
#######################################################
#                                                     #
#                        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        2.55     2.55
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    58       3_A - 60_A        1.97     3.02
  LCS_AVERAGE:     71.58

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    37      33_A - 69_A        0.97     4.49
  LONGEST_CONTINUOUS_SEGMENT:    37      34_A - 70_A        0.97     4.70
  LCS_AVERAGE:     41.21

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     34   58   79      4   25   30   36   43   53   66   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     L     4_A     L     4_A     34   58   79     19   29   35   43   52   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     L     5_A     L     5_A     34   58   79     19   29   35   43   50   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     C     6_A     C     6_A     34   58   79     19   29   35   43   53   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     P     7_A     P     7_A     34   58   79     13   29   35   43   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     N     8_A     N     8_A     34   58   79     16   29   35   43   51   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     C     9_A     C     9_A     34   58   79     19   29   35   43   50   58   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     Q    10_A     Q    10_A     34   58   79     17   29   35   43   50   58   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     V    11_A     V    11_A     34   58   79     16   29   35   43   50   58   67   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     G    12_A     G    12_A     34   58   79     19   29   35   43   50   59   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     M    13_A     M    13_A     34   58   79     19   29   35   43   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     R    14_A     R    14_A     34   58   79     19   29   35   43   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    15_A     E    15_A     34   58   79     17   29   35   45   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     V    16_A     V    16_A     34   58   79     19   29   35   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    17_A     E    17_A     34   58   79     19   29   35   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     R    18_A     R    18_A     34   58   79      6   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     R    19_A     R    19_A     34   58   79      6   24   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     G    20_A     G    20_A     34   58   79      7   28   35   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     V    21_A     V    21_A     34   58   79     16   29   35   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     L    22_A     L    22_A     34   58   79     14   29   35   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     I    23_A     I    23_A     34   58   79     19   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     D    24_A     D    24_A     34   58   79     19   29   35   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     V    25_A     V    25_A     34   58   79     19   29   35   43   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     C    26_A     C    26_A     34   58   79     19   29   35   43   53   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     P    27_A     P    27_A     34   58   79     19   29   35   43   50   59   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     Q    28_A     Q    28_A     34   58   79     19   29   35   43   50   58   67   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     C    29_A     C    29_A     34   58   79     19   29   35   43   50   58   67   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     G    30_A     G    30_A     34   58   79     19   29   35   43   50   58   68   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     G    31_A     G    31_A     34   58   79     11   29   35   44   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     V    32_A     V    32_A     34   58   79     19   29   35   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     W    33_A     W    33_A     37   58   79     19   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     L    34_A     L    34_A     37   58   79     18   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     D    35_A     D    35_A     37   58   79      5   27   35   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     K    36_A     K    36_A     37   58   79      3   28   35   44   54   60   68   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     G    37_A     G    37_A     37   58   79     18   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    38_A     E    38_A     37   58   79     18   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     L    39_A     L    39_A     37   58   79     18   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    40_A     E    40_A     37   58   79     18   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     K    41_A     K    41_A     37   58   79     18   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     