
#######################################################
#                                                     #
#                        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  153 ( 1254),  selected   76 , name one
# Molecule2: number of CA atoms   76 (  627),  selected   76 , 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:    76       1_A - 76_A        1.75     1.75
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    76       1_A - 76_A        1.75     1.75
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    73       1_A - 73_A        0.99     1.90
  LCS_AVERAGE:     92.85

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:   76
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     M     1_A     M     1_A     73   76   76      6   56   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     K     2_A     K     2_A     73   76   76     43   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     I     3_A     I     3_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     H     4_A     H     4_A     73   76   76     24   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     E     5_A     E     5_A     73   76   76     20   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     F     6_A     F     6_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     G     7_A     G     7_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     L     8_A     L     8_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     A     9_A     A     9_A     73   76   76     42   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     L    10_A     L    10_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     F    11_A     F    11_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     G    12_A     G    12_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     E    13_A     E    13_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     H    14_A     H    14_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     Y    15_A     Y    15_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     S    16_A     S    16_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     A    17_A     A    17_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     N    18_A     N    18_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     Q    19_A     Q    19_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     F    20_A     F    20_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     A    21_A     A    21_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     K    22_A     K    22_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     I    23_A     I    23_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     L    24_A     L    24_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     I    25_A     I    25_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     N    26_A     N    26_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     K    27_A     K    27_A     73   76   76     11   59   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     D    28_A     D    28_A     73   76   76      7   51   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     G    29_A     G    29_A     73   76   76     40   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     S    30_A     S    30_A     73   76   76      7   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     N    31_A     N    31_A     73   76   76      9   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     V    32_A     V    32_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     D    33_A     D    33_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     R    34_A     R    34_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     K    35_A     K    35_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     T    36_A     T    36_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     I    37_A     I    37_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     Q    38_A     Q    38_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     N    39_A     N    39_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     W    40_A     W    40_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     I    41_A     I    41_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     N    42_A     N    42_A     73   76   76     36   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     R    43_A     R    43_A     73   76   76     12   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     D    44_A     D    44_A     73   76   76     31   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     Q    45_A     Q    45_A     73   76   76     12   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     D    46_A     D    46_A     73   76   76     22   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     L    47_A     L    47_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     N    48_A     N    48_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     D    49_A     D    49_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     W    50_A     W    50_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     V    51_A     V    51_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     I    52_A     I    52_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     V    53_A     V    53_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     Q    54_A     Q    54_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     L    55_A     L    55_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     K    56_A     K    56_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     E    57_A     E    57_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     E    58_A     E    58_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     L    59_A     L    59_A     73   76   76     42   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     L    60_A     L    60_A     73   76   76     44   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     K    61_A     K    61_A     73   76   76     43   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     R    62_A     R    62_A     73   76   76     43   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     E    63_A     E    63_A     73   76   76     43   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     V    64_A     V    64_A     73   76   76     33   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     I    65_A     I    65_A     73   76   76     36   61   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     L    66_A     L    66_A     73   76   76     11   58   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     K    67_A     K    67_A     73   76   76     11   46   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     N    68_A     N    68_A     73   76   76     11   46   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     L    69_A     L    69_A     73   76   76     15   57   69   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     L    70_A     L    70_A     73   76   76     11   24   65   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     T    71_A     T    71_A     73   76   76     11   34   64   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     N    72_A     N    72_A     73   76   76     11   36   64   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     L    73_A     L    73_A     73   76   76     11   19   54   73   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     S    74_A     S    74_A     26   76   76     11   16   29   64   74   74   74   74   74   74   74   76   76   76   76   76   76   76   76   76 
LCS_GDT     Q    75_A     Q    75_A      4   76   76      3    3    4    4    8   13   16   18   24   40   66   76   76   76   76   76   76   76   76   76 
LCS_GDT     A    76_A     A    76_A      4   76   76      3    3    4    7   11   15   17   28   54   70   74   76   76   76   76   76   76   76   76   76 
LCS_AVERAGE  LCS_A:  97.62  (  92.85  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     44     61     69     73     74     74     74     74     74     74     74     76     76     76     76     76     76     76     76     76 
GDT PERCENT_AT  57.89  80.26  90.79  96.05  97.37  97.37  97.37  97.37  97.37  97.37  97.37 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00
GDT RMS_LOCAL    0.31   0.51   0.74   0.99   1.10   1.10   1.10   1.10   1.10   1.10   1.10   1.75   1.75   1.75   1.75   1.75   1.75   1.75   1.75   1.75
GDT RMS_ALL_AT   2.45   2.34   2.13   1.90   1.85   1.85   1.85   1.85   1.85   1.85   1.85   1.75   1.75   1.75   1.75   1.75   1.75   1.75   1.75   1.75

