
#######################################################
#                                                     #
#                        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        4.80     5.98
  LCS_AVERAGE:     93.70

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    48       9_B - 56_B        1.92     7.42
  LONGEST_CONTINUOUS_SEGMENT:    48      10_B - 57_B        1.98     7.41
  LCS_AVERAGE:     56.11

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    27       9_B - 35_B        0.99     7.68
  LONGEST_CONTINUOUS_SEGMENT:    27      34_B - 65_B        1.00     7.71
  LONGEST_CONTINUOUS_SEGMENT:    27      35_B - 66_B        0.93     7.53
  LONGEST_CONTINUOUS_SEGMENT:    27      36_B - 67_B        0.94     7.31
  LCS_AVERAGE:     34.05

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   48   72      8   15   24   31   41   48   54   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     P    10_B     P    10_B     27   48   72     18   25   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     K    11_B     K    11_B     27   48   72     17   25   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     E    12_B     E    12_B     27   48   72     18   25   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     E    13_B     E    13_B     27   48   72     18   25   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     K    14_B     K    14_B     27   48   72     18   25   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     F    15_B     F    15_B     27   48   72     18   25   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     K    16_B     K    16_B     27   48   72     18   25   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     K    17_B     K    17_B     27   48   72     18   25   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     K    18_B     K    18_B     27   48   72     18   25   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     L    19_B     L    19_B     27   48   72     18   25   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     E    20_B     E    20_B     27   48   72     18   25   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     E    21_B     E    21_B     27   48   72     18   25   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     E    22_B     E    22_B     27   48   72     18   25   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     L    23_B     L    23_B     27   48   72     18   25   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     K    24_B     K    24_B     27   48   72     18   25   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     K    25_B     K    25_B     27   48   72     18   25   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     I    26_B     I    26_B     27   48   72     18   25   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     R    27_B     R    27_B     27   48   72     18   25   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     E    28_B     E    28_B     27   48   72     18   25   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     R    29_B     R    29_B     27   48   72     18   25   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     L    30_B     L    30_B     27   48   72     18   25   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     L    31_B     L    31_B     27   48   72      8   25   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     M    32_B     M    32_B     27   48   72      5   25   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     V    33_B     V    33_B     27   48   72      2   15   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     F    34_B     F    34_B     27   48   72      5   22   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     D    35_B     D    35_B     27   48   72      5   15   24   36   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     E    36_B     E    36_B     27   48   72      5   20   24   36   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     E    37_B     E    37_B     27   48   72      3    3   24   28   37   47   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     R    38_B     R    38_B     27   48   72     18   21   29   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     V    39_B     V    39_B     27   48   72     18   21   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     E    40_B     E    40_B     27   48   72     18   21   24   37   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     E    41_B     E    41_B     27   48   72     18   21   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     Y    42_B     Y    42_B     27   48   72     18   21   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     M    43_B     M    43_B     27   48   72     18   21   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     K    44_B     K    44_B     27   48   72     18   21   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     I    45_B     I    45_B     27   48   72     18   23   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     M    46_B     M    46_B     27   48   72     18   21   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     K    47_B     K    47_B     27   48   72     18   21   