L    42_A     L    42_A     37   58   79     18   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     L    43_A     L    43_A     37   58   79     18   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     A    44_A     A    44_A     37   58   79     18   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    45_A     E    45_A     37   58   79     18   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     A    46_A     A    46_A     37   58   79     18   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    47_A     E    47_A     37   58   79     18   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    48_A     E    48_A     37   58   79     18   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     V    49_A     V    49_A     37   58   79     18   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    50_A     E    50_A     37   58   79     18   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     R    51_A     R    51_A     37   58   79     18   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     R    52_A     R    52_A     37   58   79     18   25   34   44   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     Y    53_A     Y    53_A     37   58   79     18   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    54_A     E    54_A     37   58   79     18   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    55_A     E    55_A     37   58   79     17   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    56_A     E    56_A     37   58   79     17   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     L    57_A     L    57_A     37   58   79     17   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    58_A     E    58_A     37   58   79     17   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     G    59_A     G    59_A     37   58   79     17   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     F    60_A     F    60_A     37   58   79     17   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     Y    61_A     Y    61_A     37   56   79     17   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     R    62_A     R    62_A     37   55   79     17   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     K    63_A     K    63_A     37   55   79     17   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    64_A     E    64_A     37   55   79     17   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     G    65_A     G    65_A     37   55   79     17   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     K    66_A     K    66_A     37   55   79     17   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     P    67_A     P    67_A     37   55   79      4   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     Y    68_A     Y    68_A     37   55   79      4   29   36   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     K    69_A     K    69_A     37   51   79      3   17   24   38   47   57   68   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     R    70_A     R    70_A     37   51   79      3   17   24   42   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     K    71_A     K    71_A     35   51   79      3   13   23   42   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     K    72_A     K    72_A     25   51   79      3    5   18   27   34   54   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     G    73_A     G    73_A     24   51   79      4   24   34   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     F    74_A     F    74_A      8   51   79      4   11   22   29   52   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     M    75_A     M    75_A      8   51   79      4    7   13   46   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     K    76_A     K    76_A      8   51   79      4   17   34   45   54   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     L    77_A     L    77_A      8   51   79      4    7   23   29   47   59   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     F    78_A     F    78_A      8   51   79      3    7   22   29   35   56   68   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     D    79_A     D    79_A      8   51   79      3    7   22   32   48   61   69   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     L    80_A     L    80_A      8   51   79      3   13   23   28   34   39   49   76   78   78   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     F    81_A     F    81_A      6   50   79      3    3    8   13   23   30   35   45   72   77   79   79   79   79   79   79   79   79   79   79 
LCS_AVERAGE  LCS_A:  70.93  (  41.21   71.58  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     19     29     36     46     54     61     69     76     78     78     79     79     79     79     79     79     79     79     79     79 
GDT PERCENT_AT  24.05  36.71  45.57  58.23  68.35  77.22  87.34  96.20  98.73  98.73 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00
GDT RMS_LOCAL    0.30   0.54   0.96   1.28   1.52   1.87   2.21   2.42   2.48   2.48   2.55   2.55   2.55   2.55   2.55   2.55   2.55   2.55   2.55   2.55
GDT RMS_ALL_AT   9.11   8.61   3.72   3.30   3.15   2.74   2.58   2.56   2.56   2.56   2.55   2.55   2.55   2.55   2.55   2.55   2.55   2.55   2.55   2.55

