
#######################################################
#                                                     #
#                        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   89 (  781),  selected   76 , name one
# Molecule2: number of CA atoms   76 (  680),  selected   76 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:B  -ch2:B  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    72       9_B - 85_B        4.93     6.11
  LCS_AVERAGE:     93.56

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    46       9_B - 54_B        1.98     7.61
  LONGEST_CONTINUOUS_SEGMENT:    46      10_B - 55_B        1.95     7.63
  LONGEST_CONTINUOUS_SEGMENT:    46      11_B - 56_B        2.00     7.60
  LCS_AVERAGE:     54.02

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    28      35_B - 67_B        0.98     7.51
  LCS_AVERAGE:     34.54

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     S     9_B     S     9_B     27   46   72      8   18   25   27   40   47   54   56   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     P    10_B     P    10_B     27   46   72     18   24   28   36   45   50   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     K    11_B     K    11_B     27   46   72     20   24   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    12_B     E    12_B     27   46   72     20   24   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    13_B     E    13_B     27   46   72     20   24   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     K    14_B     K    14_B     27   46   72     20   24   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     F    15_B     F    15_B     27   46   72     20   24   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     K    16_B     K    16_B     27   46   72     20   24   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     K    17_B     K    17_B     27   46   72     20   24   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     K    18_B     K    18_B     27   46   72     20   24   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     L    19_B     L    19_B     27   46   72     20   24   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    20_B     E    20_B     27   46   72     20   24   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    21_B     E    21_B     27   46   72     20   24   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    22_B     E    22_B     27   46   72     20   24   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     L    23_B     L    23_B     27   46   72     20   24   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     K    24_B     K    24_B     27   46   72     20   24   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     K    25_B     K    25_B     27   46   72     20   24   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     I    26_B     I    26_B     27   46   72     20   24   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     R    27_B     R    27_B     27   46   72     20   24   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    28_B     E    28_B     27   46   72     20   24   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     R    29_B     R    29_B     27   46   72     20   24   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     L    30_B     L    30_B     27   46   72     20   24   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     L    31_B     L    31_B     27   46   72     17   24   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     M    32_B     M    32_B     27   46   72     17   24   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     V    33_B     V    33_B     27   46   72      5   23   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     F    34_B     F    34_B     27   46   72      8   23   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     D    35_B     D    35_B     28   46   72      4   17   24   36   43   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    36_B     E    36_B     28   46   72      4   23   25   29   40   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    37_B     E    37_B     28   46   72      3    7   13   26   33   39   48   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     R    38_B     R    38_B     28   46   72     21   23   25   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     V    39_B     V    39_B     28   46   72     21   23   25   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    40_B     E    40_B     28   46   72     21   23   25   36   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    41_B     E    41_B     28   46   72     21   23   27   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     Y    42_B     Y    42_B     28   46   72     21   23   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     M    43_B     M    43_B     28   46   72     21   23   27   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     K    44_B     K    44_B     28   46   72     21   23   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     I    45_B     I    45_B     28   46   72     21   23   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     M    46_B     M    46_B     28   46   72     21   23   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     K    47_B     K    47_B     28   46   72     21   23   25   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    48_B     E    48_B     28   46   72     21   23   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     V    49_B     V    49_B     28   46   72     21   23   25   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     I    50_B     I    50_B     28   46   72     21   23   25   30   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    51_B     E    51_B     28   46   72     21   23   25   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     K    52_B     K    52_B     28   46   72     21   23   25   36   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     I    53_B     I    53_B     28   46   72     21   23   25   29   37   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     L    54_B     L    54_B     28   46   72     21   23   25   29   37   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    55_B     E    55_B     28   46   72     21   23   25   30   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     N    56_B     N    56_B     28   46   72     21   23   25   29   37   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     R    57_B     R    57_B     28   42   72     21   23   25   27   35   40   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     K    58_B     K    58_B     28   42   72     21   23   25   29   37   49   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     K    64_B     K    64_B     28   42   72      9   11   19   24   28   34   39   43   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     V    65_B     V    65_B     28   42   72      9   11   24   26   31   38   48   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    66_B     E    66_B     28   42   72      9   23   25   29   37   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     I    67_B     I    67_B     28   42   72      9   16   25   27   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     P    68_B     P    68_B     26   42   72      9   23   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     P    69_B     P    69_B     23   41   72     18   24   29   37   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     G    70_B     G    70_B     23   40   72      9   16   28   35   45   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     M    71_B     M    71_B     23   38   72      9   16   24   25   42   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    72_B     E    72_B     23   38   72     10   16   24   25   42   51   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     W    73_B     W    73_B     23   35   72     10   16   24   25   27   30   34   52   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     F    74_B     F    74_B     23   34   72     10   16   24   25   27   30   33   35   54   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     Y    75_B     Y    75_B     23   28   72     10   16   24   25   27   30   33   35   55   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    76_B     E    76_B     23   26   72     10   16   24   25   27   30   33   35   48   60   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     N    77_B     N    77_B     23   26   72     10   16   24   25   27   30   33   35   36   38   55   63   64   66   67   68   69   70   71   73 
LCS_GDT     F    78_B     F    78_B     23   26   72     10   16   24   25   27   30   33   35   36   38   41   52   64   66   67   68   69   70   71   73 
LCS_GDT     L    79_B     L    79_B     23   26   72     10   16   23   25   27   30   33   35   36   38   41   45   63   66   67   68   69   70   71   73 
LCS_GDT     R    80_B     R    80_B     23   26   72     10   16   24   25   27   30   33   35   36   38   41   43   56   66   67   68   69   70   71   73 
LCS_GDT     Y    81_B     Y    81_B     23   26   72     10   16   24   25   27   30   33   35   36   38   41   42   44   50   59   68   69   70   71   73 
LCS_GDT     Y    82_B     Y    82_B     23   26   72     10   16   24   25   27   30   33   35   36   38   41   42   44   48   57   66   69   70   71   73 
LCS_GDT     D    83_B     D    83_B     23   26   72     10   16   24   25   27   30   33   35   36   38   41   42   44   47   52   60   67   70   71   73 
LCS_GDT     Y    84_B     Y    84_B     23   26   72     10   16   24   25   27   30   33   35   36   38   41   42   44   47   48   55   63   68   71   73 
LCS_GDT     E    85_B     E    85_B     23   26   72     10   16   24   25   27   30   33   35   36   38   41   42   44   47   48   54   60   67   70   73 
LCS_GDT     E    86_B     E    86_B     23   26   59      9   16   24   25   27   30   33   35   36   38   41   42   44   47   48   52   57   63   70   73 
LCS_GDT     E    87_B     E    87_B     23   26   54      9   15   24   25   27   30   33   35   36   38   41   42   44   47   48   49   54   59   64   68 
LCS_GDT     K    88_B     K    88_B     23   26   54      9   16   24   25   27   30   33   34   36   38   41   42   44   47   48   49   54   59   64   68 
LCS_GDT     L    89_B     L    89_B     23   26   53      9   15   24   25   27   30   33   35   36   38   41   42   44   47   48   49   54   59   64   68 
LCS_AVERAGE  LCS_A:  60.71  (  34.54   54.02   93.56 )