# Checking swapping
#   possible swapping detected:  E     5_A      E     5_A
#   possible swapping detected:  E    13_A      E    13_A
#   possible swapping detected:  Y    15_A      Y    15_A
#   possible swapping detected:  D    33_A      D    33_A
#   possible swapping detected:  E    58_A      E    58_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    M     1_A      M     1_A     1.360     0    0.054   1.098     4.184   81.548   72.738
LGA    K     2_A      K     2_A     0.229     0    0.008   0.250     0.999   95.238   96.825
LGA    I     3_A      I     3_A     0.930     0    0.066   0.102     1.813   85.952   80.476
LGA    H     4_A      H     4_A     1.153     0    0.067   1.245     5.150   81.429   66.619
LGA    E     5_A      E     5_A     1.422     0    0.046   1.104     5.902   81.429   60.053
LGA    F     6_A      F     6_A     0.818     0    0.014   0.056     0.982   90.476   91.342
LGA    G     7_A      G     7_A     0.932     0    0.044   0.044     1.073   88.214   88.214
LGA    L     8_A      L     8_A     1.443     0    0.028   1.181     3.395   79.286   71.250
LGA    A     9_A      A     9_A     1.507     0    0.039   0.045     1.583   77.143   76.286
LGA    L    10_A      L    10_A     0.980     0    0.088   1.241     3.046   85.952   79.940
LGA    F    11_A      F    11_A     0.763     0    0.035   0.074     0.981   90.476   90.476
LGA    G    12_A      G    12_A     0.987     0    0.031   0.031     0.995   90.476   90.476
LGA    E    13_A      E    13_A     1.176     0    0.035   0.500     2.650   81.429   75.873
LGA    H    14_A      H    14_A     0.965     0    0.059   1.115     3.160   90.595   83.048
LGA    Y    15_A      Y    15_A     0.785     0    0.078   0.115     0.966   90.476   90.476
LGA    S    16_A      S    16_A     0.677     0    0.029   0.070     0.734   90.476   92.063
LGA    A    17_A      A    17_A     0.713     0    0.023   0.022     0.854   92.857   92.381
LGA    N    18_A      N    18_A     0.292     0    0.041   0.804     3.006  100.000   89.107
LGA    Q    19_A      Q    19_A     0.361     0    0.068   0.917     2.288  100.000   90.952
LGA    F    20_A      F    20_A     0.440     0    0.012   0.106     1.413  100.000   91.515
LGA    A    21_A      A    21_A     0.285     0    0.017   0.018     0.385  100.000  100.000
LGA    K    22_A      K    22_A     0.551     0    0.066   0.801     1.693   97.619   88.730
LGA    I    23_A      I    23_A     0.520     0    0.075   0.167     0.656   97.619   94.048
LGA    L    24_A      L    24_A     0.567     0    0.015   1.225     2.982   90.476   84.286
LGA    I    25_A      I    25_A     0.781     0    0.087   1.629     4.828   90.476   76.548
LGA    N    26_A      N    26_A     0.500     0    0.025   0.070     1.171   95.238   91.726
LGA    K    27_A      K    27_A     0.867     0    0.031   0.721     6.113   90.476   65.238
LGA    D    28_A      D    28_A     1.279     0    0.057   0.665     3.419   81.429   74.345
LGA    G    29_A      G    29_A     0.872     0    0.069   0.069     1.306   85.952   85.952
LGA    S    30_A      S    30_A     1.432     0    0.044   0.255     1.928   83.690   80.079
LGA    N    31_A      N    31_A     1.379     0    0.014   0.905     4.434   79.286   66.786
LGA    V    32_A      V    32_A     0.375     0    0.019   1.327     2.575   97.619   87.483
LGA    D    33_A      D    33_A     0.364     0    0.026   0.198     0.798  100.000   96.429
LGA    R    34_A      R    34_A     0.483     0    0.034   0.929     3.527  100.000   75.238
LGA    K    35_A      K    35_A     0.532     0    0.042   0.280     0.848   97.619   96.825
LGA    T    36_A      T    36_A     0.554     0    0.014   0.147     0.663   92.857   91.837
LGA    I    37_A      I    37_A     0.490     0    0.008   0.092     0.624   95.238   97.619
LGA    Q    38_A      Q    38_A     0.454     0    0.029   1.294     5.175   95.238   72.487
LGA    N    39_A      N    39_A     0.743     0    0.007   0.929     3.842   90.476   74.524
LGA    W    40_A      W    40_A     0.787     0    0.035   0.065     0.898   90.476   90.476
LGA    I    41_A      I    41_A     0.801     0    0.012   0.181     1.099   90.476   90.536
LGA    N    42_A      N    42_A     1.217     0    0.011   0.143     1.621   81.548   80.417
