
#######################################################
#                                                     #
#                        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   82 (  674),  selected   79 , name one
# Molecule2: number of CA atoms   79 (  632),  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       3_A - 81_A        2.72     2.72
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    61      13_A - 73_A        2.00     2.90
  LCS_AVERAGE:     75.12

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    38      32_A - 69_A        0.99     4.10
  LONGEST_CONTINUOUS_SEGMENT:    38      33_A - 70_A        0.95     4.36
  LCS_AVERAGE:     43.26

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     L     3_A     L     3_A     37   59   79      3   21   33   41   47   56   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     L     4_A     L     4_A     37   59   79     20   27   38   44   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     L     5_A     L     5_A     37   59   79     20   27   38   44   52   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     C     6_A     C     6_A     37   59   79     20   27   38   44   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     P     7_A     P     7_A     37   59   79      5   22   38   44   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     N     8_A     N     8_A     37   59   79     20   27   38   44   52   57   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     C     9_A     C     9_A     37   59   79     20   27   38   44   52   57   64   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     Q    10_A     Q    10_A     37   59   79     14   26   36   44   52   57   63   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     V    11_A     V    11_A     37   59   79      7   26   36   44   52   57   63   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     G    12_A     G    12_A     37   60   79     20   27   38   44   52   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     M    13_A     M    13_A     37   61   79     20   27   38   44   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     R    14_A     R    14_A     37   61   79     20   27   38   44   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     E    15_A     E    15_A     37   61   79     20   27   38   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     V    16_A     V    16_A     37   61   79     20   27   38   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     E    17_A     E    17_A     37   61   79     12   27   38   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     R    18_A     R    18_A     37   61   79      7   27   38   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     R    19_A     R    19_A     37   61   79      7   22   38   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     G    20_A     G    20_A     37   61   79      7   27   38   44   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     V    21_A     V    21_A     37   61   79     12   27   38   44   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     L    22_A     L    22_A     37   61   79     12   27   38   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     I    23_A     I    23_A     37   61   79     20   27   37   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     D    24_A     D    24_A     37   61   79     20   27   38   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     V    25_A     V    25_A     37   61   79     20   27   38   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     C    26_A     C    26_A     37   61   79     20   27   38   44   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     P    27_A     P    27_A     37   61   79     20   27   38   44   52   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     Q    28_A     Q    28_A     37   61   79     20   27   38   44   52   57   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     C    29_A     C    29_A     37   61   79     20   27   38   44   52   57   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     G    30_A     G    30_A     37   61   79     20   27   38   44   52   59   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     G    31_A     G    31_A     37   61   79      9   26   38   44   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     V    32_A     V    32_A     38   61   79     20   27   38   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     W    33_A     W    33_A     38   61   79     20   27   38   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     L    34_A     L    34_A     38   61   79     20   29   38   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     D    35_A     D    35_A     38   61   79     14   31   38   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     K    36_A     K    36_A     38   61   79     19   31   38   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     G    37_A     G    37_A     38   61   79     19   30   38   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     E    38_A     E    38_A     38   61   79     14   31   38   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     L    39_A     L    39_A     38   61   79     19   31   38   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     E    40_A     E    40_A     38   61   79     19   31   38   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     K    41_A     K    41_A     38   61   79     19   31   38   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     L    42_A     L    42_A     38   61   79     19   31   38   