
#######################################################
#                                                     #
#                        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  100 (  812),  selected   78 , name one
# Molecule2: number of CA atoms   78 (  613),  selected   78 , 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:    78      21_A - 98_A        1.14     1.14
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    78      21_A - 98_A        1.14     1.14
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    77      22_A - 98_A        0.82     1.17
  LCS_AVERAGE:     97.50

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:   78
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     F    21_A     F    21_A      3   78   78      0    3    3    5    5   17   20   31   57   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     Q    22_A     Q    22_A     77   78   78      3    6   49   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     G    23_A     G    23_A     77   78   78     21   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     Q    24_A     Q    24_A     77   78   78     21   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     Q    25_A     Q    25_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     D    26_A     D    26_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     K    27_A     K    27_A     77   78   78     37   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     L    28_A     L    28_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     V    29_A     V    29_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     L    30_A     L    30_A     77   78   78     46   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     R    31_A     R    31_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     V    32_A     V    32_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     D    33_A     D    33_A     77   78   78     37   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     G    34_A     G    34_A     77   78   78     44   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     I    35_A     I    35_A     77   78   78     28   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     L    36_A     L    36_A     77   78   78     21   66   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     N    37_A     N    37_A     77   78   78     25   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     E    38_A     E    38_A     77   78   78     23   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     L    39_A     L    39_A     77   78   78     42   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     D    40_A     D    40_A     77   78   78     27   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     A    41_A     A    41_A     77   78   78     39   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     Q    42_A     Q    42_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     V    43_A     V    43_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     L    44_A     L    44_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     E    45_A     E    45_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     G    46_A     G    46_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     I    47_A     I    47_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     L    48_A     L    48_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     T    49_A     T    49_A     77   78   78     46   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     R    50_A     R    50_A     77   78   78     30   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     L    51_A     L    51_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     N    52_A     N    52_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     G    53_A     G    53_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     V    54_A     V    54_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     R    55_A     R    55_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     Q    56_A     Q    56_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     F    57_A     F    57_A     77   78   78     29   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     R    58_A     R    58_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     L    59_A     L    59_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     D    60_A     D    60_A     77   78   78     12   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     R    61_A     R    61_A     77   78   78      5   41   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     I    62_A     I    62_A     77   78   78      5   11   14   74   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     S    63_A     S    63_A     77   78   78      5   11   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     G    64_A     G    64_A     77   78   78      8   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     E    65_A     E    65_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     L    66_A     L    66_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     E    67_A     E    67_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     V    68_A     V    68_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     V    69_A     V    69_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     F    70_A     F    70_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     D    71_A     D    71_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     P    72_A     P    72_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     E    73_A     E    73_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     V    74_A     V    74_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     V    75_A     V    75_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     S    76_A     S    76_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     S    77_A     S    77_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     R    78_A     R    78_A     77   78   78     31   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     S    79_A     S    79_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     L    80_A     L    80_A     77   78   78     40   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     V    81_A     V    81_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     D    82_A     D    82_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     G    83_A     G    83_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     I    84_A     I    84_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     E    85_A     E    85_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     E    86_A     E    86_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     D    87_A     D    87_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     G    88_A     G    88_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     F    89_A     F    89_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     G    90_A     G    90_A     77   78   78     46   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     K    91_A     K    91_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     F    92_A     F    92_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     K    93_A     K    93_A     77   78   78     37   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     L    94_A     L    94_A     77   78   78     37   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     R    95_A     R    95_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     V    96_A     V    96_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     M    97_A     M    97_A     77   78   78     48   70   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_GDT     S    98_A     S    98_A     77   78   78      3   66   75   76   77   77   77   77   77   78   78   78   78   78   78   78   78   78   78   78 
LCS_AVERAGE  LCS_A:  99.17  (  97.50  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     48     70     75     76     77     77     77     77     77     78     78     78     78     78     78     78     78     78     78     78 
GDT PERCENT_AT  61.54  89.74  96.15  97.44  98.72  98.72  98.72  98.72  98.72 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00
GDT RMS_LOCAL    0.33   0.53   0.63   0.77   0.82   0.82   0.82   0.82   0.82   1.14   1.14   1.14   1.14   1.14   1.14   1.14   1.14   1.14   1.14   1.14
GDT RMS_ALL_AT   1.26   1.22   1.20   1.17   1.17   1.17   1.17   1.17   1.17   1.14   1.14   1.14   1.14   1.14   1.14   1.14   1.14   1.14   1.14   1.14

