
#######################################################
#                                                     #
#                        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        0.77     0.77
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    89       1_A - 89_A        0.77     0.77
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    89       1_A - 89_A        0.77     0.77
  LCS_AVERAGE:    100.00

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     89   89   89      3   12   27   68   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     S     2_A     S     2_A     89   89   89      3    4   10   32   56   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     A     3_A     A     3_A     89   89   89     15   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     D     4_A     D     4_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     L     5_A     L     5_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     A     6_A     A     6_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     H     7_A     H     7_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     G     8_A     G     8_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     G     9_A     G     9_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     Q    10_A     Q    10_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     V    11_A     V    11_A     89   89   89     62   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     F    12_A     F    12_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     S    13_A     S    13_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     A    14_A     A    14_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     N    15_A     N    15_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     C    16_A     C    16_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     A    17_A     A    17_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     A    18_A     A    18_A     89   89   89     57   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     C    19_A     C    19_A     89   89   89     54   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     H    20_A     H    20_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     L    21_A     L    21_A     89   89   89     50   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     G    22_A     G    22_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     G    23_A     G    23_A     89   89   89     57   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     R    24_A     R    24_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     N    25_A     N    25_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     V    26_A     V    26_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     V    27_A     V    27_A     89   89   89     60   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     N    28_A     N    28_A     89   89   89     57   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     P    29_A     P    29_A     89   89   89     60   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     A    30_A     A    30_A     89   89   89     60   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     K    31_A     K    31_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     T    32_A     T    32_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     L    33_A     L    33_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     Q    34_A     Q    34_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     K    35_A     K    35_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     A    36_A     A    36_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     D    37_A     D    37_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     L    38_A     L    38_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     D    39_A     D    39_A     89   89   89     58   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     Q    40_A     Q    40_A     89   89   89     58   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     Y    41_A     Y    41_A     89   89   89     12   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     G    42_A     G    42_A     89   89   89     27   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     M    43_A     M    43_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     A    44_A     A    44_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     S    45_A     S    45_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     I    46_A     I    46_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     E    47_A     E    47_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     A    48_A     A    48_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     I    49_A     I    49_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     T    50_A     T    50_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     T    51_A     T    51_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     Q    52_A     Q    52_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     V    53_A     V    53_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     T    54_A     T    54_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     N    55_A     N    55_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     G    56_A     G    56_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     K    57_A     K    57_A     89   89   89     53   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     G    58_A     G    58_A     89   89   89     20   80   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     A    59_A     A    59_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     M    60_A     M    60_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     P    61_A     P    61_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     A    62_A     A    62_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     F    63_A     F    63_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     G    64_A     G    64_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     S    65_A     S    65_A     89   89   89     60   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     K    66_A     K    66_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     L    67_A     L    67_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     S    68_A     S    68_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     A    69_A     A    69_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     D    70_A     D    70_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     D    71_A     D    71_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     I    72_A     I    72_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     A    73_A     A    73_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     D    74_A     D    74_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     V    75_A     V    75_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     A    76_A     A    76_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     S    77_A     S    77_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     Y    78_A     Y    78_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     V    79_A     V    79_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     L    80_A     L    80_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     D    81_A     D    81_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     Q    82_A     Q    82_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     S    83_A     S    83_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     E    84_A     E    84_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     K    85_A     K    85_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     G    86_A     G    86_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     W    87_A     W    87_A     89   89   89     63   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     Q    88_A     Q    88_A     89   89   89     42   85   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_GDT     G    89_A     G    89_A     89   89   89      2   47   87   87   88   89   89   89   89   89   89   89   89   89   89   89   89   89   89   89 
LCS_AVERAGE  LCS_A: 100.00  ( 100.00  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     63     85     87     87     88     89     89     89     89     89     89     89     89     89     89     89     89     89     89     89 
GDT PERCENT_AT  70.79  95.51  97.75  97.75  98.88 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00
GDT RMS_LOCAL    0.27   0.43   0.47   0.47   0.63   0.77   0.77   0.77   0.77   0.77   0.77   0.77   0.77   0.77   0.77   0.77   0.77   0.77   0.77   0.77
GDT RMS_ALL_AT   0.81   0.79   0.79   0.79   0.78   0.77   0.77   0.77   0.77   0.77   0.77   0.77   0.77   0.77   0.77   0.77   0.77   0.77   0.77   0.77