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     L    43_A     L    43_A     38   61   79     19   31   38   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     A    44_A     A    44_A     38   61   79     19   31   36   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     E    45_A     E    45_A     38   61   79     19   31   37   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     A    46_A     A    46_A     38   61   79     19   31   38   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     E    47_A     E    47_A     38   61   79     19   31   36   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     E    48_A     E    48_A     38   61   79     19   31   36   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     V    49_A     V    49_A     38   61   79     19   31   36   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     E    50_A     E    50_A     38   61   79     19   31   36   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     R    51_A     R    51_A     38   61   79     19   31   36   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     R    52_A     R    52_A     38   61   79     19   31   36   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     Y    53_A     Y    53_A     38   61   79     19   31   36   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     E    54_A     E    54_A     38   61   79     19   31   36   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     E    55_A     E    55_A     38   61   79     19   31   36   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     E    56_A     E    56_A     38   61   79     18   31   36   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     L    57_A     L    57_A     38   61   79     18   31   36   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     E    58_A     E    58_A     38   61   79     18   31   36   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     G    59_A     G    59_A     38   61   79     18   31   36   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     F    60_A     F    60_A     38   61   79     18   31   36   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     Y    61_A     Y    61_A     38   61   79     18   31   36   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     R    62_A     R    62_A     38   61   79     18   31   36   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     K    63_A     K    63_A     38   61   79     18   31   36   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     E    64_A     E    64_A     38   61   79     18   31   36   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     G    65_A     G    65_A     38   61   79     18   31   36   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     K    66_A     K    66_A     38   61   79     18   31   36   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     P    67_A     P    67_A     38   61   79     18   31   36   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     Y    68_A     Y    68_A     38   61   79     18   31   36   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     K    69_A     K    69_A     38   61   79      3   17   23   37   47   56   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     R    70_A     R    70_A     38   61   79      3   16   23   41   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     K    71_A     K    71_A     30   61   79      3   13   20   41   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     K    72_A     K    72_A     23   61   79      3    5   18   23   30   53   63   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     G    73_A     G    73_A     20   61   79      6    7   23   39   52   58   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     F    74_A     F    74_A      9   49   79      6    7   10   23   32   46   63   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     M    75_A     M    75_A      9   49   79      6    7   27   45   53   60   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     K    76_A     K    76_A      9   49   79      6    7   29   44   52   57   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     L    77_A     L    77_A      9   49   79      6    7   10   17   30   43   57   61   71   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     F    78_A     F    78_A      9   49   79      6    7   19   25   32   43   57   65   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     D    79_A     D    79_A      9   49   79      4    7   22   33   52   57   65   72   76   77   77   78   79   79   79   79   79   79   79   79 
LCS_GDT     L    80_A     L    80_A      9   44   79      3    6    8    9   14   32   39   53   62   64   67   77   79   79   79   79   79   79   79   79 
LCS_GDT     F    81_A     F    81_A      9   38   79      3   11   18   22   26   30   34   40   46   51   71   78   79   79   79   79   79   79   79   79 
LCS_AVERAGE  LCS_A:  72.79  (  43.26   75.12  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     20     31     38     45     53     60     65     72     76     77     77     78     79     79     79     79     79     79     79     79 
GDT PERCENT_AT  25.32  39.24  48.10  56.96  67.09  75.95  82.28  91.14  96.20  97.47  97.47  98.73 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00
GDT RMS_LOCAL    0.31   0.67   1.09   1.22   1.48   1.84   2.03   2.31   2.47   2.53   2.53   2.62   2.72   2.72   2.72   2.72   2.72   2.72   2.72   2.72
GDT RMS_ALL_AT   8.75   4.99   5.37   3.42   3.18   2.88   2.83   2.75   2.73   2.72   2.72   2.72   2.72   2.72   2.72   2.72   2.72   2.72   2.72   2.72