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     E    48_B     E    48_B     27   48   72     18   21   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     V    49_B     V    49_B     27   48   72     18   21   24   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     I    50_B     I    50_B     27   48   72     18   21   24   33   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     E    51_B     E    51_B     27   48   72     18   21   24   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     K    52_B     K    52_B     27   48   72     18   21   24   38   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     I    53_B     I    53_B     27   48   72     18   21   24   29   37   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     L    54_B     L    54_B     27   48   72     18   21   24   29   41   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     E    55_B     E    55_B     27   48   72     18   21   24   33   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     N    56_B     N    56_B     27   48   72     18   21   24   29   37   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     R    57_B     R    57_B     27   48   72     18   21   24   28   36   42   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     K    58_B     K    58_B     27   46   72     18   21   24   29   37   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     K    64_B     K    64_B     27   43   72      8   11   20   24   29   35   40   52   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     V    65_B     V    65_B     27   43   72      8   11   23   28   33   39   52   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     E    66_B     E    66_B     27   43   72      8   18   24   29   37   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     I    67_B     I    67_B     27   43   72      8   16   24   29   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     P    68_B     P    68_B     26   43   72      8   25   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     P    69_B     P    69_B     23   43   72     18   25   31   39   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     G    70_B     G    70_B     23   42   72     11   15   30   38   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     M    71_B     M    71_B     23   41   72      7   18   23   25   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     E    72_B     E    72_B     23   39   72      9   18   23   25   45   52   55   57   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     W    73_B     W    73_B     23   35   72      9   18   23   25   28   30   32   53   60   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     F    74_B     F    74_B     23   34   72      9   18   23   25   28   30   32   36   56   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     Y    75_B     Y    75_B     23   29   72      9   18   23   25   28   30   32   36   56   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     E    76_B     E    76_B     23   27   72      9   18   23   25   28   30   32   36   54   63   63   64   65   67   67   68   70   71   72   73 
LCS_GDT     N    77_B     N    77_B     23   26   72      9   18   23   25   28   30   32   36   36   39   61   64   65   67   67   68   70   71   72   73 
LCS_GDT     F    78_B     F    78_B     23   26   72      9   18   23   25   28   30   32   36   36   38   41   55   65   67   67   68   70   71   72   73 
LCS_GDT     L    79_B     L    79_B     23   26   72      9   18   23   25   28   30   32   36   36   38   41   52   64   67   67   68   70   71   72   73 
LCS_GDT     R    80_B     R    80_B     23   26   72      9   18   23   25   28   30   32   36   36   38   41   52   64   67   67   68   70   71   72   73 
LCS_GDT     Y    81_B     Y    81_B     23   26   72      9   18   23   25   28   30   32   36   36   38   41   42   46   56   67   68   70   71   72   73 
LCS_GDT     Y    82_B     Y    82_B     23   26   72      9   18   23   25   28   30   32   36   36   38   41   42   44   50   60   66   70   71   72   73 
LCS_GDT     D    83_B     D    83_B     23   26   72      9   18   23   25   28   30   32   36   36   38   41   42   44   49   60   65   70   71   72   73 
LCS_GDT     Y    84_B     Y    84_B     23   26   72      9   18   23   25   28   30   32   36   36   38   41   42   44   49   52   62   70   71   72   73 
LCS_GDT     E    85_B     E    85_B     23   26   72      9   18   23   25   28   30   32   36   36   38   41   42   44   47   50   56   62   67   72   73 
LCS_GDT     E    86_B     E    86_B     23   26   63      8   18   23   25   28   30   32   36   36   38   41   42   44   47   48   54   58   65   70   73 
LCS_GDT     E    87_B     E    87_B     23   26   57      8   18   23   25   28   30   32   36   36   38   41   42   44   47   48   49   57   62   69   70 
LCS_GDT     K    88_B     K    88_B     23   26   54      8   18   23   25   28   30   32   36   36   38   41   42   44   47   48   49   55   62   65   68 
LCS_GDT     L    89_B     L    89_B     23   26   54      8   18   23   25   28   30   32   36   36   38   41   42   44   47   48   49   55   59   65   68 
LCS_AVERAGE  LCS_A:  61.29  (  34.05   56.11   93.70 )

