
#######################################################
#                                                     #
#                        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   87 (  694),  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        2.92     2.92
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    76      23_A - 98_A        1.92     3.02
  LCS_AVERAGE:     95.10

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    74      25_A - 98_A        0.96     3.24
  LCS_AVERAGE:     90.25

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    5   78      2    3    3    5    5    5   10   12   13   13   14   23   27   30   35   37   46   63   77   78 
LCS_GDT     Q    22_A     Q    22_A      4    5   78      0    3    4    7    7    8   10   21   28   56   74   77   77   77   77   77   77   77   77   78 
LCS_GDT     G    23_A     G    23_A      4   76   78      3    3    4    7   12   15   17   21   60   74   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     Q    24_A     Q    24_A      4   76   78      3    4    4    7   12   15   18   51   70   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     Q    25_A     Q    25_A     74   76   78      3    4    4    6    9   14   37   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     D    26_A     D    26_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     K    27_A     K    27_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     L    28_A     L    28_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     V    29_A     V    29_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     L    30_A     L    30_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     R    31_A     R    31_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     V    32_A     V    32_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     D    33_A     D    33_A     74   76   78     18   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     G    34_A     G    34_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     I    35_A     I    35_A     74   76   78     46   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     L    36_A     L    36_A     74   76   78     46   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     N    37_A     N    37_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     E    38_A     E    38_A     74   76   78     49   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     L    39_A     L    39_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     D    40_A     D    40_A     74   76   78     46   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     A    41_A     A    41_A     74   76   78     49   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     Q    42_A     Q    42_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     V    43_A     V    43_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     L    44_A     L    44_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     E    45_A     E    45_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     G    46_A     G    46_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     I    47_A     I    47_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     L    48_A     L    48_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     T    49_A     T    49_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     R    50_A     R    50_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     L    51_A     L    51_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     N    52_A     N    52_A     74   76   78     28   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     G    53_A     G    53_A     74   76   78     42   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     V    54_A     V    54_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     R    55_A     R    55_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     Q    56_A     Q    56_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     F    57_A     F    57_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     R    58_A     R    58_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     L    59_A     L    59_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     D    60_A     D    60_A     74   76   78      9   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     R    61_A     R    61_A     74   76   78     11   28   64   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     I    62_A     I    62_A     74   76   78      9   13   48   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     S    63_A     S    63_A     74   76   78      9   33   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     G    64_A     G    64_A     74   76   78     14   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     E    65_A     E    65_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     L    66_A     L    66_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     E    67_A     E    67_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     V    68_A     V    68_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     V    69_A     V    69_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     F    70_A     F    70_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     D    71_A     D    71_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     P    72_A     P    72_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     E    73_A     E    73_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     V    74_A     V    74_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     V    75_A     V    75_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     S    76_A     S    76_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     S    77_A     S    77_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     R    78_A     R    78_A     74   76   78     22   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     S    79_A     S    79_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     L    80_A     L    80_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     V    81_A     V    81_A     74   76   78     44   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     D    82_A     D    82_A     74   76   78     44   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     G    83_A     G    83_A     74   76   78     46   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     I    84_A     I    84_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     E    85_A     E    85_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     E    86_A     E    86_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     D    87_A     D    87_A     74   76   78     26   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     G    88_A     G    88_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     F    89_A     F    89_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     G    90_A     G    90_A     74   76   78     48   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     K    91_A     K    91_A     74   76   78     41   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     F    92_A     F    92_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     K    93_A     K    93_A     74   76   78     38   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     L    94_A     L    94_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     R    95_A     R    95_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     V    96_A     V    96_A     74   76   78     50   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     M    97_A     M    97_A     74   76   78     48   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_GDT     S    98_A     S    98_A     74   76   78     37   70   71   73   73   73   73   74   74   75   76   77   77   77   77   77   77   77   77   78 
LCS_AVERAGE  LCS_A:  95.12  (  90.25   95.10  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     50     70     71     73     73     73     73     74     74     75     76     77     77     77     77     77     77     77     77     78 
GDT PERCENT_AT  64.10  89.74  91.03  93.59  93.59  93.59  93.59  94.87  94.87  96.15  97.44  98.72  98.72  98.72  98.72  98.72  98.72  98.72  98.72 100.00
GDT RMS_LOCAL    0.33   0.47   0.51   0.62   0.62   0.62   0.62   0.96   0.96   1.48   1.92   2.33   2.33   2.33   2.33   2.33   2.33   2.33   2.33   2.92
GDT RMS_ALL_AT   3.29   3.29   3.29   3.30   3.30   3.30   3.30   3.24   3.24   3.13   3.02   2.95   2.95   2.95   2.95   2.95   2.95   2.95   2.95   2.92

