
#######################################################
#                                                     #
#                        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        1.10     1.10
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    76       1_A - 76_A        1.10     1.10
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    75       1_A - 75_A        0.97     1.11
  LCS_AVERAGE:     97.45

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     75   76   76      9   64   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     K     2_A     K     2_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     I     3_A     I     3_A     75   76   76     37   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     H     4_A     H     4_A     75   76   76     28   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     E     5_A     E     5_A     75   76   76     28   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     F     6_A     F     6_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     G     7_A     G     7_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     L     8_A     L     8_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     A     9_A     A     9_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     L    10_A     L    10_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     F    11_A     F    11_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     G    12_A     G    12_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     E    13_A     E    13_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     H    14_A     H    14_A     75   76   76     37   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     Y    15_A     Y    15_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     S    16_A     S    16_A     75   76   76     37   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     A    17_A     A    17_A     75   76   76     37   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     N    18_A     N    18_A     75   76   76     37   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     Q    19_A     Q    19_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     F    20_A     F    20_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     A    21_A     A    21_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     K    22_A     K    22_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     I    23_A     I    23_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     L    24_A     L    24_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     I    25_A     I    25_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     N    26_A     N    26_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     K    27_A     K    27_A     75   76   76     34   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     D    28_A     D    28_A     75   76   76     10   58   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     G    29_A     G    29_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     S    30_A     S    30_A     75   76   76     28   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     N    31_A     N    31_A     75   76   76     17   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     V    32_A     V    32_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     D    33_A     D    33_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     R    34_A     R    34_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     K    35_A     K    35_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     T    36_A     T    36_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     I    37_A     I    37_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     Q    38_A     Q    38_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     N    39_A     N    39_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     W    40_A     W    40_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     I    41_A     I    41_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     N    42_A     N    42_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     R    43_A     R    43_A     75   76   76     35   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     D    44_A     D    44_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     Q    45_A     Q    45_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     D    46_A     D    46_A     75   76   76     37   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     L    47_A     L    47_A     75   76   76     28   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     N    48_A     N    48_A     75   76   76     39   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     D    49_A     D    49_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     W    50_A     W    50_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     V    51_A     V    51_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     I    52_A     I    52_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     V    53_A     V    53_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     Q    54_A     Q    54_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     L    55_A     L    55_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     K    56_A     K    56_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     E    57_A     E    57_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     E    58_A     E    58_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     L    59_A     L    59_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     L    60_A     L    60_A     75   76   76     40   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     K    61_A     K    61_A     75   76   76     23   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     R    62_A     R    62_A     75   76   76     23   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     E    63_A     E    63_A     75   76   76     35   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     V    64_A     V    64_A     75   76   76     36   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     I    65_A     I    65_A     75   76   76     20   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     L    66_A     L    66_A     75   76   76     17   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     K    67_A     K    67_A     75   76   76     28   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     N    68_A     N    68_A     75   76   76     38   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     L    69_A     L    69_A     75   76   76      9   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     L    70_A     L    70_A     75   76   76     17   51   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     T    71_A     T    71_A     75   76   76      9   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     N    72_A     N    72_A     75   76   76     17   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     L    73_A     L    73_A     75   76   76     17   65   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     S    74_A     S    74_A     75   76   76     12   57   74   74   74   74   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     Q    75_A     Q    75_A     75   76   76      3    3    4    4    8   14   19   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_GDT     A    76_A     A    76_A      4   76   76      3    3    4    7   10   63   74   76   76   76   76   76   76   76   76   76   76   76   76   76 
LCS_AVERAGE  LCS_A:  99.15  (  97.45  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     40     65     74     74     74     74     74     76     76     76     76     76     76     76     76     76     76     76     76     76 
GDT PERCENT_AT  52.63  85.53  97.37  97.37  97.37  97.37  97.37 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00
GDT RMS_LOCAL    0.30   0.54   0.72   0.72   0.72   0.72   0.72   1.10   1.10   1.10   1.10   1.10   1.10   1.10   1.10   1.10   1.10   1.10   1.10   1.10
GDT RMS_ALL_AT   1.30   1.22   1.16   1.16   1.16   1.16   1.16   1.10   1.10   1.10   1.10   1.10   1.10   1.10   1.10   1.10   1.10   1.10   1.10   1.10