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     21     24     29     37     45     51     54     57     59     62     63     63     64     66     67     68     69     70     71     73 
GDT PERCENT_AT  27.63  31.58  38.16  48.68  59.21  67.11  71.05  75.00  77.63  81.58  82.89  82.89  84.21  86.84  88.16  89.47  90.79  92.11  93.42  96.05
GDT RMS_LOCAL    0.26   0.49   0.95   1.34   1.65   2.01   2.09   2.31   2.52   2.79   2.92   2.92   3.10   3.49   3.71   3.95   4.18   4.42   4.68   5.18
GDT RMS_ALL_AT   7.50   7.95   7.92   7.81   7.66   7.52   7.45   7.38   7.24   7.10   7.02   7.02   6.92   6.74   6.62   6.51   6.42   6.30   6.20   6.04

# Checking swapping
#   possible swapping detected:  E    13_B      E    13_B
#   possible swapping detected:  E    21_B      E    21_B
#   possible swapping detected:  F    34_B      F    34_B
#   possible swapping detected:  E    36_B      E    36_B
#   possible swapping detected:  E    37_B      E    37_B
#   possible swapping detected:  E    40_B      E    40_B
#   possible swapping detected:  Y    42_B      Y    42_B
#   possible swapping detected:  E    55_B      E    55_B
#   possible swapping detected:  F    74_B      F    74_B
#   possible swapping detected:  E    76_B      E    76_B
#   possible swapping detected:  Y    81_B      Y    81_B
#   possible swapping detected:  Y    82_B      Y    82_B
#   possible swapping detected:  E    85_B      E    85_B
#   possible swapping detected:  E    86_B      E    86_B
#   possible swapping detected:  E    87_B      E    87_B

