
#######################################################
#                                                     #
#                        LGA                          #
#                  ---------------                    #
#                                                     #
#               Local-Global Alignment                #
#        A Method for Finding 3-D Similarities        #
#               in Protein Structures                 #
#                                                     #
#                  ------------ 10/2009               #
#                                                     #
#      Adam Zemla (adamz@llnl.gov)                    #
#      Lawrence Livermore National Laboratory, CA     #
#                                                     #
#######################################################

!!!   License for LGA program has expired  !!!
#   For updated version of the LGA program   #
# please contact Adam Zemla:  adamz@llnl.gov #

# Molecule1: number of CA atoms  103 (  821),  selected   79 , name one
# Molecule2: number of CA atoms   79 (  633),  selected   79 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:A  -ch2:A  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    79      23_A - 101_A       1.72     1.72
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    79      23_A - 101_A       1.72     1.72
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    77      23_A - 99_A        0.80     1.83
  LCS_AVERAGE:     95.10

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:   79
LCS_GDT     RESIDUE       RESIDUE       SEGMENT_SIZE    GLOBAL DISTANCE TEST COLUMNS: number of residues under the threshold assigned to each residue pair
LCS_GDT   NAME NUMBER   NAME NUMBER    1.0  2.0  5.0    0.5  1.0  1.5  2.0  2.5  3.0  3.5  4.0  4.5  5.0  5.5  6.0  6.5  7.0  7.5  8.0  8.5  9.0  9.5 10.0
LCS_GDT     G    23_A     G    23_A     77   79   79      4   59   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     G    24_A     G    24_A     77   79   79     44   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     S    25_A     S    25_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     M    26_A     M    26_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     K    27_A     K    27_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     I    28_A     I    28_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     Y    29_A     Y    29_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     V    30_A     V    30_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     K    31_A     K    31_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     L    32_A     L    32_A     77   79   79     38   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     Q    33_A     Q    33_A     77   79   79     15   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     D    34_A     D    34_A     77   79   79     12   66   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     G    35_A     G    35_A     77   79   79     31   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     T    36_A     T    36_A     77   79   79     49   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     V    37_A     V    37_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     I    38_A     I    38_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     E    39_A     E    39_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     L    40_A     L    40_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     E    41_A     E    41_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     V    42_A     V    42_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     E    43_A     E    43_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     P    44_A     P    44_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     S    45_A     S    45_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     D    46_A     D    46_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     T    47_A     T    47_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     I    48_A     I    48_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     L    49_A     L    49_A     77   79   79     54   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     E    50_A     E    50_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     V    51_A     V    51_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     K    52_A     K    52_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     E    53_A     E    53_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     K    54_A     K    54_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     I    55_A     I    55_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     Y    56_A     Y    56_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     E    57_A     E    57_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     K    58_A     K    58_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     T    59_A     T    59_A     77   79   79     36   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     G    60_A     G    60_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     I    61_A     I    61_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     P    62_A     P    62_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     P    63_A     P    63_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     E    64_A     E    64_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     D    65_A     D    65_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     Q    66_A     Q    66_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     I    67_A     I    67_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     L    68_A     L    68_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     I    69_A     I    69_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     Y    70_A     Y    70_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     K    71_A     K    71_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     G    72_A     G    72_A     77   79   79     54   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     K    73_A     K    73_A     77   79   79      8   67   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     V    74_A     V    74_A     77   79   79     37   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     L    75_A     L    75_A     77   79   79     36   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     E    76_A     E    76_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     D    77_A     D    77_A     77   79   79     10   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     S    78_A     S    78_A     77   79   79     49   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     K    79_A     K    79_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     T    80_A     T    80_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     L    81_A     L    81_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     A    82_A     A    82_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     D    83_A     D    83_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     Y    84_A     Y    84_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     N    85_A     N    85_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     I    86_A     I    86_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     Q    87_A     Q    87_A     77   79   79      6   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     E    88_A     E    88_A     77   79   79     51   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     N    89_A     N    89_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     D    90_A     D    90_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     V    91_A     V    91_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     L    92_A     L    92_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     Y    93_A     Y    93_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     L    94_A     L    94_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     V    95_A     V    95_A     77   79   79     56   68   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     R    96_A     R    96_A     77   79   79     20   67   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     R    97_A     R    97_A     77   79   79      5   60   73   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     L    98_A     L    98_A     77   79   79      5    6   36   73   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     K    99_A     K    99_A     77   79   79      5   33   72   76   77   77   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     S   100_A     S   100_A      3   79   79      0    3    9   32   57   75   78   78   78   78   78   78   78   78   79   79   79   79   79   79 
LCS_GDT     P   101_A     P   101_A      3   79   79      1    2    3    5    8   11   12   12   12   21   25   35   67   78   79   79   79   79   79   79 
LCS_AVERAGE  LCS_A:  98.37  (  95.10  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     56     68     73     76     77     77     78     78     78     78     78     78     78     78     79     79     79     79     79     79 
GDT PERCENT_AT  70.89  86.08  92.41  96.20  97.47  97.47  98.73  98.73  98.73  98.73  98.73  98.73  98.73  98.73 100.00 100.00 100.00 100.00 100.00 100.00
GDT RMS_LOCAL    0.27   0.41   0.52   0.67   0.80   0.80   1.09   1.09   1.09   1.09   1.09   1.09   1.09   1.09   1.72   1.72   1.72   1.72   1.72   1.72
GDT RMS_ALL_AT   1.91   1.92   1.92   1.86   1.83   1.83   1.76   1.76   1.76   1.76   1.76   1.76   1.76   1.76   1.72   1.72   1.72   1.72   1.72   1.72