# Checking swapping
#   possible swapping detected:  E    15_A      E    15_A
#   possible swapping detected:  E    17_A      E    17_A
#   possible swapping detected:  E    40_A      E    40_A
#   possible swapping detected:  E    45_A      E    45_A
#   possible swapping detected:  E    54_A      E    54_A
#   possible swapping detected:  E    55_A      E    55_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     3.889     0    0.487   1.381     9.897   40.714   23.631
LGA    L     4_A      L     4_A     2.451     0    0.062   1.366     4.312   62.857   56.667
LGA    L     5_A      L     5_A     2.682     4    0.029   0.029     2.682   62.976   31.488
LGA    C     6_A      C     6_A     1.801     0    0.031   0.124     2.162   68.810   67.460
LGA    P     7_A      P     7_A     1.336     0    0.037   0.179     1.658   75.000   79.116
LGA    N     8_A      N     8_A     2.560     0    0.139   0.826     4.297   54.286   56.667
LGA    C     9_A      C     9_A     3.663     0    0.012   0.108     4.349   43.452   43.413
LGA    Q    10_A      Q    10_A     3.676     0    0.123   1.108     5.540   45.000   37.672
LGA    V    11_A      V    11_A     4.145     0    0.060   0.105     4.987   43.452   40.816
LGA    G    12_A      G    12_A     3.071     0    0.014   0.014     3.419   53.571   53.571
LGA    M    13_A      M    13_A     1.538     0    0.054   0.959     3.485   68.810   72.321
LGA    R    14_A      R    14_A     1.204     0    0.120   1.218     5.356   83.690   65.671
LGA    E    15_A      E    15_A     0.555     0    0.020   0.726     2.310   92.857   83.757
LGA    V    16_A      V    16_A     0.968     0    0.038   0.067     1.296   85.952   85.306
LGA    E    17_A      E    17_A     1.587     0    0.029   0.204     1.890   79.405   75.767
LGA    R    18_A      R    18_A     1.657     3    0.029   0.149     2.015   70.833   54.589
LGA    R    19_A      R    19_A     1.794     5    0.034   0.404     2.331   68.810   37.532
LGA    G    20_A      G    20_A     2.395     0    0.101   0.101     2.795   60.952   60.952
LGA    V    21_A      V    21_A     3.075     0    0.049   0.082     3.694   57.262   52.245
LGA    L    22_A      L    22_A     2.456     0    0.074   0.836     4.685   62.857   55.893
LGA    I    23_A      I    23_A     1.991     0    0.054   0.276     2.833   77.381   70.119
LGA    D    24_A      D    24_A     0.964     0    0.042   0.261     2.199   85.952   81.667
LGA    V    25_A      V    25_A     1.295     0    0.037   0.087     1.941   83.690   79.048
LGA    C    26_A      C    26_A     1.984     0    0.018   0.052     2.695   66.905   64.921
LGA    P    27_A      P    27_A     3.163     0    0.011   0.045     4.081   46.905   49.252
LGA    Q    28_A      Q    28_A     4.177     0    0.082   0.855     4.447   38.690   39.206
LGA    C    29_A      C    29_A     3.958     0    0.057   0.089     4.124   41.786   44.603
LGA    G    30_A      G    30_A     3.517     0    0.023   0.023     3.550   46.667   46.667
LGA    G    31_A      G    31_A     2.177     0    0.126   0.126     2.593   66.905   66.905
LGA    V    32_A      V    32_A     1.960     0    0.055   1.107     4.458   68.810   64.286
LGA    W    33_A      W    33_A     1.688     0    0.071   1.105     5.877   72.857   57.891
LGA    L    34_A      L    34_A     2.300     0    0.103   0.662     3.244   62.857   62.024
LGA    D    35_A      D    35_A     2.506     0    0.071   0.209     2.678   60.952   62.857
LGA    K    36_A      K    36_A     3.470     0    0.587   1.005     9.086   41.190   31.481
LGA    G    37_A      G    37_A     1.994     0    0.093   0.093     2.144   68.810   68.810
LGA    E    38_A      E    38_A     2.208     0    0.032   1.064     2.561   64.762   65.767
LGA    L    39_A      L    39_A     1.795     0    0.025   0.035     1.926   72.857   73.929
LGA    E    40_A      E    40_A     1.540     0    0.017   0.056     1.829   72.857   77.672
LGA    K    41_A      K    41_A     2.197     0    0.063   0.183     3.279   64.762   61.429
LGA    L    42_A      L    42_A     2.201     0    0.009   1.385     5.670   68.810   55.238
LGA    L    43_A      L    43_A     1.421     0    0.054   0.077     1.601   79.286   81.488
LGA    A    44_A      A    44_A     1.771     0    0.061   0.071     2.014   70.833   71.238