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    S     9_B      S     9_B     3.849     0    0.201   0.678     4.919   43.690   39.603
LGA    P    10_B      P    10_B     2.682     0    0.023   0.312     2.957   60.952   60.408
LGA    K    11_B      K    11_B     2.179     0    0.039   0.062     2.956   64.762   62.222
LGA    E    12_B      E    12_B     2.200     0    0.019   0.375     4.173   64.762   58.360
LGA    E    13_B      E    13_B     2.256     0    0.024   1.113     5.900   64.762   55.185
LGA    K    14_B      K    14_B     1.836     0    0.011   0.802     4.272   72.857   62.275
LGA    F    15_B      F    15_B     1.825     0    0.020   0.104     2.011   72.857   72.121
LGA    K    16_B      K    16_B     2.065     0    0.085   0.949     4.090   66.786   63.915
LGA    K    17_B      K    17_B     1.916     0    0.054   0.998     6.903   72.857   54.709
LGA    K    18_B      K    18_B     2.032     0    0.060   0.585     3.272   68.810   64.074
LGA    L    19_B      L    19_B     1.981     0    0.021   0.109     2.136   72.857   71.845
LGA    E    20_B      E    20_B     2.086     0    0.020   0.149     2.593   64.762   63.915
LGA    E    21_B      E    21_B     2.021     0    0.015   0.754     2.760   66.786   64.815
LGA    E    22_B      E    22_B     1.913     0    0.014   0.855     5.423   72.857   59.101
LGA    L    23_B      L    23_B     1.876     0    0.054   1.398     4.315   72.857   66.369
LGA    K    24_B      K    24_B     1.931     0    0.037   0.118     2.064   72.857   71.958
LGA    K    25_B      K    25_B     1.983     0    0.005   0.649     2.381   72.857   70.159
LGA    I    26_B      I    26_B     1.761     0    0.061   0.065     2.043   75.000   72.917
LGA    R    27_B      R    27_B     1.582     0    0.000   1.165     8.634   72.857   46.970
LGA    E    28_B      E    28_B     1.741     0    0.048   0.114     2.502   72.857   69.312
LGA    R    29_B      R    29_B     1.630     0    0.007   1.199     5.312   72.857   55.281
LGA    L    30_B      L    30_B     1.552     0    0.054   1.168     4.169   77.143   71.607
LGA    L    31_B      L    31_B     1.296     0    0.049   0.072     1.467   81.429   81.429
LGA    M    32_B      M    32_B     1.492     0    0.014   1.080     5.911   77.143   64.881
LGA    V    33_B      V    33_B     1.775     0    0.043   0.098     2.242   72.857   70.544
LGA    F    34_B      F    34_B     1.627     0    0.074   0.093     2.561   75.000   70.087
LGA    D    35_B      D    35_B     2.685     0    0.089   0.529     4.339   60.952   51.429
LGA    E    36_B      E    36_B     3.129     0    0.074   1.086     7.676   48.452   35.926
LGA    E    37_B      E    37_B     4.421     0    0.106   0.808     7.487   40.238   27.196
LGA    R    38_B      R    38_B     2.009     0    0.106   0.767     3.758   66.905   56.883
LGA    V    39_B      V    39_B     1.913     0    0.044   0.941     3.832   72.857   71.156
LGA    E    40_B      E    40_B     2.215     0    0.060   1.184     7.151   68.810   47.619
LGA    E    41_B      E    41_B     1.813     0    0.023   0.834     2.852   77.143   70.317
LGA    Y    42_B      Y    42_B     1.104     0    0.012   1.330     9.282   81.429   49.127
LGA    M    43_B      M    43_B     1.448     0    0.020   1.099     6.651   81.429   65.238
LGA    K    44_B      K    44_B     1.317     0    0.031   1.039     5.715   81.429   65.291
LGA    I    45_B      I    45_B     0.771     0    0.022   0.101     1.405   90.476   88.214
LGA    M    46_B      M    46_B     1.165     0    0.023   1.123     3.089   83.690   78.631
LGA    K    47_B      K    47_B     1.545     0    0.071   0.990     5.822   79.286   61.905
LGA    E    48_B      E    48_B     0.799     0    0.012   0.117     1.719   85.952   84.497
LGA    V    49_B      V    49_B     1.592     0    0.042   0.103     2.410   75.000   72.925
LGA    I    50_B      I    50_B     2.056     0    0.024   0.636     2.442   66.786   68.988
LGA    E    51_B      E    51_B     1.638     0    0.026   0.073     1.866   72.857   77.619