# Checking swapping
#   possible swapping detected:  E    15_A      E    15_A
#   possible swapping detected:  E    17_A      E    17_A
#   possible swapping detected:  E    38_A      E    38_A
#   possible swapping detected:  E    55_A      E    55_A
#   possible swapping detected:  E    56_A      E    56_A
#   possible swapping detected:  F    60_A      F    60_A
#   possible swapping detected:  E    64_A      E    64_A
#   possible swapping detected:  Y    68_A      Y    68_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    L     3_A      L     3_A     3.949     0    0.476   1.439     9.097   37.500   23.452
LGA    L     4_A      L     4_A     2.508     0    0.050   1.308     4.640   59.048   53.214
LGA    L     5_A      L     5_A     3.004     4    0.034   0.034     3.004   55.357   27.679
LGA    C     6_A      C     6_A     2.503     0    0.053   0.100     3.469   55.357   55.952
LGA    P     7_A      P     7_A     2.686     0    0.018   0.035     3.398   55.476   61.769
LGA    N     8_A      N     8_A     3.795     0    0.170   0.844     5.839   36.548   39.167
LGA    C     9_A      C     9_A     4.538     0    0.027   0.118     5.318   33.095   34.444
LGA    Q    10_A      Q    10_A     4.724     0    0.177   1.057     6.778   32.857   28.201
LGA    V    11_A      V    11_A     4.572     0    0.086   1.062     5.080   37.381   34.082
LGA    G    12_A      G    12_A     3.179     0    0.019   0.019     3.601   51.905   51.905
LGA    M    13_A      M    13_A     1.467     0    0.027   0.945     3.910   75.119   74.643
LGA    R    14_A      R    14_A     0.867     0    0.098   1.216     7.012   90.476   64.719
LGA    E    15_A      E    15_A     1.104     0    0.020   0.742     1.495   83.690   84.444
LGA    V    16_A      V    16_A     1.556     0    0.054   0.092     1.872   77.143   77.755
LGA    E    17_A      E    17_A     2.193     0    0.039   0.218     2.334   66.786   65.661
LGA    R    18_A      R    18_A     2.241     3    0.017   0.148     2.433   64.762   48.571
LGA    R    19_A      R    19_A     2.446     5    0.045   0.406     2.877   60.952   33.939
LGA    G    20_A      G    20_A     2.842     0    0.226   0.226     2.842   59.048   59.048
LGA    V    21_A      V    21_A     2.946     0    0.052   0.108     3.250   57.143   54.082
LGA    L    22_A      L    22_A     2.305     0    0.146   0.900     4.171   64.881   60.417
LGA    I    23_A      I    23_A     1.836     0    0.060   0.262     2.550   75.119   71.012
LGA    D    24_A      D    24_A     0.751     0    0.082   0.277     2.006   88.214   83.869
LGA    V    25_A      V    25_A     0.964     0    0.023   0.049     1.549   85.952   82.789
LGA    C    26_A      C    26_A     1.837     0    0.025   0.051     2.599   70.952   67.619
LGA    P    27_A      P    27_A     2.707     0    0.017   0.046     3.578   53.810   56.327
LGA    Q    28_A      Q    28_A     4.008     0    0.084   0.781     6.036   38.690   35.026
LGA    C    29_A      C    29_A     3.966     0    0.049   0.097     3.966   43.333   45.635
LGA    G    30_A      G    30_A     3.258     0    0.025   0.025     3.414   53.571   53.571
LGA    G    31_A      G    31_A     1.966     0    0.118   0.118     2.497   72.976   72.976
LGA    V    32_A      V    32_A     1.560     0    0.065   1.074     3.827   75.000   68.707
LGA    W    33_A      W    33_A     0.924     0    0.061   0.742     5.432   88.214   64.456
LGA    L    34_A      L    34_A     1.296     0    0.058   0.542     2.149   81.429   77.262
LGA    D    35_A      D    35_A     1.253     0    0.050   0.155     1.306   81.429   81.429
LGA    K    36_A      K    36_A     1.473     0    0.019   0.866     5.896   81.429   66.296
LGA    G    37_A      G    37_A     1.437     0    0.074   0.074     1.640   77.143   77.143
LGA    E    38_A      E    38_A     1.481     0    0.035   1.005     3.724   77.143   71.534
LGA    L    39_A      L    39_A     1.408     0    0.034   0.043     1.448   81.429   81.429
LGA    E    40_A      E    40_A     1.203     0    0.016   0.892     3.292   81.429   70.688
LGA    K    41_A      K    41_A     1.799     0    0.064   0.841     4.141   72.857   63.810
LGA    L    42_A      L    42_A     2.001     0    0.029   1.366     5.441   70.833   58.452
LGA    L    43_A      L    43_A     1.365     0    0.068   0.077     1.501   79.286   81.488
LGA    A    44_A      A    44_A     1.485     0    0.056   0.064     1.720   77.143   76.286
