
#######################################################
#                                                     #
#                        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        4.95     6.15
  LCS_AVERAGE:     93.46

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    47       9_B - 55_B        1.97     7.64
  LONGEST_CONTINUOUS_SEGMENT:    47      10_B - 56_B        2.00     7.62
  LCS_AVERAGE:     54.83

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    27      35_B - 66_B        0.96     7.78
  LONGEST_CONTINUOUS_SEGMENT:    27      36_B - 67_B        0.97     7.54
  LCS_AVERAGE:     33.97

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     26   47   72      9   23   27   36   40   48   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     P    10_B     P    10_B     26   47   72     19   25   28   37   45   49   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     K    11_B     K    11_B     26   47   72     19   25   29   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    12_B     E    12_B     26   47   72     19   25   29   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    13_B     E    13_B     26   47   72     19   25   29   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     K    14_B     K    14_B     26   47   72     19   25   29   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     F    15_B     F    15_B     26   47   72     19   25   29   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     K    16_B     K    16_B     26   47   72     19   25   29   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     K    17_B     K    17_B     26   47   72     19   25   29   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     K    18_B     K    18_B     26   47   72     19   25   29   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     L    19_B     L    19_B     26   47   72     19   25   29   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    20_B     E    20_B     26   47   72     19   25   29   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    21_B     E    21_B     26   47   72     19   25   29   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    22_B     E    22_B     26   47   72     19   25   29   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     L    23_B     L    23_B     26   47   72     19   25   29   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     K    24_B     K    24_B     26   47   72     19   25   29   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     K    25_B     K    25_B     26   47   72     19   25   29   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     I    26_B     I    26_B     26   47   72     19   25   29   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     R    27_B     R    27_B     26   47   72     19   25   29   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    28_B     E    28_B     26   47   72     19   25   29   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     R    29_B     R    29_B     26   47   72     19   25   29   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     L    30_B     L    30_B     26   47   72     19   25   29   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     L    31_B     L    31_B     26   47   72     11   25   29   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     M    32_B     M    32_B     26   47   72     14   25   29   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     V    33_B     V    33_B     26   47   72      5   18   27   37   45   51   55   57   59   62   63   63   64   65   67   68   69   70   71   73 
LCS_GDT     F    34_B     F    34_B     26   47   72      5   17   27   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     D    35_B     D    35_B     27   47   72      5   15   24   33   43   50   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    36_B     E    36_B     27   47   72      7   22   24   31   43   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    37_B     E    37_B     27   47   72      3    4   16   26   34   40   51   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     R    38_B     R    38_B     27   47   72     18   22   27   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     V    39_B     V    39_B     27   47   72     18   22   27   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    40_B     E    40_B     27   47   72     19   22   24   34   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    41_B     E    41_B     27   47   72     19   22   27   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     Y    42_B     Y    42_B     27   47   72     19   22   29   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     M    43_B     M    43_B     27   47   72     19   22   25   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     K    44_B     K    44_B     27   47   72     19   22   29   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     I    45_B     I    45_B     27   47   72     19   22   29   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     M    46_B     M    46_B     27   47   72     19   22   29   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     K    47_B     K    47_B     27   