# Checking swapping
#   possible swapping detected:  E    39_A      E    39_A
#   possible swapping detected:  E    41_A      E    41_A
#   possible swapping detected:  E    88_A      E    88_A
#   possible swapping detected:  D    90_A      D    90_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    G    23_A      G    23_A     1.799     0    0.160   0.160     1.799   77.143   77.143
LGA    G    24_A      G    24_A     0.642     0    0.092   0.092     0.846   90.476   90.476
LGA    S    25_A      S    25_A     0.768     0    0.065   0.607     3.014   88.214   80.714
LGA    M    26_A      M    26_A     0.846     0    0.039   0.671     1.767   90.476   87.143
LGA    K    27_A      K    27_A     0.537     0    0.041   1.114     5.278   92.857   79.153
LGA    I    28_A      I    28_A     0.283     0    0.053   0.895     2.721  100.000   88.810
LGA    Y    29_A      Y    29_A     0.244     0    0.019   0.122     0.829  100.000   96.825
LGA    V    30_A      V    30_A     0.175     0    0.052   0.061     0.288  100.000  100.000
LGA    K    31_A      K    31_A     0.446     0    0.032   0.218     1.969   95.238   89.630
LGA    L    32_A      L    32_A     1.155     0    0.033   0.129     1.326   83.690   82.560
LGA    Q    33_A      Q    33_A     1.708     0    0.034   0.958     7.906   72.857   50.159
LGA    D    34_A      D    34_A     1.886     0    0.156   1.062     3.914   75.000   68.214
LGA    G    35_A      G    35_A     1.338     0    0.119   0.119     1.583   79.286   79.286
LGA    T    36_A      T    36_A     0.817     0    0.042   1.024     2.988   88.214   81.905
LGA    V    37_A      V    37_A     0.362     0    0.015   0.101     0.744  100.000   97.279
LGA    I    38_A      I    38_A     0.249     0    0.038   1.381     3.867  100.000   83.155
LGA    E    39_A      E    39_A     0.277     0    0.036   1.214     4.848  100.000   77.354
LGA    L    40_A      L    40_A     0.311     0    0.054   0.084     0.409  100.000  100.000
LGA    E    41_A      E    41_A     0.580     0    0.043   0.839     2.186   92.857   85.714
LGA    V    42_A      V    42_A     0.405     0    0.019   0.117     0.849   92.857   94.558
LGA    E    43_A      E    43_A     0.409     0    0.031   0.977     4.117   95.238   78.148
LGA    P    44_A      P    44_A     0.527     0    0.043   0.112     0.986   95.238   93.197
LGA    S    45_A      S    45_A     0.458     0    0.072   0.157     1.025   95.238   92.143
LGA    D    46_A      D    46_A     0.335     0    0.051   0.248     1.356  100.000   96.488
LGA    T    47_A      T    47_A     0.434     0    0.043   0.039     0.747  100.000   95.918
LGA    I    48_A      I    48_A     0.579     0    0.036   0.118     0.982   90.476   90.476
LGA    L    49_A      L    49_A     0.863     0    0.032   1.429     3.400   90.476   77.917
LGA    E    50_A      E    50_A     0.650     0    0.035   0.750     4.426   95.238   77.302
LGA    V    51_A      V    51_A     0.382     0    0.030   0.111     0.444  100.000  100.000
LGA    K    52_A      K    52_A     0.480     0    0.031   0.068     1.184   97.619   92.646
LGA    E    53_A      E    53_A     0.539     0    0.041   0.467     2.322   95.238   83.915
LGA    K    54_A      K    54_A     0.356     0    0.041   0.092     1.220  100.000   94.762
LGA    I    55_A      I    55_A     0.316     0    0.029   0.083     0.517  100.000   98.810
LGA    Y    56_A      Y    56_A     0.436     0    0.035   0.244     0.960  100.000   95.238
LGA    E    57_A      E    57_A     0.411     0    0.105   0.178     1.218  100.000   92.698
LGA    K    58_A      K    58_A     0.534     0    0.142   0.479     1.926   92.857   88.571
LGA    T    59_A      T    59_A     0.791     0    0.053   1.222     2.400   90.476   83.129
LGA    G    60_A      G    60_A     0.956     0    0.076   0.076     1.033   88.214   88.214
LGA    I    61_A      I    61_A     0.638     0    0.062   0.077     0.678   90.476   94.048
LGA    P    62_A      P    62_A     0.484     0    0.031   0.110     1.025   95.238   91.905
LGA    P    63_A      P    63_A     0.399     0    0.042   0.063     0.524  100.000   97.279
LGA    E    64_A      E    64_A     0.491     0    0.069   0.812     3.384  100.000   87.249
LGA    D    65_A      D    65_A     0.374     0    0.183   0.309     1.370   97.619   91.786
