
#######################################################
#                                                     #
#                        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  103 (  821),  selected   79 , name one
# Molecule2: number of CA atoms   79 (  633),  selected   79 , 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:    79      23_A - 101_A       1.78     1.78
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    79      23_A - 101_A       1.78     1.78
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    77      23_A - 99_A        0.99     1.87
  LCS_AVERAGE:     95.23

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:   79
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    23_A     G    23_A     77   79   79      3    4   28   43   57   72   74   75   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     G    24_A     G    24_A     77   79   79     37   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     S    25_A     S    25_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     M    26_A     M    26_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     K    27_A     K    27_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     I    28_A     I    28_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     Y    29_A     Y    29_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     V    30_A     V    30_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     K    31_A     K    31_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     L    32_A     L    32_A     77   79   79     19   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     Q    33_A     Q    33_A     77   79   79     13   63   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     D    34_A     D    34_A     77   79   79     13   57   73   74   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     G    35_A     G    35_A     77   79   79     25   68   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     T    36_A     T    36_A     77   79   79     41   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     V    37_A     V    37_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     I    38_A     I    38_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     E    39_A     E    39_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     L    40_A     L    40_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     E    41_A     E    41_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     V    42_A     V    42_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     E    43_A     E    43_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     P    44_A     P    44_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     S    45_A     S    45_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     D    46_A     D    46_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     T    47_A     T    47_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     I    48_A     I    48_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     L    49_A     L    49_A     77   79   79     54   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     E    50_A     E    50_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     V    51_A     V    51_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     K    52_A     K    52_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     E    53_A     E    53_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     K    54_A     K    54_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     I    55_A     I    55_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     Y    56_A     Y    56_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     E    57_A     E    57_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     K    58_A     K    58_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     T    59_A     T    59_A     77   79   79     16   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     G    60_A     G    60_A     77   79   79     46   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     I    61_A     I    61_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     P    62_A     P    62_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     P    63_A     P    63_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     E    64_A     E    64_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     D    65_A     D    65_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     Q    66_A     Q    66_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     I    67_A     I    67_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     L    68_A     L    68_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     I    69_A     I    69_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     Y    70_A     Y    70_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     K    71_A     K    71_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     G    72_A     G    72_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     K    73_A     K    73_A     77   79   79     37   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     V    74_A     V    74_A     77   79   79     46   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     L    75_A     L    75_A     77   79   79     46   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     E    76_A     E    76_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     D    77_A     D    77_A     77   79   79      9   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     S    78_A     S    78_A     77   79   79     46   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     K    79_A     K    79_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     T    80_A     T    80_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     L    81_A     L    81_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     A    82_A     A    82_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     D    83_A     D    83_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     Y    84_A     Y    84_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     N    85_A     N    85_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     I    86_A     I    86_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     Q    87_A     Q    87_A     77   79   79     20   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     E    88_A     E    88_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     N    89_A     N    89_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     D    90_A     D    90_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     V    91_A     V    91_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     L    92_A     L    92_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     Y    93_A     Y    93_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     L    94_A     L    94_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     V    95_A     V    95_A     77   79   79     57   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     R    96_A     R    96_A     77   79   79     12   70   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     R    97_A     R    97_A     77   79   79      4   31   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     L    98_A     L    98_A     77   79   79      4   18   60   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     K    99_A     K    99_A     77   79   79      9   41   73   75   76   76   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     S   100_A     S   100_A     11   79   79      3    8   13   32   57   69   77   77   77   78   78   78   78   78   78   79   79   79   79   79 
LCS_GDT     P   101_A     P   101_A      3   79   79      0    2    3    4   10   12   13   18   25   38   62   77   78   78   78   79   79   79   79   79 
LCS_AVERAGE  LCS_A:  98.41  (  95.23  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     57     70     73     75     76     76     77     77     77     78     78     78     78     78     78     79     79     79     79     79 
GDT PERCENT_AT  72.15  88.61  92.41  94.94  96.20  96.20  97.47  97.47  97.47  98.73  98.73  98.73  98.73  98.73  98.73 100.00 100.00 100.00 100.00 100.00
GDT RMS_LOCAL    0.29   0.45   0.55   0.76   0.79   0.79   1.10   1.10   0.99   1.26   1.26   1.26   1.26   1.26   1.26   1.78   1.78   1.78   1.78   1.78
GDT RMS_ALL_AT   1.97   1.94   1.96   1.86   1.86   1.86   1.81   1.81   1.87   1.81   1.81   1.81   1.81   1.81   1.81   1.78   1.78   1.78   1.78   1.78

