
#######################################################
#                                                     #
#                        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        1.83     1.83
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    79       3_A - 81_A        1.83     1.83
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    52       3_A - 54_A        0.99     2.53
  LCS_AVERAGE:     57.03

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     52   79   79     14   30   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     L     4_A     L     4_A     52   79   79     19   35   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     L     5_A     L     5_A     52   79   79     19   35   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     C     6_A     C     6_A     52   79   79     19   35   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     P     7_A     P     7_A     52   79   79     14   35   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     N     8_A     N     8_A     52   79   79     19   35   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     C     9_A     C     9_A     52   79   79     19   35   50   58   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     Q    10_A     Q    10_A     52   79   79     19   35   50   58   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     V    11_A     V    11_A     52   79   79      9   27   48   58   64   73   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     G    12_A     G    12_A     52   79   79     19   35   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     M    13_A     M    13_A     52   79   79     18   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     R    14_A     R    14_A     52   79   79     19   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    15_A     E    15_A     52   79   79     21   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     V    16_A     V    16_A     52   79   79     21   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    17_A     E    17_A     52   79   79     21   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     R    18_A     R    18_A     52   79   79     17   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     R    19_A     R    19_A     52   79   79      7   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     G    20_A     G    20_A     52   79   79      7   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     V    21_A     V    21_A     52   79   79      7   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     L    22_A     L    22_A     52   79   79      7   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     I    23_A     I    23_A     52   79   79     19   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     D    24_A     D    24_A     52   79   79     21   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     V    25_A     V    25_A     52   79   79     19   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     C    26_A     C    26_A     52   79   79     19   35   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     P    27_A     P    27_A     52   79   79     19   35   50   58   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     Q    28_A     Q    28_A     52   79   79     19   35   50   58   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     C    29_A     C    29_A     52   79   79     19   35   50   58   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     G    30_A     G    30_A     52   79   79     19   35   50   58   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     G    31_A     G    31_A     52   79   79      5   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     V    32_A     V    32_A     52   79   79     19   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     W    33_A     W    33_A     52   79   79     21   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     L    34_A     L    34_A     52   79   79     21   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     D    35_A     D    35_A     52   79   79     16   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     K    36_A     K    36_A     52   79   79     17   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     G    37_A     G    37_A     52   79   79     21   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    38_A     E    38_A     52   79   79     21   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     L    39_A     L    39_A     52   79   79     21   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    40_A     E    40_A     52   79   79     21   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     K    41_A     K    41_A     52   79   79     21   