47   72     19   22   25   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    48_B     E    48_B     27   47   72     19   22   29   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     V    49_B     V    49_B     27   47   72     19   22   24   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     I    50_B     I    50_B     27   47   72     19   22   24   31   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    51_B     E    51_B     27   47   72     19   22   24   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     K    52_B     K    52_B     27   47   72     19   22   24   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     I    53_B     I    53_B     27   47   72     19   22   24   30   37   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     L    54_B     L    54_B     27   47   72     19   22   24   30   39   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    55_B     E    55_B     27   47   72     19   22   24   32   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     N    56_B     N    56_B     27   47   72     19   22   24   30   37   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     R    57_B     R    57_B     27   42   72     19   22   24   26   35   42   54   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     K    58_B     K    58_B     27   42   72     19   22   24   30   37   49   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     K    64_B     K    64_B     27   42   72      9   11   20   24   28   35   38   43   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     V    65_B     V    65_B     27   42   72      9   14   23   26   32   38   45   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    66_B     E    66_B     27   42   72      9   22   24   30   37   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     I    67_B     I    67_B     27   42   72      9   17   24   27   45   51   55   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   25   29   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     P    69_B     P    69_B     24   42   72     19   25   29   37   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     G    70_B     G    70_B     24   40   72      9   18   27   36   45   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     M    71_B     M    71_B     24   38   72      9   17   23   35   44   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    72_B     E    72_B     24   37   72      9   18   23   25   44   51   55   57   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     W    73_B     W    73_B     24   35   72     10   18   23   25   26   31   37   52   59   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     F    74_B     F    74_B     24   32   72     10   18   23   25   26   31   33   35   56   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     Y    75_B     Y    75_B     24   29   72     10   18   23   25   26   31   33   48   56   62   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     E    76_B     E    76_B     24   26   72     10   18   23   25   26   31   33   34   56   59   63   63   64   66   67   68   69   70   71   73 
LCS_GDT     N    77_B     N    77_B     24   26   72     10   18   23   25   26   31   33   34   36   40   58   63   64   66   67   68   69   70   71   73 
LCS_GDT     F    78_B     F    78_B     24   26   72     10   18   23   25   26   31   33   34   36   37   39   44   62   66   67   68   69   70   71   73 
LCS_GDT     L    79_B     L    79_B     24   26   72     10   18   23   25   26   31   33   34   36   37   39   44   56   66   67   68   69   70   71   73 
LCS_GDT     R    80_B     R    80_B     24   26   72     10   18   23   25   26   31   33   34   36   37   39   44   56   66   67   68   69   70   71   73 
LCS_GDT     Y    81_B     Y    81_B     24   26   72     10   18   23   25   26   31   33   34   36   37   39   41   43   50   59   68   69   70   71   73 
LCS_GDT     Y    82_B     Y    82_B     24   26   72     10   18   23   25   26   31   33   34   36   37   39   41   43   47   52   60   69   70   71   73 
LCS_GDT     D    83_B     D    83_B     24   26   72     10   18   23   25   26   31   33   34   36   37   39   41   43   45   52   60   67   70   71   73 
LCS_GDT     Y    84_B     Y    84_B     24   26   72     10   18   23   25   26   31   33   34   36   37   39   41   43   45   49   55   62   68   71   73 
LCS_GDT     E    85_B     E    85_B     24   26   72     10   18   23   25   26   31   33   34   36   37   39   41   43   45   48   53   58   63   69   73 
LCS_GDT     E    86_B     E    86_B     24   26   57      9   18   23   25   26   31   33   34   36   37   39   41   43   45   48   50   56   62   68   73 
LCS_GDT     E    87_B     E    87_B     24   26   53      9   18   23   25   26   31   33   34   36   36   39   41   43   45   48   49   53   60   64   67 
LCS_GDT     K    88_B     K    88_B     24   26   52      9   18   23   25   26   30   33   34   36   36   39   41   43   45   48   49   52   56   60   67 
LCS_GDT     L    89_B     L    89_B     24   26   52     10   18   23   25   26   30   33   34   36   36   38   41   43   45   48   49   50   56   60   67 
LCS_AVERAGE  LCS_A:  60.75  (  33.97   54.83   93.46 )