# Checking swapping
#   possible swapping detected:  F    21_A      F    21_A
#   possible swapping detected:  D    33_A      D    33_A
#   possible swapping detected:  E    45_A      E    45_A
#   possible swapping detected:  F    57_A      F    57_A
#   possible swapping detected:  D    60_A      D    60_A
#   possible swapping detected:  E    65_A      E    65_A
#   possible swapping detected:  E    67_A      E    67_A
#   possible swapping detected:  E    73_A      E    73_A
#   possible swapping detected:  D    82_A      D    82_A
#   possible swapping detected:  E    85_A      E    85_A
#   possible swapping detected:  E    86_A      E    86_A
#   possible swapping detected:  D    87_A      D    87_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    F    21_A      F    21_A     7.463     0    0.555   0.816    13.846   16.429    7.359
LGA    Q    22_A      Q    22_A     3.789     4    0.484   0.510     5.146   46.071   25.291
LGA    G    23_A      G    23_A     1.024     0    0.303   0.303     2.153   81.786   81.786
LGA    Q    24_A      Q    24_A     0.949     0    0.078   0.787     2.739   88.214   77.989
LGA    Q    25_A      Q    25_A     0.462     0    0.024   0.981     2.262   92.857   84.815
LGA    D    26_A      D    26_A     0.561     0    0.095   0.643     2.503   92.857   85.238
LGA    K    27_A      K    27_A     0.973     0    0.088   0.597     2.769   88.214   80.053
LGA    L    28_A      L    28_A     0.631     0    0.018   0.069     0.650   90.476   94.048
LGA    V    29_A      V    29_A     0.786     0    0.007   0.042     1.383   90.476   86.599
LGA    L    30_A      L    30_A     0.647     0    0.053   0.144     0.962   90.476   90.476
LGA    R    31_A      R    31_A     0.453     0    0.012   0.724     1.504  100.000   92.424
LGA    V    32_A      V    32_A     0.360     0    0.037   0.155     0.611  100.000   98.639
LGA    D    33_A      D    33_A     0.595     0    0.074   0.900     3.530   97.619   83.750
LGA    G    34_A      G    34_A     0.327     0    0.022   0.022     0.573   97.619   97.619
LGA    I    35_A      I    35_A     0.662     0    0.027   0.061     0.998   90.476   91.667
LGA    L    36_A      L    36_A     1.202     0    0.077   0.157     1.640   79.286   77.143
LGA    N    37_A      N    37_A     0.674     0    0.041   1.232     4.738   90.476   75.714
LGA    E    38_A      E    38_A     0.603     0    0.021   0.851     3.098   95.238   83.280
LGA    L    39_A      L    39_A     0.424     0    0.020   0.806     1.821   97.619   89.643
LGA    D    40_A      D    40_A     0.596     0    0.027   0.291     1.193   92.857   89.405
LGA    A    41_A      A    41_A     0.449     0    0.019   0.029     0.526   97.619   98.095
LGA    Q    42_A      Q    42_A     0.284     0    0.022   0.249     0.898  100.000   97.884
LGA    V    43_A      V    43_A     0.330     0    0.013   0.038     0.402  100.000  100.000
LGA    L    44_A      L    44_A     0.288     0    0.015   0.124     0.454  100.000  100.000
LGA    E    45_A      E    45_A     0.521     0    0.035   0.336     1.337   92.857   90.529
LGA    G    46_A      G    46_A     0.617     0    0.074   0.074     1.228   90.595   90.595
LGA    I    47_A      I    47_A     0.478     0    0.046   0.059     0.565   95.238   96.429
LGA    L    48_A      L    48_A     0.514     0    0.016   0.088     0.570   90.476   92.857
LGA    T    49_A      T    49_A     0.891     0    0.016   0.972     2.941   88.214   81.905
LGA    R    50_A      R    50_A     1.043     0    0.058   1.024     5.610   88.214   69.307
LGA    L    51_A      L    51_A     0.462     0    0.044   1.285     2.465   97.619   87.679
LGA    N    52_A      N    52_A     0.219     0    0.010   0.743     2.803  100.000   85.893
LGA    G    53_A      G    53_A     0.276     0    0.010   0.010     0.276  100.000  100.000
LGA    V    54_A      V    54_A     0.250     0    0.026   0.055     0.311  100.000  100.000
LGA    R    55_A      R    55_A     0.417     0    0.010   1.130     6.083  100.000   76.364
LGA    Q    56_A      Q    56_A     0.505     0    0.047   0.527     1.688   92.857   91.693
LGA    F    57_A      F    57_A     1.063     0    0.019   0.086     1.387   85.952   83.074
LGA    R    58_A      R    58_A     0.935     0    0.009   0.633     2.770   88.214   79.610
LGA    L    59_A      L    59_A     0.579     0    0.090   0.105     0.803   92.857   92.857
LGA    D    60_A      D    60_A     0.716     0    0.112   1.170     5.682   90.595   71.548