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     L    42_A     L    42_A     52   79   79     21   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     L    43_A     L    43_A     52   79   79     21   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     A    44_A     A    44_A     52   79   79     21   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    45_A     E    45_A     52   79   79     21   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     A    46_A     A    46_A     52   79   79     21   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    47_A     E    47_A     52   79   79     21   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    48_A     E    48_A     52   79   79     21   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     V    49_A     V    49_A     52   79   79     21   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    50_A     E    50_A     52   79   79     21   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     R    51_A     R    51_A     52   79   79     21   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     R    52_A     R    52_A     52   79   79     21   36   50   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     Y    53_A     Y    53_A     52   79   79     16   36   47   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    54_A     E    54_A     52   79   79     16   36   47   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    55_A     E    55_A     45   79   79     16   36   47   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    56_A     E    56_A     45   79   79     16   31   47   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     L    57_A     L    57_A     45   79   79     16   31   47   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    58_A     E    58_A     41   79   79     16   31   47   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     G    59_A     G    59_A     41   79   79     16   31   47   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     F    60_A     F    60_A     41   79   79     16   31   45   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     Y    61_A     Y    61_A     41   79   79     16   31   47   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     R    62_A     R    62_A     41   79   79     16   31   47   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     K    63_A     K    63_A     41   79   79     16   26   40   56   67   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    64_A     E    64_A     41   79   79     16   27   40   56   66   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     G    65_A     G    65_A     41   79   79     16   28   42   56   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     K    66_A     K    66_A     41   79   79     16   31   47   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     P    67_A     P    67_A     41   79   79     16   31   47   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     Y    68_A     Y    68_A     41   79   79      4   31   47   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     K    69_A     K    69_A     41   79   79      3   18   39   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     R    70_A     R    70_A     41   79   79      5   20   47   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     K    71_A     K    71_A     41   79   79      3   18   47   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     K    72_A     K    72_A     29   79   79      3    5    7   52   62   69   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     G    73_A     G    73_A     27   79   79      3   33   50   58   64   72   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     F    74_A     F    74_A     27   79   79     10   22   47   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     M    75_A     M    75_A      9   79   79      4    7   49   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     K    76_A     K    76_A      9   79   79      4    7   43   58   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     L    77_A     L    77_A      9   79   79      4   25   47   60   69   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     F    78_A     F    78_A      9   79   79      3    6   26   52   64   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     D    79_A     D    79_A      9   79   79      3    6   17   43   62   73   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     L    80_A     L    80_A      9   79   79      3    6   11   27   61   74   78   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     F    81_A     F    81_A      9   79   79      3    6    9   17   25   34   56   79   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_AVERAGE  LCS_A:  85.68  (  57.03  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     21     36     50     60     69     74     78     79     79     79     79     79     79     79     79     79     79     79     79     79 