LGA    E    45_A      E    45_A     2.084     0    0.028   1.131     3.990   68.810   57.037
LGA    A    46_A      A    46_A     1.752     0    0.059   0.065     1.862   75.000   74.571
LGA    E    47_A      E    47_A     1.032     0    0.034   0.620     2.448   81.429   78.677
LGA    E    48_A      E    48_A     1.875     0    0.046   0.861     2.837   70.833   64.921
LGA    V    49_A      V    49_A     2.012     0    0.035   0.047     2.622   70.833   67.143
LGA    E    50_A      E    50_A     1.036     0    0.035   0.587     2.572   85.952   76.190
LGA    R    51_A      R    51_A     1.264     0    0.059   1.436     9.439   81.429   49.221
LGA    R    52_A      R    52_A     1.876     0    0.028   1.243     7.842   72.857   49.264
LGA    Y    53_A      Y    53_A     1.249     0    0.051   0.438     2.956   85.952   75.516
LGA    E    54_A      E    54_A     0.509     0    0.070   0.959     2.115   92.857   83.810
LGA    E    55_A      E    55_A     0.880     0    0.028   0.164     1.530   90.476   84.497
LGA    E    56_A      E    56_A     0.662     0    0.018   0.214     1.202   95.238   89.577
LGA    L    57_A      L    57_A     0.827     0    0.064   0.132     2.105   88.214   81.667
LGA    E    58_A      E    58_A     1.164     0    0.034   0.757     3.924   81.548   71.746
LGA    G    59_A      G    59_A     0.747     0    0.051   0.051     0.943   90.476   90.476
LGA    F    60_A      F    60_A     1.166     0    0.053   1.212     5.051   81.548   63.896
LGA    Y    61_A      Y    61_A     1.836     0    0.026   0.118     2.291   70.833   68.135
LGA    R    62_A      R    62_A     1.905     0    0.029   1.178     6.233   70.833   59.048
LGA    K    63_A      K    63_A     1.778     2    0.066   0.681     3.614   68.810   52.540
LGA    E    64_A      E    64_A     2.540     0    0.026   0.651     3.033   57.262   58.942
LGA    G    65_A      G    65_A     2.972     0    0.082   0.082     3.026   55.357   55.357
LGA    K    66_A      K    66_A     3.064     3    0.017   0.064     3.206   55.357   36.508
LGA    P    67_A      P    67_A     3.206     0    0.096   0.384     4.817   53.571   47.483
LGA    Y    68_A      Y    68_A     2.415     0    0.044   0.217     3.612   53.810   74.484
LGA    K    69_A      K    69_A     3.749     2    0.102   0.535     7.145   50.119   28.783
LGA    R    70_A      R    70_A     2.593     0    0.076   0.692     4.813   57.262   48.571
LGA    K    71_A      K    71_A     2.325     0    0.650   0.989     4.982   70.952   54.444
LGA    K    72_A      K    72_A     3.866     0    0.393   0.609    10.961   50.595   29.788
LGA    G    73_A      G    73_A     3.011     0    0.631   0.631     4.232   46.786   46.786
LGA    F    74_A      F    74_A     3.826     0    0.011   1.229    10.697   46.667   23.290
LGA    M    75_A      M    75_A     2.200     0    0.102   0.842     3.343   60.952   62.083
LGA    K    76_A      K    76_A     4.120     0    0.077   0.175     6.659   37.976   29.048
LGA    L    77_A      L    77_A     5.553     0    0.033   1.426    10.170   25.119   18.095
LGA    F    78_A      F    78_A     4.711     0    0.185   0.405     7.543   32.857   23.030
LGA    D    79_A      D    79_A     3.922     0    0.043   0.278     5.094   36.071   41.369
LGA    L    80_A      L    80_A     7.045     0    0.026   0.956    12.822   11.548    6.369
LGA    F    81_A      F    81_A     6.764     0    0.208   0.272    12.651   18.333    7.489

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:       79     316    316  100.00     632    632  100.00                79
SUMMARY(RMSD_GDC):     2.716          2.700                  3.525           64.638   57.858

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)   82   79    4.0     72    2.31    71.835    76.535     2.984

LGA_LOCAL      RMSD:   2.313  Number of atoms:   72  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   2.750  Number of assigned atoms:   79 
Std_ASGN_ATOMS RMSD:   2.716  Standard rmsd on all 79 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.880756 * X  +  -0.413434 * Y  +  -0.230958 * Z  + -12.315892
  Y_new =   0.444446 * X  +  -0.890016 * Y  +  -0.101684 * Z  +  -9.863544
  Z_new =  -0.163516 * X  +  -0.192207 * Y  +   0.967636 * Z  +  18.309835 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  2.674257  0.164254 -0.196083   [DEG:  153.2236    9.4111  -11.2347 ]
ZXZ: -1.156063  0.255109 -2.436674   [DEG:  -66.2375   14.6167 -139.6111 ]
 
# END of job