# Checking swapping
#   possible swapping detected:  D    26_A      D    26_A
#   possible swapping detected:  E    45_A      E    45_A
#   possible swapping detected:  F    57_A      F    57_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:  E    85_A      E    85_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    F    21_A      F    21_A    18.176     0    0.054   1.268    20.244    0.000    0.000
LGA    Q    22_A      Q    22_A    13.470     4    0.121   0.159    15.092    0.000    0.000
LGA    G    23_A      G    23_A    11.691     0    0.208   0.208    12.192    0.357    0.357
LGA    Q    24_A      Q    24_A     9.998     0    0.560   0.852    14.949    0.833    0.370
LGA    Q    25_A      Q    25_A     6.213     0    0.623   1.121    13.891   26.310   12.487
LGA    D    26_A      D    26_A     0.710     0    0.688   1.062     6.111   86.071   58.631
LGA    K    27_A      K    27_A     0.567     0    0.092   0.637     2.622   90.476   83.915
LGA    L    28_A      L    28_A     0.485     0    0.043   0.140     0.566   95.238   97.619
LGA    V    29_A      V    29_A     0.729     0    0.018   0.038     1.260   90.476   86.599
LGA    L    30_A      L    30_A     0.464     0    0.051   0.122     0.844   92.857   96.429
LGA    R    31_A      R    31_A     0.297     0    0.040   0.619     2.281  100.000   90.866
LGA    V    32_A      V    32_A     0.216     0    0.091   0.145     0.667   97.619   97.279
LGA    D    33_A      D    33_A     0.840     0    0.083   0.222     1.750   90.476   82.738
LGA    G    34_A      G    34_A     0.433     0    0.052   0.052     0.541   97.619   97.619
LGA    I    35_A      I    35_A     0.508     0    0.014   0.040     0.583   92.857   94.048
LGA    L    36_A      L    36_A     0.602     0    0.088   0.187     1.066   90.476   89.345
LGA    N    37_A      N    37_A     0.357     0    0.042   1.231     4.121  100.000   85.238
LGA    E    38_A      E    38_A     0.324     0    0.040   0.961     3.701  100.000   82.857
LGA    L    39_A      L    39_A     0.315     0    0.012   0.770     1.980  100.000   93.214
LGA    D    40_A      D    40_A     0.361     0    0.019   0.135     0.910  100.000   96.429
LGA    A    41_A      A    41_A     0.363     0    0.024   0.027     0.406  100.000  100.000
LGA    Q    42_A      Q    42_A     0.293     0    0.035   0.120     0.592  100.000   97.884
LGA    V    43_A      V    43_A     0.335     0    0.017   0.031     0.379  100.000  100.000
LGA    L    44_A      L    44_A     0.318     0    0.020   0.127     0.353  100.000  100.000
LGA    E    45_A      E    45_A     0.385     0    0.058   0.396     1.308  100.000   95.820
LGA    G    46_A      G    46_A     0.379     0    0.047   0.047     0.713   95.238   95.238
LGA    I    47_A      I    47_A     0.417     0    0.032   0.034     0.474  100.000  100.000
LGA    L    48_A      L    48_A     0.400     0    0.019   0.085     0.458  100.000  100.000
LGA    T    49_A      T    49_A     0.632     0    0.020   0.060     0.764   90.476   90.476
LGA    R    50_A      R    50_A     0.609     0    0.039   0.831     5.044   92.857   76.450
LGA    L    51_A      L    51_A     0.520     0    0.083   1.298     2.649   95.238   85.476
LGA    N    52_A      N    52_A     0.803     0    0.030   0.786     2.844   90.476   78.810
LGA    G    53_A      G    53_A     0.760     0    0.014   0.014     0.760   90.476   90.476
LGA    V    54_A      V    54_A     0.487     0    0.015   0.035     0.552   95.238   97.279
LGA    R    55_A      R    55_A     0.478     0    0.018   1.328     7.312  100.000   68.874
LGA    Q    56_A      Q    56_A     0.369     0    0.048   0.578     3.098  100.000   82.698
LGA    F    57_A      F    57_A     0.713     0    0.007   0.127     1.022   90.476   89.654
LGA    R    58_A      R    58_A     0.656     0    0.016   1.156     6.962   92.857   65.887
LGA    L    59_A      L    59_A     0.382     0    0.044   0.106     1.189   97.619   94.107
LGA    D    60_A      D    60_A     0.827     0    0.047   0.531     2.433   92.857   82.917
LGA    R    61_A      R    61_A     1.738     0    0.012   0.096     2.445   70.952   71.429
LGA    I    62_A      I    62_A     2.467     0    0.033   0.064     3.467   64.762   58.274