LGA    R    43_A      R    43_A     1.645     0    0.142   1.280     6.145   81.548   59.913
LGA    D    44_A      D    44_A     0.608     0    0.034   0.251     0.978   90.476   92.857
LGA    Q    45_A      Q    45_A     0.954     0    0.016   1.015     5.201   90.476   66.138
LGA    D    46_A      D    46_A     0.896     0    0.066   0.108     1.313   88.214   84.821
LGA    L    47_A      L    47_A     0.213     0    0.018   1.238     3.062  100.000   87.976
LGA    N    48_A      N    48_A     0.306     0    0.039   1.032     3.063  100.000   83.810
LGA    D    49_A      D    49_A     0.557     0    0.013   0.578     2.020   92.857   88.452
LGA    W    50_A      W    50_A     0.886     0    0.027   0.917     6.829   90.476   56.497
LGA    V    51_A      V    51_A     0.484     0    0.028   1.337     2.837   92.857   84.762
LGA    I    52_A      I    52_A     0.635     0    0.028   0.156     0.969   90.476   91.667
LGA    V    53_A      V    53_A     0.774     0    0.014   1.239     2.717   90.476   82.041
LGA    Q    54_A      Q    54_A     0.744     0    0.013   0.307     1.137   90.476   89.471
LGA    L    55_A      L    55_A     0.747     0    0.007   1.229     2.844   88.214   81.964
LGA    K    56_A      K    56_A     1.234     0    0.019   0.945     4.313   81.429   72.275
LGA    E    57_A      E    57_A     1.051     0    0.052   0.667     4.024   85.952   73.915
LGA    E    58_A      E    58_A     0.538     0    0.035   0.704     2.311   90.476   81.005
LGA    L    59_A      L    59_A     1.102     0    0.030   1.245     3.796   83.690   75.655
LGA    L    60_A      L    60_A     1.228     0    0.016   1.255     3.212   81.429   76.429
LGA    K    61_A      K    61_A     1.067     0    0.044   0.733     4.599   85.952   66.720
LGA    R    62_A      R    62_A     1.044     0    0.071   1.129     3.524   81.429   75.671
LGA    E    63_A      E    63_A     0.936     0    0.025   0.388     1.557   90.476   89.630
LGA    V    64_A      V    64_A     0.696     0    0.037   1.341     2.943   92.857   83.401
LGA    I    65_A      I    65_A     0.576     0    0.029   0.124     1.271   92.857   90.536
LGA    L    66_A      L    66_A     0.948     0    0.029   0.896     1.801   88.214   83.810
LGA    K    67_A      K    67_A     1.100     0    0.056   0.824     4.142   83.690   74.709
LGA    N    68_A      N    68_A     1.043     0    0.025   0.907     3.733   85.952   73.810
LGA    L    69_A      L    69_A     0.552     0    0.031   0.663     1.554   88.333   84.940
LGA    L    70_A      L    70_A     1.804     0    0.058   1.254     3.612   70.952   66.250
LGA    T    71_A      T    71_A     2.243     0    0.102   1.159     3.749   66.786   61.769
LGA    N    72_A      N    72_A     2.061     0    0.146   0.182     2.882   62.857   67.917
LGA    L    73_A      L    73_A     2.637     0    0.260   1.187     4.778   49.167   52.381
LGA    S    74_A      S    74_A     4.076     0    0.618   0.564     5.521   33.690   34.921
LGA    Q    75_A      Q    75_A     9.522     0    0.525   1.436    12.789    2.976    1.323
LGA    A    76_A      A    76_A     8.929     0    0.232   0.240     9.567    4.048    3.333

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:       76     304    304  100.00     627    627  100.00                76
SUMMARY(RMSD_GDC):     1.752          1.703                  2.271           85.356   78.585

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  153   76    4.0     74    1.10    93.421    96.509     6.148

LGA_LOCAL      RMSD:   1.104  Number of atoms:   74  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   1.852  Number of assigned atoms:   76 
Std_ASGN_ATOMS RMSD:   1.752  Standard rmsd on all 76 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.994846 * X  +   0.097779 * Y  +  -0.026831 * Z  +   2.819454
  Y_new =   0.092929 * X  +  -0.985138 * Y  +  -0.144453 * Z  +  -8.526124
  Z_new =  -0.040557 * X  +   0.141215 * Y  +  -0.989148 * Z  +   4.296396 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  0.093140  0.040568  2.999786   [DEG:    5.3366    2.3244  171.8751 ]
ZXZ: -0.183649  2.994135 -0.279671   [DEG:  -10.5223  171.5513  -16.0240 ]
 
# END of job