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     18     25     31     39     45     52     55     57     60     63     63     64     65     67     67     68     70     71     72     73 
GDT PERCENT_AT  23.68  32.89  40.79  51.32  59.21  68.42  72.37  75.00  78.95  82.89  82.89  84.21  85.53  88.16  88.16  89.47  92.11  93.42  94.74  96.05
GDT RMS_LOCAL    0.21   0.58   0.89   1.25   1.53   1.97   2.07   2.21   2.44   2.82   2.82   3.00   3.20   3.60   3.60   3.84   4.31   4.55   4.80   5.05
GDT RMS_ALL_AT   7.30   7.77   7.65   7.63   7.51   7.35   7.31   7.23   7.09   6.88   6.88   6.78   6.70   6.49   6.49   6.38   6.17   6.07   5.98   5.91

# Checking swapping
#   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:  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    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     3.614     0    0.187   0.676     4.598   46.905   42.698
LGA    P    10_B      P    10_B     2.398     0    0.020   0.315     2.686   62.857   63.741
LGA    K    11_B      K    11_B     1.936     0    0.039   0.065     2.647   70.833   67.513
LGA    E    12_B      E    12_B     1.964     0    0.019   0.412     3.794   72.857   65.132
LGA    E    13_B      E    13_B     1.998     0    0.013   0.542     4.694   72.857   58.254
LGA    K    14_B      K    14_B     1.752     0    0.009   0.796     4.374   72.857   61.429
LGA    F    15_B      F    15_B     1.725     0    0.017   0.081     1.844   72.857   72.857
LGA    K    16_B      K    16_B     1.882     0    0.092   0.975     4.251   72.857   68.254
LGA    K    17_B      K    17_B     1.777     0    0.010   0.069     1.939   72.857   72.857
LGA    K    18_B      K    18_B     2.003     0    0.048   0.585     3.585   70.833   63.386
LGA    L    19_B      L    19_B     1.973     0    0.020   0.108     2.173   72.857   71.845
LGA    E    20_B      E    20_B     1.951     0    0.018   0.179     2.558   72.857   69.312
LGA    E    21_B      E    21_B     1.943     0    0.015   0.141     1.988   72.857   72.857
LGA    E    22_B      E    22_B     1.966     0    0.012   0.841     5.524   70.833   56.190
LGA    L    23_B      L    23_B     1.754     0    0.053   1.395     4.261   72.857   65.417
LGA    K    24_B      K    24_B     1.708     0    0.032   0.115     2.096   72.857   71.958
LGA    K    25_B      K    25_B     1.896     0    0.013   0.648     2.578   72.857   71.217
LGA    I    26_B      I    26_B     1.590     0    0.037   0.056     2.165   77.143   75.060
LGA    R    27_B      R    27_B     1.201     0    0.012   1.156     8.192   81.429   52.814
LGA    E    28_B      E    28_B     1.434     0    0.039   0.099     2.293   81.429   75.767
LGA    R    29_B      R    29_B     1.332     0    0.044   1.191     5.206   81.429   59.827
LGA    L    30_B      L    30_B     1.341     0    0.036   1.313     4.423   81.429   73.810
LGA    L    31_B      L    31_B     0.753     0    0.071   0.069     1.268   85.952   88.274
LGA    M    32_B      M    32_B     1.495     0    0.215   1.030     6.011   73.214   61.607
LGA    V    33_B      V    33_B     1.834     0    0.603   1.025     5.690   77.143   56.190
LGA    F    34_B      F    34_B     1.618     0    0.079   0.302     2.900   75.000   68.615
LGA    D    35_B      D    35_B     2.652     0    0.125   0.513     4.199   59.048   51.250
LGA    E    36_B      E    36_B     2.692     0    0.082   1.076     5.916   55.357   46.402
LGA    E    37_B      E    37_B     3.841     0    0.078   1.000     5.474   46.667   40.952
LGA    R    38_B      R    38_B     1.917     0    0.095   0.797     3.620   72.976   59.740
LGA    V    39_B      V    39_B     1.607     0    0.018   0.089     1.793   72.857   74.082
LGA    E    40_B      E    40_B     2.230     0    0.032   0.953     7.091   68.810   46.720
LGA    E    41_B      E    41_B     1.793     0    0.010   0.828     2.737   77.143   70.317
LGA    Y    42_B      Y    42_B     1.019     0    0.024   1.302     8.982   85.952   52.381
LGA    M    43_B      M    43_B     1.466     0    0.064   1.315     7.231   81.429   61.845
LGA    K    44_B      K    44_B     1.244     0    0.036   1.033     5.310   85.952   70.265
LGA    I    45_B      I    45_B     0.571     0    0.023   0.097     1.383   90.476   88.214
LGA    M    46_B      M    46_B     0.986     0    0.026   1.124     3.106   85.952   78.690
LGA    K    47_B      K    47_B     1.464     0    0.068   0.994     5.826   81.429   62.857