LGA    S    63_A      S    63_A     1.507     0    0.011   0.059     1.697   79.405   80.079
LGA    G    64_A      G    64_A     0.781     0    0.059   0.059     0.980   92.857   92.857
LGA    E    65_A      E    65_A     0.228     0    0.031   0.179     1.721  100.000   91.799
LGA    L    66_A      L    66_A     0.591     0    0.055   0.068     0.773   90.476   90.476
LGA    E    67_A      E    67_A     0.702     0    0.022   0.418     1.322   90.476   87.460
LGA    V    68_A      V    68_A     0.475     0    0.034   0.065     0.559   97.619   98.639
LGA    V    69_A      V    69_A     0.482     0    0.010   0.079     0.671  100.000   98.639
LGA    F    70_A      F    70_A     0.432     0    0.037   0.114     0.653   97.619   93.939
LGA    D    71_A      D    71_A     0.293     0    0.027   0.224     1.115  100.000   95.298
LGA    P    72_A      P    72_A     0.297     0    0.021   0.031     0.428  100.000  100.000
LGA    E    73_A      E    73_A     0.319     0    0.081   0.378     1.571   97.619   94.868
LGA    V    74_A      V    74_A     0.185     0    0.019   0.034     0.252  100.000  100.000
LGA    V    75_A      V    75_A     0.321     0    0.025   0.047     0.508  100.000   98.639
LGA    S    76_A      S    76_A     0.334     0    0.009   0.136     0.401  100.000  100.000
LGA    S    77_A      S    77_A     0.087     0    0.019   0.057     0.477  100.000  100.000
LGA    R    78_A      R    78_A     0.702     0    0.028   1.037     5.829   90.476   71.558
LGA    S    79_A      S    79_A     0.447     0    0.011   0.049     0.557   97.619   96.825
LGA    L    80_A      L    80_A     0.470     0    0.029   0.996     2.299  100.000   89.821
LGA    V    81_A      V    81_A     0.510     0    0.045   0.055     0.685   92.857   91.837
LGA    D    82_A      D    82_A     0.521     0    0.108   0.145     0.791   95.238   92.857
LGA    G    83_A      G    83_A     0.514     0    0.030   0.030     0.537   95.238   95.238
LGA    I    84_A      I    84_A     0.377     0    0.023   0.065     0.412  100.000  100.000
LGA    E    85_A      E    85_A     0.338     0    0.016   0.160     1.339  100.000   94.815
LGA    E    86_A      E    86_A     0.296     0    0.062   0.154     0.955   97.619   94.709
LGA    D    87_A      D    87_A     0.657     0    0.025   0.130     1.259   90.476   87.083
LGA    G    88_A      G    88_A     0.370     0    0.042   0.042     0.488  100.000  100.000
LGA    F    89_A      F    89_A     0.440     0    0.049   0.115     0.983   95.238   94.805
LGA    G    90_A      G    90_A     0.795     0    0.013   0.013     1.026   88.214   88.214
LGA    K    91_A      K    91_A     0.844     0    0.029   0.502     1.021   90.476   88.466
LGA    F    92_A      F    92_A     0.382     0    0.027   0.060     0.539   97.619   97.403
LGA    K    93_A      K    93_A     0.817     0    0.047   1.223     7.766   90.476   62.328
LGA    L    94_A      L    94_A     0.230     0    0.022   0.149     0.585   97.619   98.810
LGA    R    95_A      R    95_A     0.258     0    0.015   1.607     5.964  100.000   73.853
LGA    V    96_A      V    96_A     0.363     0    0.030   0.124     0.662   95.238   94.558
LGA    M    97_A      M    97_A     0.784     0    0.048   0.690     3.542   90.476   80.417
LGA    S    98_A      S    98_A     0.795     1    0.630   0.607     2.832   82.143   68.333

# 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):     2.915          2.889                  3.408           89.029   84.005

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)   87   78    4.0     74    0.96    94.231    94.676     6.956

LGA_LOCAL      RMSD:   0.964  Number of atoms:   74  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   3.237  Number of assigned atoms:   78 
Std_ASGN_ATOMS RMSD:   2.915  Standard rmsd on all 78 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.868103 * X  +  -0.493745 * Y  +   0.051115 * Z  +  -4.966455
  Y_new =   0.378903 * X  +   0.725647 * Y  +   0.574342 * Z  + -42.560596
  Z_new =  -0.320670 * X  +  -0.479221 * Y  +   0.817018 * Z  + -10.026196 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  0.411548  0.326437 -0.530470   [DEG:   23.5800   18.7035  -30.3937 ]
ZXZ:  3.052829  0.614576 -2.551873   [DEG:  174.9142   35.2126 -146.2115 ]
 
# END of job