# Checking swapping
#   possible swapping detected:  Y    15_A      Y    15_A
#   possible swapping detected:  D    28_A      D    28_A
#   possible swapping detected:  D    44_A      D    44_A
#   possible swapping detected:  E    57_A      E    57_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     1.310     0    0.040   0.842     2.681   81.429   75.238
LGA    K     2_A      K     2_A     0.663     0    0.068   0.810     4.356   92.857   79.048
LGA    I     3_A      I     3_A     0.633     0    0.067   0.125     1.385   90.595   87.143
LGA    H     4_A      H     4_A     0.984     0    0.014   1.144     6.612   90.476   60.286
LGA    E     5_A      E     5_A     0.791     0    0.068   1.115     5.159   90.476   69.206
LGA    F     6_A      F     6_A     0.398     0    0.015   0.079     0.482  100.000  100.000
LGA    G     7_A      G     7_A     0.548     0    0.073   0.073     0.645   92.857   92.857
LGA    L     8_A      L     8_A     0.834     0    0.013   0.258     1.636   90.476   86.012
LGA    A     9_A      A     9_A     0.632     0    0.035   0.052     0.794   95.238   94.286
LGA    L    10_A      L    10_A     0.131     0    0.078   0.170     0.475  100.000  100.000
LGA    F    11_A      F    11_A     0.414     0    0.047   0.099     0.742   95.238   95.671
LGA    G    12_A      G    12_A     0.639     0    0.030   0.030     0.910   90.476   90.476
LGA    E    13_A      E    13_A     0.722     0    0.053   0.659     2.667   90.476   80.952
LGA    H    14_A      H    14_A     0.816     0    0.166   1.115     2.575   88.214   80.190
LGA    Y    15_A      Y    15_A     0.797     0    0.051   0.124     0.982   90.476   90.476
LGA    S    16_A      S    16_A     0.877     0    0.086   0.146     1.003   88.214   88.968
LGA    A    17_A      A    17_A     0.798     0    0.009   0.022     0.841   90.476   90.476
LGA    N    18_A      N    18_A     0.617     0    0.021   0.253     1.457   92.857   90.536
LGA    Q    19_A      Q    19_A     0.366     0    0.093   1.003     2.249   97.619   87.989
LGA    F    20_A      F    20_A     0.288     0    0.036   0.084     1.100  100.000   93.160
LGA    A    21_A      A    21_A     0.387     0    0.026   0.038     0.425  100.000  100.000
LGA    K    22_A      K    22_A     0.281     0    0.114   0.847     2.669   97.619   89.206
LGA    I    23_A      I    23_A     0.334     0    0.096   0.207     0.651  100.000   97.619
LGA    L    24_A      L    24_A     0.389     0    0.057   0.223     0.936  100.000   97.619
LGA    I    25_A      I    25_A     0.392     0    0.099   1.654     4.891   97.619   80.238
LGA    N    26_A      N    26_A     0.240     0    0.032   0.147     0.594  100.000   98.810
LGA    K    27_A      K    27_A     0.466     0    0.094   0.380     1.194   92.976   92.646
LGA    D    28_A      D    28_A     1.080     0    0.033   1.193     4.036   85.952   73.988
LGA    G    29_A      G    29_A     0.458     0    0.070   0.070     0.519   95.238   95.238
LGA    S    30_A      S    30_A     0.607     0    0.101   0.181     0.986   90.476   90.476
LGA    N    31_A      N    31_A     0.761     0    0.016   0.599     2.753   90.476   78.929
LGA    V    32_A      V    32_A     0.532     0    0.050   0.050     0.806   90.476   90.476
LGA    D    33_A      D    33_A     0.698     0    0.039   0.232     0.850   90.476   91.667
LGA    R    34_A      R    34_A     0.514     0    0.017   0.775     3.619   95.238   76.450
LGA    K    35_A      K    35_A     0.559     0    0.056   0.233     1.357   95.238   89.577
LGA    T    36_A      T    36_A     0.429     0    0.036   0.134     0.678   97.619   97.279
LGA    I    37_A      I    37_A     0.244     0    0.043   0.142     0.518  100.000   98.810
LGA    Q    38_A      Q    38_A     0.335     0    0.035   1.271     5.409  100.000   74.603
LGA    N    39_A      N    39_A     0.346     0    0.020   0.456     1.447  100.000   97.679
LGA    W    40_A      W    40_A     0.403     0    0.017   0.084     0.923  100.000   93.878
LGA    I    41_A      I    41_A     0.293     0    0.011   0.226     0.820  100.000   97.619
LGA    N    42_A      N    42_A     0.748     0    0.073   0.261     1.167   88.214   88.214
