     L    33_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     Q    34_A     Q    34_A     87   89   89     59   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     K    35_A     K    35_A     87   89   89     59   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     A    36_A     A    36_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     D    37_A     D    37_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     L    38_A     L    38_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     D    39_A     D    39_A     87   89   89     36   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     Q    40_A     Q    40_A     87   89   89     36   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     Y    41_A     Y    41_A     87   89   89     21   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     G    42_A     G    42_A     87   89   89     26   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     M    43_A     M    43_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     A    44_A     A    44_A     87   89   89     23   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     S    45_A     S    45_A     87   89   89     59   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     I    46_A     I    46_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     E    47_A     E    47_A     87   89   89     56   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     A    48_A     A    48_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     I    49_A     I    49_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     T    50_A     T    50_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     T    51_A     T    51_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     Q    52_A     Q    52_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     V    53_A     V    53_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     T    54_A     T    54_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     N    55_A     N    55_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     G    56_A     G    56_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     K    57_A     K    57_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     G    58_A     G    58_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     A    59_A     A    59_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     M    60_A     M    60_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     P    61_A     P    61_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     A    62_A     A    62_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     F    63_A     F    63_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     G    64_A     G    64_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     S    65_A     S    65_A     87   89   89     39   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     K    66_A     K    66_A     87   89   89     57   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     L    67_A     L    67_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     S    68_A     S    68_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     A    69_A     A    69_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     D    70_A     D    70_A     87   89   89     54   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     D    71_A     D    71_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     I    72_A     I    72_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     A    73_A     A    73_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     D    74_A     D    74_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     V    75_A     V    75_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     A    76_A     A    76_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     S    77_A     S    77_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     Y    78_A     Y    78_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     V    79_A     V    79_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     L    80_A     L    80_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     D    81_A     D    81_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     Q    82_A     Q    82_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     S    83_A     S    83_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     E    84_A     E    84_A     87   89   89     26   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     K    85_A     K    85_A     87   89   89      5   82   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     G    86_A     G    86_A     87   89   89      5   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     W    87_A     W    87_A     87   89   89     64   83   85   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     Q    88_A     Q    88_A     87   89   89     10   28   49   85   86   86   86   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_GDT     G    89_A     G    89_A     87   89   89      3    3    3    4   34   42   54   87   87   87   87   88   88   88   88   88   89   89   89   89 
LCS_AVERAGE  LCS_A:  98.90  (  96.69  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     64     83     85     85     86     86     86     87     87     87     87     88     88     88     88     88     89     89     89     89 
GDT PERCENT_AT  71.91  93.26  95.51  95.51  96.63  96.63  96.63  97.75  97.75  97.75  97.75  98.88  98.88  98.88  98.88  98.88 100.00 100.00 100.00 100.00
GDT RMS_LOCAL    0.31   0.44   0.48   0.48   0.58   0.58   0.58   0.88   0.88   0.88   0.88   1.16   1.16   1.16   1.16   1.16   1.66   1.66   1.66   1.66
GDT RMS_ALL_AT   1.69   1.70   1.69   1.69   1.69   1.69   1.69   1.70   1.70   1.70   1.70   1.68   1.68   1.68   1.68   1.68   1.66   1.66   1.66   1.66