# Checking swapping
#   possible swapping detected:  E    41_A      E    41_A
#   possible swapping detected:  E    57_A      E    57_A
#   possible swapping detected:  E    64_A      E    64_A
#   possible swapping detected:  E    76_A      E    76_A
#   possible swapping detected:  Y    84_A      Y    84_A
#   possible swapping detected:  Y    93_A      Y    93_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    G    23_A      G    23_A     5.685     0    0.641   0.641     6.167   25.476   25.476
LGA    G    24_A      G    24_A     0.701     0    0.337   0.337     1.587   88.452   88.452
LGA    S    25_A      S    25_A     0.444     0    0.074   0.718     2.941   95.238   88.095
LGA    M    26_A      M    26_A     0.807     0    0.043   0.656     1.510   90.476   87.143
LGA    K    27_A      K    27_A     0.618     0    0.033   1.249     8.003   90.476   65.238
LGA    I    28_A      I    28_A     0.413     0    0.032   0.091     0.509   97.619   98.810
LGA    Y    29_A      Y    29_A     0.413     0    0.025   0.134     0.953  100.000   96.032
LGA    V    30_A      V    30_A     0.265     0    0.038   0.084     0.416  100.000  100.000
LGA    K    31_A      K    31_A     0.350     0    0.034   0.247     1.822   95.238   91.693
LGA    L    32_A      L    32_A     1.045     0    0.018   1.350     3.472   83.690   74.524
LGA    Q    33_A      Q    33_A     1.853     0    0.037   0.931     7.746   70.833   45.556
LGA    D    34_A      D    34_A     2.086     0    0.142   0.351     2.235   72.976   71.964
LGA    G    35_A      G    35_A     1.397     0    0.140   0.140     1.648   79.286   79.286
LGA    T    36_A      T    36_A     0.637     0    0.046   1.043     2.933   90.476   82.041
LGA    V    37_A      V    37_A     0.330     0    0.026   0.082     0.528  100.000   98.639
LGA    I    38_A      I    38_A     0.257     0    0.052   1.324     3.476  100.000   83.810
LGA    E    39_A      E    39_A     0.409     0    0.044   0.984     4.735  100.000   78.254
LGA    L    40_A      L    40_A     0.372     0    0.043   0.087     0.448  100.000  100.000
LGA    E    41_A      E    41_A     0.493     0    0.044   1.015     3.320   95.238   78.677
LGA    V    42_A      V    42_A     0.336     0    0.020   0.095     0.842   92.857   95.918
LGA    E    43_A      E    43_A     0.465     0    0.030   0.990     4.502   95.238   77.513
LGA    P    44_A      P    44_A     0.650     0    0.050   0.326     0.765   92.857   91.837
LGA    S    45_A      S    45_A     0.408     0    0.086   0.712     2.473   97.619   90.952
LGA    D    46_A      D    46_A     0.226     0    0.050   0.147     0.975  100.000   97.619
LGA    T    47_A      T    47_A     0.485     0    0.042   0.043     0.757  100.000   95.918
LGA    I    48_A      I    48_A     0.574     0    0.040   0.632     2.563   90.476   85.179
LGA    L    49_A      L    49_A     0.818     0    0.030   1.067     4.329   90.476   74.702
LGA    E    50_A      E    50_A     0.626     0    0.036   0.938     3.972   92.857   79.577
LGA    V    51_A      V    51_A     0.444     0    0.028   0.119     0.563  100.000   98.639
LGA    K    52_A      K    52_A     0.485     0    0.029   0.072     0.716   97.619   93.651
LGA    E    53_A      E    53_A     0.541     0    0.037   0.800     3.547   95.238   81.640
LGA    K    54_A      K    54_A     0.468     0    0.046   0.550     1.370  100.000   92.698
LGA    I    55_A      I    55_A     0.367     0    0.036   0.079     0.505  100.000   98.810
LGA    Y    56_A      Y    56_A     0.590     0    0.030   0.199     2.252   90.476   81.667
LGA    E    57_A      E    57_A     0.664     0    0.088   1.022     3.777   90.476   77.672
LGA    K    58_A      K    58_A     0.630     0    0.154   0.231     0.770   92.857   91.534
LGA    T    59_A      T    59_A     0.967     0    0.074   1.204     2.537   83.690   78.163
LGA    G    60_A      G    60_A     1.089     0    0.067   0.067     1.185   85.952   85.952
LGA    I    61_A      I    61_A     0.678     0    0.069   0.089     0.732   90.476   94.048
LGA    P    62_A      P    62_A     0.710     0    0.036   0.236     1.126   90.476   89.184
LGA    P    63_A      P    63_A     0.597     0    0.050   0.068     0.760   90.476   90.476
LGA    E    64_A      E    64_A     0.808     0    0.102   0.609     3.117   90.476   82.011
LGA    D    65_A      D    65_A     0.441     0    0.200   0.480     1.988   95.238   87.321