GDT PERCENT_AT  26.58  45.57  63.29  75.95  87.34  93.67  98.73 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00
GDT RMS_LOCAL    0.32   0.64   0.91   1.29   1.50   1.64   1.77   1.83   1.83   1.83   1.83   1.83   1.83   1.83   1.83   1.83   1.83   1.83   1.83   1.83
GDT RMS_ALL_AT   2.21   2.18   2.72   1.89   1.85   1.84   1.84   1.83   1.83   1.83   1.83   1.83   1.83   1.83   1.83   1.83   1.83   1.83   1.83   1.83

# 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    40_A      E    40_A
#   possible swapping detected:  E    45_A      E    45_A
#   possible swapping detected:  E    48_A      E    48_A
#   possible swapping detected:  Y    53_A      Y    53_A
#   possible swapping detected:  E    54_A      E    54_A
#   possible swapping detected:  E    55_A      E    55_A
#   possible swapping detected:  E    56_A      E    56_A
#   possible swapping detected:  E    58_A      E    58_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
#   possible swapping detected:  F    74_A      F    74_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    L     3_A      L     3_A     1.493     0    0.488   1.403     7.182   71.071   46.131
LGA    L     4_A      L     4_A     1.107     0    0.023   0.917     3.767   83.690   77.857
LGA    L     5_A      L     5_A     1.644     4    0.027   0.027     1.644   79.286   39.643
LGA    C     6_A      C     6_A     1.213     0    0.015   0.068     1.752   79.286   77.143
LGA    P     7_A      P     7_A     0.838     0    0.014   0.048     1.272   85.952   91.973
LGA    N     8_A      N     8_A     1.855     0    0.117   0.739     3.291   65.357   68.095
LGA    C     9_A      C     9_A     2.609     0    0.067   0.087     2.919   59.048   58.413
LGA    Q    10_A      Q    10_A     2.501     0    0.016   1.277     4.965   59.048   52.011
LGA    V    11_A      V    11_A     3.048     0    0.049   1.114     4.745   57.262   52.517
LGA    G    12_A      G    12_A     1.854     0    0.011   0.011     2.238   70.833   70.833
LGA    M    13_A      M    13_A     0.907     0    0.009   0.931     2.782   88.214   84.048
LGA    R    14_A      R    14_A     0.883     0    0.041   1.315     7.129   90.476   63.377
LGA    E    15_A      E    15_A     0.529     0    0.005   0.734     3.477   92.857   79.683
LGA    V    16_A      V    16_A     0.470     0    0.048   0.060     0.665   95.238   94.558
LGA    E    17_A      E    17_A     0.697     0    0.014   0.418     3.013   92.857   83.069
LGA    R    18_A      R    18_A     0.388     3    0.029   0.173     1.097  100.000   68.442
LGA    R    19_A      R    19_A     0.817     5    0.023   0.389     2.314   90.476   47.013
LGA    G    20_A      G    20_A     1.450     0    0.091   0.091     1.949   81.548   81.548
LGA    V    21_A      V    21_A     1.467     0    0.020   0.057     2.242   83.690   77.891
LGA    L    22_A      L    22_A     1.582     0    0.015   0.841     4.934   72.857   62.857
LGA    I    23_A      I    23_A     1.416     0    0.062   1.125     3.954   83.690   75.655
LGA    D    24_A      D    24_A     0.879     0    0.054   0.254     1.295   85.952   87.083
LGA    V    25_A      V    25_A     1.265     0    0.066   0.109     1.633   81.429   77.755
LGA    C    26_A      C    26_A     1.619     0    0.033   0.040     1.999   75.000   74.286
LGA    P    27_A      P    27_A     2.265     0    0.035   0.058     2.874   60.952   63.741
LGA    Q    28_A      Q    28_A     2.604     0    0.057   0.121     2.629   57.143   58.836
LGA    C    29_A      C    29_A     2.582     0    0.025   0.044     2.710   57.143   59.683
LGA    G    30_A      G    30_A     2.306     0    0.054   0.054     2.306   64.762   64.762
LGA    G    31_A      G    31_A     1.555     0    0.058   0.058     1.730   72.857   72.857
LGA    V    32_A      V    32_A     1.543     0    0.049   1.099     4.052   75.000   68.980
LGA    W    33_A      W    33_A     1.036     0    0.057   0.328     2.427   81.429   80.408
LGA    L    34_A      L    34_A     1.170     0    0.053   0.710     2.343   81.429   79.405
LGA    D    35_A      D    35_A     1.177     0    0.097   1.257     4.729   81.429   70.060
LGA    K    36_A      K    36_A     1.632     0    0.006   0.901     6.719   77.143   60.212
LGA    G    37_A      G    37_A     1.268     0    0.034   0.034     1.340   81.429   81.429
LGA    E    38_A      E    38_A     0.882     0    0.010   0.961     4.261   88.214   76.190
LGA    L    39_A      L    39_A     1.181     0    0.021   0.059     1.447   81.429   81.429
LGA    E    40_A      E    40_A     1.165     0    0.027   0.190     1.571   81.429   80.476