LGA    E    48_B      E    48_B     0.605     0    0.012   0.092     1.473   88.214   86.455
LGA    V    49_B      V    49_B     1.475     0    0.044   0.100     2.324   77.143   75.374
LGA    I    50_B      I    50_B     2.044     0    0.021   0.634     2.542   66.786   68.036
LGA    E    51_B      E    51_B     1.600     0    0.022   0.087     1.861   72.857   78.624
LGA    K    52_B      K    52_B     1.944     0    0.029   0.923     4.959   66.905   62.116
LGA    I    53_B      I    53_B     3.172     0    0.011   0.051     4.097   51.786   46.012
LGA    L    54_B      L    54_B     2.921     0    0.038   1.393     5.921   57.143   50.952
LGA    E    55_B      E    55_B     2.034     0    0.007   1.067     4.161   60.952   56.931
LGA    N    56_B      N    56_B     3.406     0    0.015   0.951     4.171   46.905   46.786
LGA    R    57_B      R    57_B     4.455     0    0.046   1.150     8.526   38.690   28.052
LGA    K    58_B      K    58_B     3.429     0    0.526   0.967     4.303   45.119   44.921
LGA    K    64_B      K    64_B     5.821     0    0.021   0.050     8.237   25.119   16.984
LGA    V    65_B      V    65_B     4.540     0    0.037   0.079     5.152   32.976   34.830
LGA    E    66_B      E    66_B     3.264     0    0.055   0.883     3.826   51.905   49.365
LGA    I    67_B      I    67_B     2.414     0    0.009   0.118     5.021   66.905   54.643
LGA    P    68_B      P    68_B     0.734     0    0.023   0.333     1.945   83.810   81.565
LGA    P    69_B      P    69_B     1.253     0    0.026   0.348     2.414   77.381   75.510
LGA    G    70_B      G    70_B     2.670     0    0.215   0.215     2.761   59.048   59.048
LGA    M    71_B      M    71_B     3.244     0    0.149   0.676     4.169   45.119   57.083
LGA    E    72_B      E    72_B     3.635     0    0.043   0.761     5.318   37.738   42.434
LGA    W    73_B      W    73_B     6.076     0    0.036   1.212     9.664   17.262   11.122
LGA    F    74_B      F    74_B     7.177     0    0.047   1.417    13.309   10.476    5.325
LGA    Y    75_B      Y    75_B     7.140     0    0.039   0.178     8.747    8.333    8.651
LGA    E    76_B      E    76_B     8.116     0    0.018   1.041    10.813    4.524    3.439
LGA    N    77_B      N    77_B     9.789     0    0.033   0.268    11.090    0.833    0.774
LGA    F    78_B      F    78_B    10.537     0    0.045   1.187    14.847    0.119    0.087
LGA    L    79_B      L    79_B    11.318     0    0.021   0.095    12.794    0.000    0.000
LGA    R    80_B      R    80_B    12.414     0    0.023   1.321    14.058    0.000    1.602
LGA    Y    81_B      Y    81_B    13.649     0    0.025   1.279    18.420    0.000    0.000
LGA    Y    82_B      Y    82_B    14.142     0    0.048   0.233    15.969    0.000    0.000
LGA    D    83_B      D    83_B    15.642     0    0.009   0.168    17.314    0.000    0.000
LGA    Y    84_B      Y    84_B    17.022     0    0.060   1.276    18.755    0.000    0.000
LGA    E    85_B      E    85_B    17.469     0    0.068   1.194    19.171    0.000    0.000
LGA    E    86_B      E    86_B    18.611     0    0.009   0.601    20.645    0.000    0.000
LGA    E    87_B      E    87_B    20.741     0    0.093   0.911    22.252    0.000    0.000
LGA    K    88_B      K    88_B    21.698     0    0.036   0.079    23.032    0.000    0.000
LGA    L    89_B      L    89_B    21.855     0    0.117   0.142    23.840    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):     5.794          5.906                  6.281           53.537   48.386

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)   89   76    4.0     57    2.21    62.171    64.005     2.469

LGA_LOCAL      RMSD:   2.209  Number of atoms:   57  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   7.228  Number of assigned atoms:   76 
Std_ASGN_ATOMS RMSD:   5.794  Standard rmsd on all 76 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.802266 * X  +   0.139103 * Y  +   0.580534 * Z  +  23.732805
  Y_new =  -0.110150 * X  +   0.921281 * Y  +  -0.372971 * Z  + -43.984119
  Z_new =  -0.586717 * X  +  -0.363168 * Y  +  -0.723790 * Z  +   6.190584 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -3.005147  0.626998 -2.676539   [DEG: -172.1822   35.9243 -153.3544 ]
ZXZ:  0.999739  2.380076 -2.125058   [DEG:   57.2808  136.3683 -121.7568 ]
 
# END of job