LGA    K    52_B      K    52_B     1.981     0    0.027   0.926     5.436   66.905   59.947
LGA    I    53_B      I    53_B     3.179     0    0.010   0.046     4.090   51.786   46.786
LGA    L    54_B      L    54_B     2.958     0    0.037   1.394     5.922   57.143   50.952
LGA    E    55_B      E    55_B     2.110     0    0.013   0.596     3.273   60.952   60.635
LGA    N    56_B      N    56_B     3.347     0    0.011   0.934     4.084   46.905   46.786
LGA    R    57_B      R    57_B     4.374     0    0.085   1.145     8.497   38.690   29.004
LGA    K    58_B      K    58_B     3.563     0    0.092   0.790     3.832   43.333   47.831
LGA    K    64_B      K    64_B     6.039     0    0.020   0.051     8.690   22.738   14.603
LGA    V    65_B      V    65_B     4.550     0    0.034   0.088     5.239   32.976   34.830
LGA    E    66_B      E    66_B     3.264     0    0.040   0.864     3.897   53.810   51.005
LGA    I    67_B      I    67_B     2.413     0    0.017   0.128     5.067   66.905   54.643
LGA    P    68_B      P    68_B     0.779     0    0.026   0.331     1.874   81.548   80.272
LGA    P    69_B      P    69_B     1.401     0    0.028   0.348     2.494   75.119   72.993
LGA    G    70_B      G    70_B     2.751     0    0.212   0.212     2.793   59.048   59.048
LGA    M    71_B      M    71_B     3.195     0    0.145   0.693     4.101   46.786   58.988
LGA    E    72_B      E    72_B     3.601     0    0.041   0.756     5.368   37.738   44.021
LGA    W    73_B      W    73_B     6.152     0    0.039   1.233     9.923   15.952    9.796
LGA    F    74_B      F    74_B     7.280     0    0.050   1.400    13.384    8.810    4.589
LGA    Y    75_B      Y    75_B     7.215     0    0.031   0.181     8.888    8.333    7.778
LGA    E    76_B      E    76_B     8.354     0    0.014   1.040    11.334    3.333    2.593
LGA    N    77_B      N    77_B    10.046     0    0.018   0.279    11.373    0.357    0.417
LGA    F    78_B      F    78_B    10.562     0    0.046   1.197    14.710    0.000    0.043
LGA    L    79_B      L    79_B    11.485     0    0.019   0.101    13.120    0.000    0.000
LGA    R    80_B      R    80_B    12.878     0    0.023   1.321    14.567    0.000    0.693
LGA    Y    81_B      Y    81_B    13.938     0    0.024   1.270    18.406    0.000    0.000
LGA    Y    82_B      Y    82_B    14.342     0    0.051   0.197    16.290    0.000    0.000
LGA    D    83_B      D    83_B    16.080     0    0.012   0.176    17.810    0.000    0.000
LGA    Y    84_B      Y    84_B    17.505     0    0.054   1.278    19.155    0.000    0.000
LGA    E    85_B      E    85_B    17.756     0    0.045   0.996    19.373    0.000    0.000
LGA    E    86_B      E    86_B    18.871     0    0.009   0.597    20.938    0.000    0.000
LGA    E    87_B      E    87_B    21.232     0    0.091   0.908    22.877    0.000    0.000
LGA    K    88_B      K    88_B    22.054     0    0.037   0.096    23.326    0.000    0.000
LGA    L    89_B      L    89_B    21.989     0    0.117   0.130    24.011    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:       76     304    304  100.00     680    680  100.00                76
SUMMARY(RMSD_GDC):     5.921          6.010                  6.425           51.828   47.043

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)   89   76    4.0     57    2.31    61.184    62.563     2.366

LGA_LOCAL      RMSD:   2.309  Number of atoms:   57  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   7.376  Number of assigned atoms:   76 
Std_ASGN_ATOMS RMSD:   5.921  Standard rmsd on all 76 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.107010 * X  +  -0.770873 * Y  +  -0.627936 * Z  +  21.586628
  Y_new =   0.646089 * X  +   0.533957 * Y  +  -0.545398 * Z  + -47.126110
  Z_new =   0.755724 * X  +  -0.347339 * Y  +   0.555191 * Z  +   3.795223 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  1.406659 -0.856759 -0.559046   [DEG:   80.5956  -49.0886  -32.0310 ]
ZXZ: -0.855627  0.982204  2.001614   [DEG:  -49.0238   56.2761  114.6840 ]
 
# END of job