LGA    K    41_A      K    41_A     1.166     0    0.025   0.214     1.695   81.429   80.476
LGA    L    42_A      L    42_A     1.225     0    0.007   1.356     3.900   81.429   68.810
LGA    L    43_A      L    43_A     1.269     0    0.015   0.089     1.365   81.429   81.429
LGA    A    44_A      A    44_A     1.173     0    0.034   0.035     1.173   81.429   81.429
LGA    E    45_A      E    45_A     1.269     0    0.013   0.903     3.344   81.429   73.386
LGA    A    46_A      A    46_A     1.308     0    0.028   0.028     1.440   81.429   81.429
LGA    E    47_A      E    47_A     1.107     0    0.012   0.198     1.557   83.690   81.481
LGA    E    48_A      E    48_A     1.127     0    0.023   0.898     3.437   81.429   72.434
LGA    V    49_A      V    49_A     1.204     0    0.008   0.025     1.248   81.429   81.429
LGA    E    50_A      E    50_A     1.151     0    0.008   0.595     1.972   81.429   82.487
LGA    R    51_A      R    51_A     0.901     0    0.033   1.081     5.387   90.476   71.905
LGA    R    52_A      R    52_A     0.984     0    0.025   1.300     6.325   88.214   69.134
LGA    Y    53_A      Y    53_A     1.209     0    0.024   1.181     6.607   81.429   61.349
LGA    E    54_A      E    54_A     0.820     0    0.041   0.859     4.847   90.476   73.915
LGA    E    55_A      E    55_A     0.494     0    0.004   0.086     0.780   92.857   91.534
LGA    E    56_A      E    56_A     1.213     0    0.008   0.218     3.275   83.690   72.593
LGA    L    57_A      L    57_A     1.284     0    0.036   0.047     1.847   81.429   78.214
LGA    E    58_A      E    58_A     0.962     0    0.007   0.166     1.497   85.952   89.524
LGA    G    59_A      G    59_A     1.606     0    0.012   0.012     2.112   72.976   72.976
LGA    F    60_A      F    60_A     2.126     0    0.031   1.225     5.697   66.786   51.126
LGA    Y    61_A      Y    61_A     1.814     0    0.029   0.093     2.047   70.833   76.468
LGA    R    62_A      R    62_A     2.035     0    0.030   0.739     3.308   64.881   60.000
LGA    K    63_A      K    63_A     2.869     2    0.058   0.661     5.444   57.262   40.265
LGA    E    64_A      E    64_A     2.988     0    0.054   0.527     3.587   55.357   53.228
LGA    G    65_A      G    65_A     2.761     0    0.039   0.039     2.761   60.952   60.952
LGA    K    66_A      K    66_A     2.093     3    0.040   0.064     2.322   68.810   44.974
LGA    P    67_A      P    67_A     1.718     0    0.015   0.345     2.443   75.000   71.769
LGA    Y    68_A      Y    68_A     1.668     0    0.006   0.161     1.984   75.000   77.183
LGA    K    69_A      K    69_A     1.942     2    0.050   0.536     5.076   77.143   47.037
LGA    R    70_A      R    70_A     1.256     0    0.056   1.337     7.884   81.429   56.320
LGA    K    71_A      K    71_A     1.778     0    0.655   0.934     4.485   72.857   59.683
LGA    K    72_A      K    72_A     3.614     0    0.403   0.685    10.516   55.833   34.709
LGA    G    73_A      G    73_A     3.417     0    0.608   0.608     3.716   48.333   48.333
LGA    F    74_A      F    74_A     2.003     0    0.058   1.347     7.260   68.810   45.974
LGA    M    75_A      M    75_A     1.992     0    0.017   0.635     2.902   66.786   65.833
LGA    K    76_A      K    76_A     2.555     0    0.069   0.311     5.162   62.857   50.370
LGA    L    77_A      L    77_A     1.864     0    0.055   0.312     2.150   70.833   73.988
LGA    F    78_A      F    78_A     2.773     0    0.093   0.136     3.625   53.571   50.087
LGA    D    79_A      D    79_A     3.265     0    0.061   0.255     4.560   50.119   47.798
LGA    L    80_A      L    80_A     2.924     0    0.115   1.149     6.696   50.238   43.274
LGA    F    81_A      F    81_A     4.500     0    0.156   0.144     5.269   31.786   36.883

# 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):     1.833          1.836                  2.468           75.145   67.754

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)   82   79    4.0     79    1.83    80.380    89.984     4.086

LGA_LOCAL      RMSD:   1.833  Number of atoms:   79  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   1.833  Number of assigned atoms:   79 
Std_ASGN_ATOMS RMSD:   1.833  Standard rmsd on all 79 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.604297 * X  +  -0.523175 * Y  +   0.600926 * Z  + -11.629548
  Y_new =   0.776926 * X  +   0.554155 * Y  +  -0.298828 * Z  +  -7.923694
  Z_new =  -0.176667 * X  +   0.647456 * Y  +   0.741343 * Z  +  19.309874 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  0.909736  0.177599  0.717898   [DEG:   52.1240   10.1757   41.1325 ]
ZXZ:  1.109327  0.735727 -0.266378   [DEG:   63.5598   42.1541  -15.2624 ]
 
# END of job