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     19     25     29     37     45     51     55     57     59     62     63     63     64     66     67     68     69     70     71     73 
GDT PERCENT_AT  25.00  32.89  38.16  48.68  59.21  67.11  72.37  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    0.27   0.52   0.98   1.33   1.65   2.01   2.12   2.25   2.47   2.76   2.89   2.89   3.08   3.70   3.70   3.95   4.19   4.43   4.69   5.20
GDT RMS_ALL_AT   7.57   7.89   7.77   7.74   7.68   7.49   7.49   7.46   7.28   7.16   7.07   7.07   6.98   6.64   6.67   6.56   6.46   6.35   6.24   6.08

# 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:  Y    42_B      Y    42_B
#   possible swapping detected:  F    74_B      F    74_B
#   possible swapping detected:  E    76_B      E    76_B
#   possible swapping detected:  Y    82_B      Y    82_B
#   possible swapping detected:  Y    84_B      Y    84_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     3.189     0    0.577   0.887     5.909   46.429   48.810
LGA    P    10_B      P    10_B     2.495     0    0.056   0.060     3.003   62.857   59.388
LGA    K    11_B      K    11_B     1.925     0    0.067   0.062     2.738   70.833   66.614
LGA    E    12_B      E    12_B     1.817     0    0.034   0.200     3.033   72.857   65.026
LGA    E    13_B      E    13_B     1.903     0    0.036   1.118     5.912   72.857   59.683
LGA    K    14_B      K    14_B     1.536     0    0.009   0.804     4.152   75.000   64.868
LGA    F    15_B      F    15_B     1.550     0    0.018   0.113     1.818   72.857   74.416
LGA    K    16_B      K    16_B     1.823     0    0.093   0.968     4.132   72.857   68.254
LGA    K    17_B      K    17_B     1.659     0    0.053   0.989     6.611   72.857   56.190
LGA    K    18_B      K    18_B     1.791     0    0.056   0.586     3.094   72.857   68.519
LGA    L    19_B      L    19_B     1.788     0    0.020   0.103     1.947   72.857   72.857
LGA    E    20_B      E    20_B     1.895     0    0.019   0.170     2.637   72.857   68.413
LGA    E    21_B      E    21_B     1.820     0    0.018   0.764     2.713   72.857   68.413
LGA    E    22_B      E    22_B     1.742     0    0.014   0.864     5.293   72.857   59.101
LGA    L    23_B      L    23_B     1.764     0    0.061   1.395     4.389   72.857   66.369
LGA    K    24_B      K    24_B     1.869     0    0.034   0.118     1.974   72.857   72.857
LGA    K    25_B      K    25_B     1.852     0    0.013   0.649     2.091   72.857   71.958
LGA    I    26_B      I    26_B     1.613     0    0.047   0.053     1.794   75.000   75.000
LGA    R    27_B      R    27_B     1.590     0    0.011   1.144     8.626   72.857   46.970
LGA    E    28_B      E    28_B     1.805     0    0.051   0.113     2.521   72.857   69.312
LGA    R    29_B      R    29_B     1.684     0    0.018   1.201     5.711   72.857   52.165
LGA    L    30_B      L    30_B     1.484     0    0.059   0.150     1.947   79.286   76.071
LGA    L    31_B      L    31_B     1.324     0    0.090   1.366     3.224   81.429   75.417
LGA    M    32_B      M    32_B     1.474     0    0.015   1.028     6.200   79.286   66.131
LGA    V    33_B      V    33_B     1.938     0    0.039   0.109     2.620   70.833   67.143
LGA    F    34_B      F    34_B     2.028     0    0.037   0.131     2.983   68.810   65.628
LGA    D    35_B      D    35_B     3.015     0    0.106   0.832     7.198   55.357   38.155
LGA    E    36_B      E    36_B     3.048     0    0.068   1.075     6.651   51.786   41.164
LGA    E    37_B      E    37_B     4.483     0    0.074   0.855     8.344   40.238   25.820
LGA    R    38_B      R    38_B     2.141     0    0.097   0.784     3.085   66.905   60.736
LGA    V    39_B      V    39_B     1.668     0    0.020   0.087     1.881   72.857   74.082
LGA    E    40_B      E    40_B     2.308     0    0.014   0.990     7.299   68.810   47.460
LGA    E    41_B      E    41_B     1.805     0    0.007   0.825     2.847   77.143   69.418
LGA    Y    42_B      Y    42_B     0.970     0    0.014   1.275     8.471   88.214   55.119
LGA    M    43_B      M    43_B     1.501     0    0.042   1.096     5.843   79.286   64.464
LGA    K    44_B      K    44_B     1.374     0    0.027   1.032     5.664   81.429   64.339
LGA    I    45_B      I    45_B     0.829     0    0.016   0.095     1.434   88.214   87.083
LGA    M    46_B      M    46_B     1.251     0    0.028   1.109     2.968   79.286   76.250