LGA    R    61_A      R    61_A     1.473     0    0.017   1.040     5.577   75.119   64.372
LGA    I    62_A      I    62_A     2.476     0    0.030   0.091     3.641   64.881   57.500
LGA    S    63_A      S    63_A     1.579     0    0.015   0.108     1.749   79.405   78.651
LGA    G    64_A      G    64_A     0.650     0    0.150   0.150     0.867   92.857   92.857
LGA    E    65_A      E    65_A     0.577     0    0.027   0.221     2.082   95.238   85.767
LGA    L    66_A      L    66_A     0.782     0    0.065   0.089     0.981   90.476   90.476
LGA    E    67_A      E    67_A     0.723     0    0.066   0.185     1.475   90.476   86.455
LGA    V    68_A      V    68_A     0.567     0    0.035   0.051     0.673   90.476   91.837
LGA    V    69_A      V    69_A     0.510     0    0.032   0.084     0.792   97.619   95.918
LGA    F    70_A      F    70_A     0.300     0    0.025   0.052     0.547  100.000   97.403
LGA    D    71_A      D    71_A     0.296     0    0.015   0.332     1.396  100.000   96.488
LGA    P    72_A      P    72_A     0.411     0    0.026   0.102     0.516  100.000   98.639
LGA    E    73_A      E    73_A     0.442     0    0.069   0.477     1.899   97.619   91.693
LGA    V    74_A      V    74_A     0.243     0    0.020   0.034     0.281  100.000  100.000
LGA    V    75_A      V    75_A     0.321     0    0.046   0.052     0.476  100.000  100.000
LGA    S    76_A      S    76_A     0.404     0    0.049   0.744     2.180  100.000   94.127
LGA    S    77_A      S    77_A     0.632     0    0.032   0.044     0.843   90.476   90.476
LGA    R    78_A      R    78_A     0.889     0    0.061   1.187     8.181   90.476   57.489
LGA    S    79_A      S    79_A     0.486     0    0.010   0.075     0.766   97.619   96.825
LGA    L    80_A      L    80_A     0.629     0    0.012   0.556     1.894   90.476   88.274
LGA    V    81_A      V    81_A     0.524     0    0.047   0.093     0.671   95.238   94.558
LGA    D    82_A      D    82_A     0.319     0    0.088   0.759     3.339  100.000   84.940
LGA    G    83_A      G    83_A     0.454     0    0.029   0.029     0.472  100.000  100.000
LGA    I    84_A      I    84_A     0.422     0    0.045   0.133     0.469  100.000  100.000
LGA    E    85_A      E    85_A     0.367     0    0.026   0.472     1.872  100.000   93.862
LGA    E    86_A      E    86_A     0.328     0    0.037   0.540     1.921  100.000   88.889
LGA    D    87_A      D    87_A     0.490     0    0.033   0.867     3.602  100.000   84.940
LGA    G    88_A      G    88_A     0.139     0    0.038   0.038     0.313  100.000  100.000
LGA    F    89_A      F    89_A     0.256     0    0.024   0.053     0.609   97.619   97.403
LGA    G    90_A      G    90_A     0.617     0    0.046   0.046     0.699   92.857   92.857
LGA    K    91_A      K    91_A     0.491     0    0.015   0.679     3.415  100.000   79.947
LGA    F    92_A      F    92_A     0.251     0    0.022   0.061     0.686  100.000   98.268
LGA    K    93_A      K    93_A     0.654     0    0.015   0.885     4.514   95.238   79.259
LGA    L    94_A      L    94_A     0.580     0    0.017   0.345     1.064   90.476   89.345
LGA    R    95_A      R    95_A     0.422     0    0.054   1.492     6.303  100.000   72.597
LGA    V    96_A      V    96_A     0.474     0    0.057   0.062     0.593   97.619   98.639
LGA    M    97_A      M    97_A     0.584     0    0.112   0.695     2.349   92.857   86.250
LGA    S    98_A      S    98_A     1.185     1    0.642   0.597     1.838   79.286   67.937

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:       78     312    312  100.00     613    613  100.00                78
SUMMARY(RMSD_GDC):     1.145          1.111                  1.910           92.241   86.464

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  100   78    4.0     77    0.82    96.474    98.358     8.404

LGA_LOCAL      RMSD:   0.816  Number of atoms:   77  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   1.171  Number of assigned atoms:   78 
Std_ASGN_ATOMS RMSD:   1.145  Standard rmsd on all 78 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.588870 * X  +   0.130089 * Y  +   0.797690 * Z  +  12.312138
  Y_new =   0.075501 * X  +   0.973792 * Y  +  -0.214544 * Z  + -13.691174
  Z_new =  -0.804694 * X  +   0.186565 * Y  +   0.563614 * Z  + -10.149290 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  0.127518  0.935160  0.319663   [DEG:    7.3062   53.5807   18.3153 ]
ZXZ:  1.308057  0.972041 -1.342975   [DEG:   74.9461   55.6939  -76.9468 ]
 
# END of job