LGA    E    45_A      E    45_A     2.480     0    0.034   0.949     3.157   64.762   63.175
LGA    A    46_A      A    46_A     1.911     0    0.051   0.055     2.086   75.119   74.667
LGA    E    47_A      E    47_A     1.117     0    0.037   0.686     2.231   81.429   77.725
LGA    E    48_A      E    48_A     2.114     0    0.030   1.122     4.725   66.786   50.847
LGA    V    49_A      V    49_A     2.136     0    0.031   0.046     2.818   68.810   65.986
LGA    E    50_A      E    50_A     1.065     0    0.032   0.571     2.700   85.952   73.651
LGA    R    51_A      R    51_A     1.346     0    0.041   0.987     5.668   79.286   57.229
LGA    R    52_A      R    52_A     1.960     0    0.037   1.428     7.286   72.857   55.238
LGA    Y    53_A      Y    53_A     1.339     0    0.007   0.332     3.204   85.952   71.508
LGA    E    54_A      E    54_A     0.558     0    0.077   0.805     3.820   95.238   82.540
LGA    E    55_A      E    55_A     0.627     0    0.039   0.255     1.563   95.238   87.619
LGA    E    56_A      E    56_A     0.785     0    0.019   0.883     4.356   88.214   66.138
LGA    L    57_A      L    57_A     1.216     0    0.055   0.054     1.972   81.548   78.274
LGA    E    58_A      E    58_A     1.284     0    0.030   0.806     3.997   81.548   71.746
LGA    G    59_A      G    59_A     0.875     0    0.057   0.057     1.504   83.810   83.810
LGA    F    60_A      F    60_A     1.736     0    0.058   1.245     4.657   70.952   59.740
LGA    Y    61_A      Y    61_A     2.524     0    0.015   0.216     3.377   59.048   55.397
LGA    R    62_A      R    62_A     2.429     0    0.021   1.207     6.060   62.857   53.939
LGA    K    63_A      K    63_A     2.397     2    0.051   0.673     4.062   60.952   46.508
LGA    E    64_A      E    64_A     3.225     0    0.019   0.322     3.670   50.119   50.053
LGA    G    65_A      G    65_A     3.495     0    0.113   0.113     3.495   50.000   50.000
LGA    K    66_A      K    66_A     3.235     3    0.048   0.085     3.424   50.000   33.333
LGA    P    67_A      P    67_A     2.939     0    0.116   0.399     3.875   57.143   54.150
LGA    Y    68_A      Y    68_A     3.062     0    0.027   0.060     3.386   50.000   62.540
LGA    K    69_A      K    69_A     4.074     2    0.087   0.543     7.193   45.119   26.138
LGA    R    70_A      R    70_A     2.797     0    0.134   1.246     8.304   55.357   41.039
LGA    K    71_A      K    71_A     2.443     0    0.671   0.957     4.961   71.310   54.603
LGA    K    72_A      K    72_A     3.757     0    0.349   0.727    11.299   50.238   29.841
LGA    G    73_A      G    73_A     1.801     0    0.578   0.578     2.699   66.905   66.905
LGA    F    74_A      F    74_A     2.792     0    0.051   1.322     8.687   60.952   33.074
LGA    M    75_A      M    75_A     1.991     0    0.087   0.916     2.478   70.833   69.821
LGA    K    76_A      K    76_A     2.367     0    0.126   0.430     6.563   60.952   46.138
LGA    L    77_A      L    77_A     3.196     0    0.061   0.170     4.690   51.786   44.643
LGA    F    78_A      F    78_A     3.633     0    0.186   0.644     6.941   43.452   30.909
LGA    D    79_A      D    79_A     3.061     0    0.069   0.184     3.523   48.333   57.679
LGA    L    80_A      L    80_A     4.451     0    0.028   0.990     9.931   32.024   21.131
LGA    F    81_A      F    81_A     6.065     0    0.236   0.316     8.825   19.405   11.472

# 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):     2.554          2.560                  3.250           64.561   57.851

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)   82   79    4.0     76    2.42    72.785    76.388     3.014

LGA_LOCAL      RMSD:   2.422  Number of atoms:   76  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   2.563  Number of assigned atoms:   79 
Std_ASGN_ATOMS RMSD:   2.554  Standard rmsd on all 79 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.652904 * X  +  -0.151205 * Y  +  -0.742195 * Z  + -11.356556
  Y_new =  -0.326517 * X  +   0.940338 * Y  +   0.095663 * Z  +  -9.475954
  Z_new =   0.683449 * X  +   0.304798 * Y  +  -0.663321 * Z  +  19.189198 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -2.677866 -0.752477  2.710865   [DEG: -153.4304  -43.1138  155.3211 ]
ZXZ: -1.698982  2.296045  1.151299   [DEG:  -97.3445  131.5537   65.9646 ]
 
# END of job