LGA    K    47_B      K    47_B     1.611     0    0.075   0.989     5.968   79.286   61.111
LGA    E    48_B      E    48_B     0.835     0    0.015   0.111     1.630   85.952   85.503
LGA    V    49_B      V    49_B     1.700     0    0.039   0.102     2.557   72.976   70.680
LGA    I    50_B      I    50_B     2.191     0    0.023   0.630     2.623   66.786   68.036
LGA    E    51_B      E    51_B     1.728     0    0.027   0.069     1.985   72.857   76.667
LGA    K    52_B      K    52_B     2.106     0    0.029   0.932     5.466   62.976   57.302
LGA    I    53_B      I    53_B     3.351     0    0.011   0.051     4.300   50.119   45.179
LGA    L    54_B      L    54_B     3.032     0    0.042   1.392     5.965   55.357   50.060
LGA    E    55_B      E    55_B     2.145     0    0.043   0.773     3.569   60.952   62.593
LGA    N    56_B      N    56_B     3.441     0    0.006   0.929     4.152   46.905   45.952
LGA    R    57_B      R    57_B     4.468     0    0.063   1.145     8.430   38.690   28.571
LGA    K    58_B      K    58_B     3.745     0    0.074   1.236     5.126   43.333   42.910
LGA    K    64_B      K    64_B     6.404     0    0.017   0.050     8.475   20.476   13.810
LGA    V    65_B      V    65_B     4.858     0    0.035   0.081     5.547   30.357   30.884
LGA    E    66_B      E    66_B     3.478     0    0.059   0.866     4.015   50.357   48.677
LGA    I    67_B      I    67_B     2.503     0    0.017   0.122     5.136   65.000   53.690
LGA    P    68_B      P    68_B     0.778     0    0.024   0.328     1.790   85.952   82.789
LGA    P    69_B      P    69_B     1.286     0    0.027   0.349     2.586   75.119   71.905
LGA    G    70_B      G    70_B     2.554     0    0.216   0.216     2.604   62.976   62.976
LGA    M    71_B      M    71_B     3.061     0    0.143   0.694     3.982   50.119   62.619
LGA    E    72_B      E    72_B     3.456     0    0.036   0.759     5.212   40.833   46.190
LGA    W    73_B      W    73_B     5.923     0    0.036   1.194     9.059   19.048   12.789
LGA    F    74_B      F    74_B     7.140     0    0.047   1.410    13.474   10.476    5.325
LGA    Y    75_B      Y    75_B     7.153     0    0.039   0.192     8.995    8.333    8.095
LGA    E    76_B      E    76_B     8.248     0    0.010   1.038    11.090    3.452    2.963
LGA    N    77_B      N    77_B     9.983     0    0.020   0.769    11.618    0.476    0.952
LGA    F    78_B      F    78_B    10.830     0    0.061   1.161    14.842    0.000    0.043
LGA    L    79_B      L    79_B    11.790     0    0.025   0.090    13.345    0.000    0.000
LGA    R    80_B      R    80_B    12.847     0    0.019   1.309    14.574    0.000    1.169
LGA    Y    81_B      Y    81_B    14.182     0    0.030   0.279    16.902    0.000    0.000
LGA    Y    82_B      Y    82_B    14.736     0    0.042   0.205    16.551    0.000    0.000
LGA    D    83_B      D    83_B    16.173     0    0.007   0.167    17.887    0.000    0.000
LGA    Y    84_B      Y    84_B    17.595     0    0.017   0.254    20.132    0.000    0.000
LGA    E    85_B      E    85_B    18.121     0    0.061   1.089    19.785    0.000    0.000
LGA    E    86_B      E    86_B    19.192     0    0.005   0.599    21.228    0.000    0.000
LGA    E    87_B      E    87_B    21.288     0    0.089   0.911    22.798    0.000    0.000
LGA    K    88_B      K    88_B    22.334     0    0.038   0.080    23.749    0.000    0.000
LGA    L    89_B      L    89_B    22.566     0    0.118   0.136    24.564    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):     5.963          6.051                  6.459           52.423   47.488

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)   89   76    4.0     57    2.25    61.513    62.946     2.424

LGA_LOCAL      RMSD:   2.251  Number of atoms:   57  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   7.458  Number of assigned atoms:   76 
Std_ASGN_ATOMS RMSD:   5.963  Standard rmsd on all 76 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.973065 * X  +   0.163718 * Y  +  -0.162298 * Z  +   8.916025
  Y_new =   0.218925 * X  +  -0.876823 * Y  +   0.428082 * Z  + -38.446873
  Z_new =  -0.072222 * X  +  -0.452082 * Y  +  -0.889047 * Z  +   7.020861 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  0.221300  0.072285 -2.671167   [DEG:   12.6796    4.1416 -153.0466 ]
ZXZ: -2.779207  2.666057 -2.983177   [DEG: -159.2368  152.7538 -170.9234 ]
 
# END of job