LGA    Q    66_A      Q    66_A     0.503     0    0.047   0.076     0.615   92.857   95.767
LGA    I    67_A      I    67_A     0.559     0    0.020   0.088     0.664   95.238   92.857
LGA    L    68_A      L    68_A     0.392     0    0.042   0.091     0.484  100.000  100.000
LGA    I    69_A      I    69_A     0.346     0    0.024   0.065     0.698  100.000   97.619
LGA    Y    70_A      Y    70_A     0.221     0    0.023   0.199     1.449  100.000   93.770
LGA    K    71_A      K    71_A     0.588     0    0.070   0.619     3.652   92.857   85.291
LGA    G    72_A      G    72_A     0.796     0    0.090   0.090     1.098   88.214   88.214
LGA    K    73_A      K    73_A     0.778     0    0.024   0.829     1.630   92.857   84.603
LGA    V    74_A      V    74_A     0.659     0    0.040   0.105     0.969   90.476   90.476
LGA    L    75_A      L    75_A     0.808     0    0.066   0.090     1.002   90.476   89.345
LGA    E    76_A      E    76_A     0.564     0    0.074   1.038     4.386   90.476   71.270
LGA    D    77_A      D    77_A     0.752     0    0.653   0.656     3.521   76.429   85.833
LGA    S    78_A      S    78_A     0.878     0    0.057   0.682     2.712   88.214   83.413
LGA    K    79_A      K    79_A     0.694     0    0.073   0.819     2.389   90.476   83.651
LGA    T    80_A      T    80_A     0.383     0    0.056   0.055     0.667   97.619   98.639
LGA    L    81_A      L    81_A     0.619     0    0.047   0.120     0.836   92.857   91.667
LGA    A    82_A      A    82_A     0.799     0    0.029   0.039     0.891   90.476   90.476
LGA    D    83_A      D    83_A     0.787     0    0.031   0.110     0.833   90.476   91.667
LGA    Y    84_A      Y    84_A     0.813     0    0.114   0.298     0.994   90.476   92.857
LGA    N    85_A      N    85_A     0.760     0    0.043   0.627     2.768   90.476   85.179
LGA    I    86_A      I    86_A     0.517     0    0.022   0.078     0.766   92.857   95.238
LGA    Q    87_A      Q    87_A     1.057     0    0.053   0.544     2.225   88.214   82.593
LGA    E    88_A      E    88_A     0.967     0    0.106   0.592     3.846   88.214   73.968
LGA    N    89_A      N    89_A     0.460     0    0.096   1.136     4.339   95.238   76.548
LGA    D    90_A      D    90_A     0.341     0    0.066   0.168     0.814  100.000   98.810
LGA    V    91_A      V    91_A     0.100     0    0.038   1.065     2.391  100.000   89.932
LGA    L    92_A      L    92_A     0.227     0    0.036   1.101     2.548  100.000   89.048
LGA    Y    93_A      Y    93_A     0.219     0    0.036   0.242     1.178  100.000   96.071
LGA    L    94_A      L    94_A     0.467     0    0.029   0.092     0.689   95.238   92.857
LGA    V    95_A      V    95_A     0.670     0    0.140   1.169     2.848   92.857   83.401
LGA    R    96_A      R    96_A     0.694     0    0.052   1.381     3.980   90.595   77.532
LGA    R    97_A      R    97_A     1.743     0    0.059   0.593     3.542   70.952   68.052
LGA    L    98_A      L    98_A     2.739     0    0.210   0.679     5.598   57.262   45.476
LGA    K    99_A      K    99_A     2.082     0    0.069   0.266     6.027   47.024   48.836
LGA    S   100_A      S   100_A     6.485     0    0.310   0.396     7.664   23.452   19.048
LGA    P   101_A      P   101_A    11.519     0    0.658   0.621    13.673    0.357    0.204

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:       79     316    316  100.00     633    633  100.00                79
SUMMARY(RMSD_GDC):     1.778          1.772                  2.095           88.665   83.248

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  103   79    4.0     77    1.10    95.253    97.046     6.424

LGA_LOCAL      RMSD:   1.099  Number of atoms:   77  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   1.807  Number of assigned atoms:   79 
Std_ASGN_ATOMS RMSD:   1.778  Standard rmsd on all 79 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.364416 * X  +   0.107970 * Y  +  -0.924956 * Z  + -20.511528
  Y_new =   0.788913 * X  +  -0.563537 * Y  +   0.245036 * Z  +  -5.467412
  Z_new =  -0.494791 * X  +  -0.819004 * Y  +  -0.290541 * Z  +  21.349419 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  1.138072  0.517594 -1.911696   [DEG:   65.2067   29.6559 -109.5321 ]
ZXZ: -1.829764  1.865589 -2.598137   [DEG: -104.8377  106.8904 -148.8623 ]
 
# END of job