# Checking swapping
#   possible swapping detected:  F    12_A      F    12_A
#   possible swapping detected:  E    47_A      E    47_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    G     1_A      G     1_A    11.744     0    0.102   0.102    12.623    2.143    2.143
LGA    S     2_A      S     2_A     7.288     0    0.593   0.818     9.393   17.619   12.222
LGA    A     3_A      A     3_A     1.559     0    0.535   0.548     3.559   69.762   72.095
LGA    D     4_A      D     4_A     0.374     0    0.060   0.324     1.062  100.000   97.679
LGA    L     5_A      L     5_A     0.257     0    0.036   1.418     3.495  100.000   83.095
LGA    A     6_A      A     6_A     0.544     0    0.033   0.038     0.910   97.619   96.190
LGA    H     7_A      H     7_A     0.310     0    0.023   0.306     0.995  100.000   97.143
LGA    G     8_A      G     8_A     0.235     0    0.028   0.028     0.292  100.000  100.000
LGA    G     9_A      G     9_A     0.353     0    0.047   0.047     0.355  100.000  100.000
LGA    Q    10_A      Q    10_A     0.251     0    0.029   1.191     4.721  100.000   77.302
LGA    V    11_A      V    11_A     0.298     0    0.020   0.089     0.598  100.000   98.639
LGA    F    12_A      F    12_A     0.182     0    0.024   0.098     0.302  100.000  100.000
LGA    S    13_A      S    13_A     0.179     0    0.034   0.674     2.199  100.000   94.127
LGA    A    14_A      A    14_A     0.405     0    0.117   0.118     1.020   92.976   94.381
LGA    N    15_A      N    15_A     0.497     0    0.147   1.065     2.379   92.976   87.500
LGA    C    16_A      C    16_A     0.188     0    0.022   0.152     0.454  100.000  100.000
LGA    A    17_A      A    17_A     0.514     0    0.078   0.073     0.912   97.619   96.190
LGA    A    18_A      A    18_A     0.417     0    0.089   0.086     0.655  100.000   98.095
LGA    C    19_A      C    19_A     0.451     0    0.099   0.098     0.749   95.238   95.238
LGA    H    20_A      H    20_A     0.364     0    0.098   0.188     0.590   95.238   98.095
LGA    L    21_A      L    21_A     0.524     0    0.010   1.197     4.649   90.476   76.905
LGA    G    22_A      G    22_A     0.729     0    0.055   0.055     0.729   90.476   90.476
LGA    G    23_A      G    23_A     0.414     0    0.040   0.040     0.587   97.619   97.619
LGA    R    24_A      R    24_A     0.316     0    0.052   1.173     7.000   97.619   68.701
LGA    N    25_A      N    25_A     0.306     0    0.088   0.886     2.864  100.000   87.738
LGA    V    26_A      V    26_A     0.765     0    0.067   0.090     1.107   88.214   85.306
LGA    V    27_A      V    27_A     0.719     0    0.065   1.100     2.952   90.476   83.197
LGA    N    28_A      N    28_A     0.638     0    0.030   1.335     4.452   90.476   76.429
LGA    P    29_A      P    29_A     0.731     0    0.103   0.111     1.211   90.476   89.184
LGA    A    30_A      A    30_A     0.308     0    0.148   0.147     1.288   92.976   94.381
LGA    K    31_A      K    31_A     0.181     0    0.085   0.143     1.837  100.000   91.746
LGA    T    32_A      T    32_A     0.290     0    0.033   0.041     0.394  100.000  100.000
LGA    L    33_A      L    33_A     0.262     0    0.078   0.211     1.115  100.000   94.107
LGA    Q    34_A      Q    34_A     0.431     0    0.029   0.623     3.429  100.000   86.243
LGA    K    35_A      K    35_A     0.505     0    0.022   0.686     2.401   97.619   88.783
LGA    A    36_A      A    36_A     0.198     0    0.050   0.049     0.304  100.000  100.000
LGA    D    37_A      D    37_A     0.266     0    0.025   0.261     0.916  100.000   98.810
LGA    L    38_A      L    38_A     0.377     0    0.041   0.063     0.831   95.238   96.429
LGA    D    39_A      D    39_A     0.780     0    0.026   0.244     1.288   90.476   89.345
LGA    Q    40_A      Q    40_A     0.777     0    0.033   1.048     4.030   90.476   80.635
LGA    Y    41_A      Y    41_A     0.770     0    0.174   0.308     1.746   90.476   84.563
LGA    G    42_A      G    42_A     0.640     0    0.124   0.124     0.640   95.238   95.238
LGA    M    43_A      M    43_A     0.321     0    0.106   1.057     2.262   92.857   85.238
LGA    A    44_A      A    44_A     0.775     0    0.146   0.144     1.500   86.071   86.952
LGA    S    45_A      S    45_A     0.529     0    0.045   0.565     1.513   97.619   92.302
LGA    I    46_A      I    46_A     0.509     0    0.042   1.555     3.778   97.619   79.881
LGA    E    47_A      E    47_A     0.668     0    0.058   1.317     6.650   92.857   64.339
LGA    A    48_A      A    48_A     0.386     0    0.023   0.042     0.416  100.000  100.000
LGA    I    49_A      I    49_A     0.429     0    0.022   0.073     0.429  100.000  100.000