# Checking swapping
#   possible swapping detected:  F    12_A      F    12_A
#   possible swapping detected:  Y    41_A      Y    41_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     3.742     0    0.134   0.134     3.742   48.452   48.452
LGA    S     2_A      S     2_A     4.186     0    0.015   0.091     5.839   47.143   38.571
LGA    A     3_A      A     3_A     1.111     0    0.462   0.489     1.870   81.548   79.810
LGA    D     4_A      D     4_A     0.383     0    0.066   0.079     0.790   97.619   95.238
LGA    L     5_A      L     5_A     0.356     0    0.060   0.057     0.418  100.000  100.000
LGA    A     6_A      A     6_A     0.476     0    0.046   0.049     0.715  100.000   98.095
LGA    H     7_A      H     7_A     0.417     0    0.050   1.138     2.429  100.000   90.095
LGA    G     8_A      G     8_A     0.325     0    0.072   0.072     0.547   97.619   97.619
LGA    G     9_A      G     9_A     0.232     0    0.021   0.021     0.272  100.000  100.000
LGA    Q    10_A      Q    10_A     0.377     0    0.011   0.350     1.113   95.238   94.762
LGA    V    11_A      V    11_A     0.624     0    0.013   0.039     0.918   92.857   91.837
LGA    F    12_A      F    12_A     0.286     0    0.034   0.051     0.481  100.000  100.000
LGA    S    13_A      S    13_A     0.324     0    0.008   0.048     0.476  100.000  100.000
LGA    A    14_A      A    14_A     0.417     0    0.063   0.073     0.639   97.619   98.095
LGA    N    15_A      N    15_A     0.313     0    0.041   0.058     0.915  100.000   95.238
LGA    C    16_A      C    16_A     0.421     0    0.042   0.128     0.919   97.619   95.238
LGA    A    17_A      A    17_A     0.523     0    0.028   0.025     0.680   90.476   90.476
LGA    A    18_A      A    18_A     0.586     0    0.017   0.017     0.880   90.476   90.476
LGA    C    19_A      C    19_A     0.766     0    0.050   0.072     0.987   90.476   90.476
LGA    H    20_A      H    20_A     0.459     0    0.301   1.142     2.392   90.595   86.286
LGA    L    21_A      L    21_A     0.729     0    0.059   0.177     1.252   95.238   90.595
LGA    G    22_A      G    22_A     0.286     0    0.073   0.073     0.382  100.000  100.000
LGA    G    23_A      G    23_A     0.579     0    0.070   0.070     0.982   92.857   92.857
LGA    R    24_A      R    24_A     0.438     0    0.228   1.190     7.505   86.548   62.381
LGA    N    25_A      N    25_A     0.234     0    0.057   0.107     0.747   97.619   97.619
LGA    V    26_A      V    26_A     0.371     0    0.122   0.143     1.223   92.976   91.905
LGA    V    27_A      V    27_A     0.542     0    0.043   0.048     0.798   92.857   93.197
LGA    N    28_A      N    28_A     0.655     0    0.060   0.153     1.228   90.476   89.345
LGA    P    29_A      P    29_A     0.578     0    0.014   0.027     0.616   90.476   90.476
LGA    A    30_A      A    30_A     0.604     0    0.038   0.039     0.727   92.857   92.381
LGA    K    31_A      K    31_A     0.387     0    0.096   0.096     0.720   97.619   95.767
LGA    T    32_A      T    32_A     0.217     0    0.016   0.036     0.234  100.000  100.000
LGA    L    33_A      L    33_A     0.174     0    0.022   0.162     0.686  100.000   98.810
LGA    Q    34_A      Q    34_A     0.391     0    0.038   0.739     2.313  100.000   90.952
LGA    K    35_A      K    35_A     0.641     0    0.021   0.552     3.588   92.857   76.296
LGA    A    36_A      A    36_A     0.454     0    0.026   0.027     0.533   97.619   98.095
LGA    D    37_A      D    37_A     0.235     0    0.028   0.122     0.491  100.000  100.000
LGA    L    38_A      L    38_A     0.221     0    0.018   0.122     0.546   97.619   97.619
LGA    D    39_A      D    39_A     0.720     0    0.021   0.051     1.155   92.857   90.536
LGA    Q    40_A      Q    40_A     0.739     0    0.051   1.146     4.759   88.214   78.095
LGA    Y    41_A      Y    41_A     0.887     0    0.015   0.068     1.242   88.214   86.706
LGA    G    42_A      G    42_A     1.011     0    0.056   0.056     1.011   88.214   88.214
LGA    M    43_A      M    43_A     0.499     0    0.056   0.901     2.345   97.619   90.833
LGA    A    44_A      A    44_A     0.286     0    0.268   0.256     1.050   95.357   94.381
LGA    S    45_A      S    45_A     0.253     0    0.019   0.040     0.446  100.000  100.000
LGA    I    46_A      I    46_A     0.058     0    0.036   0.068     0.468  100.000  100.000
LGA    E    47_A      E    47_A     0.265     0    0.040   0.952     4.115  100.000   79.577
LGA    A    48_A      A    48_A     0.241     0    0.016   0.022     0.330  100.000  100.000
LGA    I    49_A      I    49_A     0.186     0    0.011   0.062     0.230  100.000  100.000