LGA    R    43_A      R    43_A     1.063     0    0.030   1.066     2.712   85.952   77.922
LGA    D    44_A      D    44_A     0.700     0    0.031   0.137     0.896   90.476   90.476
LGA    Q    45_A      Q    45_A     0.673     0    0.048   1.127     3.368   90.476   83.016
LGA    D    46_A      D    46_A     0.827     0    0.012   0.828     4.021   90.476   72.619
LGA    L    47_A      L    47_A     0.715     0    0.041   0.138     1.038   88.214   89.345
LGA    N    48_A      N    48_A     0.618     0    0.030   1.043     3.127   90.476   80.000
LGA    D    49_A      D    49_A     0.576     0    0.023   0.466     1.361   90.476   89.405
LGA    W    50_A      W    50_A     0.825     0    0.035   0.960     6.808   90.476   57.653
LGA    V    51_A      V    51_A     0.464     0    0.016   0.073     0.591   97.619   98.639
LGA    I    52_A      I    52_A     0.396     0    0.027   0.118     0.555  100.000   97.619
LGA    V    53_A      V    53_A     0.388     0    0.048   0.324     0.992  100.000   97.279
LGA    Q    54_A      Q    54_A     0.437     0    0.033   0.943     4.511  100.000   85.450
LGA    L    55_A      L    55_A     0.284     0    0.015   0.186     0.851  100.000   98.810
LGA    K    56_A      K    56_A     0.529     0    0.013   0.671     2.439   92.857   81.905
LGA    E    57_A      E    57_A     0.637     0    0.019   0.375     1.653   90.476   85.556
LGA    E    58_A      E    58_A     0.563     0    0.016   0.303     1.300   90.476   91.587
LGA    L    59_A      L    59_A     0.606     0    0.035   0.176     0.759   90.476   90.476
LGA    L    60_A      L    60_A     0.867     0    0.034   0.122     1.405   85.952   85.952
LGA    K    61_A      K    61_A     1.348     0    0.039   0.526     2.463   81.429   78.677
LGA    R    62_A      R    62_A     1.225     0    0.012   1.079     6.274   81.429   58.139
LGA    E    63_A      E    63_A     0.781     0    0.023   0.519     1.661   90.476   89.577
LGA    V    64_A      V    64_A     0.917     0    0.020   0.041     1.228   85.952   85.306
LGA    I    65_A      I    65_A     1.530     0    0.009   0.109     2.070   77.143   73.988
LGA    L    66_A      L    66_A     1.501     0    0.032   1.233     2.696   79.286   74.167
LGA    K    67_A      K    67_A     0.579     0    0.105   0.850     4.197   90.476   82.646
LGA    N    68_A      N    68_A     0.793     0    0.012   0.602     1.193   85.952   85.952
LGA    L    69_A      L    69_A     1.841     0    0.032   1.390     3.934   72.976   70.357
LGA    L    70_A      L    70_A     1.692     0    0.112   0.204     2.356   77.143   73.988
LGA    T    71_A      T    71_A     1.016     0    0.150   1.150     3.074   81.429   75.850
LGA    N    72_A      N    72_A     1.266     0    0.149   0.175     2.050   75.119   78.274
LGA    L    73_A      L    73_A     1.542     0    0.298   1.320     6.099   77.143   58.095
LGA    S    74_A      S    74_A     1.241     0    0.582   0.745     1.943   77.143   77.143
LGA    Q    75_A      Q    75_A     5.114     0    0.552   0.999    10.974   37.500   19.418
LGA    A    76_A      A    76_A     4.379     0    0.246   0.258     5.697   43.929   39.429

# 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):     1.100          1.036                  1.784           89.940   84.193

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  153   76    4.0     76    1.10    95.724    97.992     6.331

LGA_LOCAL      RMSD:   1.100  Number of atoms:   76  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   1.100  Number of assigned atoms:   76 
Std_ASGN_ATOMS RMSD:   1.100  Standard rmsd on all 76 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.368668 * X  +   0.557331 * Y  +   0.743953 * Z  +   1.436472
  Y_new =  -0.848067 * X  +   0.529358 * Y  +   0.023694 * Z  +  -0.436154
  Z_new =  -0.380612 * X  +  -0.639657 * Y  +   0.667812 * Z  +  12.745955 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -1.160725  0.390458 -0.763868   [DEG:  -66.5046   22.3716  -43.7664 ]
ZXZ:  1.602635  0.839531 -2.604839   [DEG:   91.8242   48.1016 -149.2463 ]
 
# END of job