LGA    Q    66_A      Q    66_A     0.417     0    0.049   0.079     0.520   97.619   98.942
LGA    I    67_A      I    67_A     0.487     0    0.017   1.066     2.426   97.619   84.405
LGA    L    68_A      L    68_A     0.309     0    0.043   0.108     0.462  100.000  100.000
LGA    I    69_A      I    69_A     0.327     0    0.031   0.090     0.886  100.000   97.619
LGA    Y    70_A      Y    70_A     0.266     0    0.032   0.264     1.801  100.000   90.754
LGA    K    71_A      K    71_A     0.573     0    0.058   1.322     7.485   95.238   72.011
LGA    G    72_A      G    72_A     0.763     0    0.073   0.073     1.148   88.214   88.214
LGA    K    73_A      K    73_A     1.061     0    0.022   0.926     2.816   88.214   76.243
LGA    V    74_A      V    74_A     0.725     0    0.045   0.126     1.027   88.214   87.891
LGA    L    75_A      L    75_A     0.803     0    0.085   0.120     1.107   90.476   88.214
LGA    E    76_A      E    76_A     0.477     0    0.097   0.484     2.110  100.000   88.836
LGA    D    77_A      D    77_A     0.958     0    0.652   0.730     3.599   76.429   81.190
LGA    S    78_A      S    78_A     0.895     0    0.097   0.700     3.046   88.214   82.222
LGA    K    79_A      K    79_A     0.569     0    0.069   0.195     1.739   92.857   88.571
LGA    T    80_A      T    80_A     0.264     0    0.049   1.001     2.184  100.000   89.932
LGA    L    81_A      L    81_A     0.479     0    0.055   0.110     0.695   95.238   96.429
LGA    A    82_A      A    82_A     0.721     0    0.025   0.039     0.847   90.476   90.476
LGA    D    83_A      D    83_A     0.702     0    0.039   0.253     1.102   90.476   89.345
LGA    Y    84_A      Y    84_A     0.643     0    0.109   0.241     1.753   90.476   87.540
LGA    N    85_A      N    85_A     0.649     0    0.057   0.675     3.085   90.476   78.036
LGA    I    86_A      I    86_A     0.593     0    0.030   0.085     0.867   90.476   94.048
LGA    Q    87_A      Q    87_A     1.281     0    0.040   0.525     3.141   83.690   75.185
LGA    E    88_A      E    88_A     0.966     0    0.082   1.306     6.219   88.214   63.915
LGA    N    89_A      N    89_A     0.375     0    0.083   0.414     1.354   97.619   94.107
LGA    D    90_A      D    90_A     0.328     0    0.060   0.896     4.018  100.000   82.381
LGA    V    91_A      V    91_A     0.165     0    0.026   1.105     2.507  100.000   88.844
LGA    L    92_A      L    92_A     0.245     0    0.032   1.092     2.473  100.000   90.000
LGA    Y    93_A      Y    93_A     0.219     0    0.021   0.211     2.122  100.000   87.857
LGA    L    94_A      L    94_A     0.302     0    0.030   0.065     0.453  100.000  100.000
LGA    V    95_A      V    95_A     0.198     0    0.079   0.133     0.571  100.000   98.639
LGA    R    96_A      R    96_A     0.785     0    0.061   0.639     3.159   83.810   69.740
LGA    R    97_A      R    97_A     1.198     0    0.049   1.187     5.880   77.381   63.550
LGA    L    98_A      L    98_A     3.281     0    0.192   0.874     8.570   57.262   35.952
LGA    K    99_A      K    99_A     2.103     0    0.611   1.407     7.317   49.167   35.556
LGA    S   100_A      S   100_A     6.395     0    0.263   0.354     8.367   14.524   12.540
LGA    P   101_A      P   101_A    12.345     0    0.653   0.752    14.903    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:       79     316    316  100.00     633    633  100.00                79
SUMMARY(RMSD_GDC):     1.725          1.700                  2.209           90.268   83.811

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  103   79    4.0     78    1.09    95.253    97.324     6.533

LGA_LOCAL      RMSD:   1.094  Number of atoms:   78  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   1.764  Number of assigned atoms:   79 
Std_ASGN_ATOMS RMSD:   1.725  Standard rmsd on all 79 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.312701 * X  +   0.134579 * Y  +  -0.940269 * Z  + -18.769913
  Y_new =   0.869824 * X  +  -0.438273 * Y  +   0.226544 * Z  +  -8.324275
  Z_new =  -0.381607 * X  +  -0.888710 * Y  +  -0.254109 * Z  +  17.637589 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  1.225684  0.391534 -1.849295   [DEG:   70.2265   22.4332 -105.9568 ]
ZXZ: -1.807226  1.827722 -2.736006   [DEG: -103.5464  104.7208 -156.7616 ]
 
# END of job