LGA    T    50_A      T    50_A     0.181     0    0.041   1.095     2.348  100.000   91.088
LGA    T    51_A      T    51_A     0.119     0    0.020   0.053     0.293  100.000  100.000
LGA    Q    52_A      Q    52_A     0.406     0    0.045   0.799     3.792  100.000   86.508
LGA    V    53_A      V    53_A     0.165     0    0.024   0.027     0.222  100.000  100.000
LGA    T    54_A      T    54_A     0.155     0    0.026   0.070     0.231  100.000  100.000
LGA    N    55_A      N    55_A     0.209     0    0.043   0.097     0.371  100.000  100.000
LGA    G    56_A      G    56_A     0.527     0    0.008   0.008     0.558   92.857   92.857
LGA    K    57_A      K    57_A     0.821     0    0.031   0.113     1.486   90.476   86.455
LGA    G    58_A      G    58_A     1.235     0    0.022   0.022     1.235   81.429   81.429
LGA    A    59_A      A    59_A     0.725     0    0.024   0.024     0.919   92.857   92.381
LGA    M    60_A      M    60_A     0.374     0    0.010   0.168     0.620  100.000   98.810
LGA    P    61_A      P    61_A     0.299     0    0.031   0.158     0.438  100.000  100.000
LGA    A    62_A      A    62_A     0.230     0    0.027   0.029     0.299  100.000  100.000
LGA    F    63_A      F    63_A     0.375     0    0.025   0.098     0.586  100.000   97.403
LGA    G    64_A      G    64_A     0.401     0    0.031   0.031     0.806   95.238   95.238
LGA    S    65_A      S    65_A     0.884     0    0.085   0.672     3.325   88.214   80.714
LGA    K    66_A      K    66_A     0.627     0    0.096   0.801     2.236   95.238   86.878
LGA    L    67_A      L    67_A     0.592     0    0.017   0.029     0.713   90.476   90.476
LGA    S    68_A      S    68_A     0.564     0    0.035   0.045     0.680   95.238   93.651
LGA    A    69_A      A    69_A     0.190     0    0.017   0.021     0.324  100.000  100.000
LGA    D    70_A      D    70_A     0.494     0    0.032   0.152     1.517  100.000   91.905
LGA    D    71_A      D    71_A     0.240     0    0.026   0.260     0.691  100.000   98.810
LGA    I    72_A      I    72_A     0.203     0    0.017   0.057     0.321  100.000  100.000
LGA    A    73_A      A    73_A     0.205     0    0.015   0.028     0.212  100.000  100.000
LGA    D    74_A      D    74_A     0.204     0    0.007   0.043     0.210  100.000  100.000
LGA    V    75_A      V    75_A     0.209     0    0.049   0.885     1.994  100.000   92.245
LGA    A    76_A      A    76_A     0.181     0    0.012   0.018     0.233  100.000  100.000
LGA    S    77_A      S    77_A     0.162     0    0.007   0.027     0.263  100.000  100.000
LGA    Y    78_A      Y    78_A     0.176     0    0.041   0.032     0.252  100.000  100.000
LGA    V    79_A      V    79_A     0.140     0    0.028   0.034     0.185  100.000  100.000
LGA    L    80_A      L    80_A     0.179     0    0.008   0.109     0.597  100.000   98.810
LGA    D    81_A      D    81_A     0.167     0    0.007   0.131     0.318  100.000  100.000
LGA    Q    82_A      Q    82_A     0.141     0    0.017   0.080     0.298  100.000  100.000
LGA    S    83_A      S    83_A     0.239     0    0.002   0.652     2.151  100.000   94.127
LGA    E    84_A      E    84_A     0.298     0    0.014   0.873     4.267  100.000   83.492
LGA    K    85_A      K    85_A     0.181     0    0.022   0.437     1.311  100.000   96.878
LGA    G    86_A      G    86_A     0.331     0    0.018   0.018     0.331  100.000  100.000
LGA    W    87_A      W    87_A     0.453     0    0.100   0.138     1.335   92.976   95.272
LGA    Q    88_A      Q    88_A     0.891     0    0.543   0.873     4.279   82.143   66.296
LGA    G    89_A      G    89_A     1.358     0    0.448   0.448     4.238   62.500   62.500

# 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):     0.772          0.807                  1.117           94.893   92.153

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)   89   89    4.0     89    0.77    98.315    99.246    10.207

LGA_LOCAL      RMSD:   0.772  Number of atoms:   89  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   0.772  Number of assigned atoms:   89 
Std_ASGN_ATOMS RMSD:   0.772  Standard rmsd on all 89 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.532760 * X  +  -0.787858 * Y  +  -0.308944 * Z  +   3.091657
  Y_new =  -0.613798 * X  +  -0.611066 * Y  +   0.499851 * Z  + -23.625530
  Z_new =  -0.582597 * X  +  -0.076671 * Y  +  -0.809137 * Z  +  11.693113 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -0.855960  0.621920 -3.047118   [DEG:  -49.0429   35.6334 -174.5870 ]
ZXZ: -2.587990  2.513478 -1.701647   [DEG: -148.2809  144.0117  -97.4972 ]
 
# END of job