LGA    T    50_A      T    50_A     0.451     0    0.039   0.064     0.766  100.000   95.918
LGA    T    51_A      T    51_A     0.335     0    0.023   0.935     2.209  100.000   89.932
LGA    Q    52_A      Q    52_A     0.310     0    0.041   1.200     3.698  100.000   84.709
LGA    V    53_A      V    53_A     0.336     0    0.032   0.093     0.658  100.000   98.639
LGA    T    54_A      T    54_A     0.178     0    0.023   0.927     2.056  100.000   91.088
LGA    N    55_A      N    55_A     0.593     0    0.112   0.145     1.031   92.857   90.536
LGA    G    56_A      G    56_A     0.530     0    0.043   0.043     0.681   95.238   95.238
LGA    K    57_A      K    57_A     0.307     0    0.022   0.206     1.045  100.000   96.878
LGA    G    58_A      G    58_A     0.512     0    0.036   0.036     0.512   97.619   97.619
LGA    A    59_A      A    59_A     0.320     0    0.129   0.127     0.739   97.619   96.190
LGA    M    60_A      M    60_A     0.448     0    0.024   0.192     1.118  100.000   94.107
LGA    P    61_A      P    61_A     0.473     0    0.047   0.240     1.054   97.619   94.626
LGA    A    62_A      A    62_A     0.484     0    0.063   0.086     1.033   92.976   92.476
LGA    F    63_A      F    63_A     0.283     0    0.102   0.198     0.701  100.000   94.805
LGA    G    64_A      G    64_A     0.391     0    0.071   0.071     0.990   95.238   95.238
LGA    S    65_A      S    65_A     0.807     0    0.143   0.152     1.671   92.857   87.619
LGA    K    66_A      K    66_A     0.568     0    0.126   1.004     2.968   95.238   82.222
LGA    L    67_A      L    67_A     0.479     0    0.027   0.960     2.547   92.857   86.667
LGA    S    68_A      S    68_A     0.499     0    0.058   0.063     0.674  100.000   96.825
LGA    A    69_A      A    69_A     0.395     0    0.030   0.039     0.605  100.000   98.095
LGA    D    70_A      D    70_A     0.689     0    0.060   0.224     2.321   95.238   84.107
LGA    D    71_A      D    71_A     0.223     0    0.022   0.179     0.935  100.000   98.810
LGA    I    72_A      I    72_A     0.092     0    0.020   0.100     0.517  100.000   98.810
LGA    A    73_A      A    73_A     0.184     0    0.028   0.050     0.265  100.000  100.000
LGA    D    74_A      D    74_A     0.117     0    0.019   0.351     0.853  100.000   97.619
LGA    V    75_A      V    75_A     0.068     0    0.023   0.094     0.353  100.000  100.000
LGA    A    76_A      A    76_A     0.085     0    0.026   0.039     0.133  100.000  100.000
LGA    S    77_A      S    77_A     0.130     0    0.036   0.668     2.375  100.000   94.127
LGA    Y    78_A      Y    78_A     0.085     0    0.031   0.056     0.185  100.000  100.000
LGA    V    79_A      V    79_A     0.176     0    0.037   1.181     2.512  100.000   88.844
LGA    L    80_A      L    80_A     0.290     0    0.023   1.174     2.886  100.000   90.238
LGA    D    81_A      D    81_A     0.353     0    0.031   0.256     0.872  100.000   96.429
LGA    Q    82_A      Q    82_A     0.165     0    0.026   1.063     2.845  100.000   91.164
LGA    S    83_A      S    83_A     0.373     0    0.037   0.589     2.512  100.000   91.270
LGA    E    84_A      E    84_A     1.048     0    0.045   0.229     3.026   83.690   72.434
LGA    K    85_A      K    85_A     1.441     0    0.038   0.601     4.529   79.286   66.243
LGA    G    86_A      G    86_A     1.105     0    0.474   0.474     3.319   75.833   75.833
LGA    W    87_A      W    87_A     0.321     0    0.527   0.449     1.904   90.833   97.381
LGA    Q    88_A      Q    88_A     2.717     0    0.072   0.629     6.397   46.310   38.677
LGA    G    89_A      G    89_A     6.077     0    0.165   0.165    10.540   12.857   12.857

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:       89     356    356  100.00     636    636  100.00                89
SUMMARY(RMSD_GDC):     1.662          1.689                  1.805           92.705   87.853

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)   89   89    4.0     87    0.88    96.348    97.635     8.897

LGA_LOCAL      RMSD:   0.878  Number of atoms:   87  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   1.703  Number of assigned atoms:   89 
Std_ASGN_ATOMS RMSD:   1.662  Standard rmsd on all 89 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.240839 * X  +  -0.294209 * Y  +  -0.924899 * Z  +  34.285030
  Y_new =   0.425590 * X  +   0.824433 * Y  +  -0.373072 * Z  +  -9.358822
  Z_new =   0.872278 * X  +  -0.483478 * Y  +  -0.073343 * Z  + -53.080803 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  2.085760 -1.059842 -1.721348   [DEG:  119.5053  -60.7245  -98.6260 ]
ZXZ: -1.187392  1.644205  2.076913   [DEG:  -68.0325   94.2060  118.9983 ]
 
# END of job
