
#######################################################
#                                                     #
#                        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        4.92     6.10
  LCS_AVERAGE:     93.54

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    48       9_B - 56_B        1.93     7.57
  LONGEST_CONTINUOUS_SEGMENT:    48      10_B - 57_B        1.97     7.55
  LCS_AVERAGE:     55.64

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    27       9_B - 35_B        0.92     7.88
  LCS_AVERAGE:     33.52

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      5   15   26   27   40   48   54   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     P    10_B     P    10_B     27   48   72     19   25   30   39   46   52   55   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     K    11_B     K    11_B     27   48   72     19   25   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     E    12_B     E    12_B     27   48   72     19   25   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     E    13_B     E    13_B     27   48   72     19   25   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     K    14_B     K    14_B     27   48   72     19   25   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     F    15_B     F    15_B     27   48   72     19   25   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     K    16_B     K    16_B     27   48   72     19   25   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     K    17_B     K    17_B     27   48   72     19   25   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     K    18_B     K    18_B     27   48   72     19   25   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     L    19_B     L    19_B     27   48   72     19   25   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     E    20_B     E    20_B     27   48   72     19   25   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     E    21_B     E    21_B     27   48   72     19   25   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     E    22_B     E    22_B     27   48   72     19   25   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     L    23_B     L    23_B     27   48   72     19   25   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     K    24_B     K    24_B     27   48   72     19   25   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     K    25_B     K    25_B     27   48   72     19   25   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     I    26_B     I    26_B     27   48   72     19   25   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     R    27_B     R    27_B     27   48   72     19   25   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     E    28_B     E    28_B     27   48   72     19   25   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     R    29_B     R    29_B     27   48   72     19   25   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     L    30_B     L    30_B     27   48   72     19   25   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     L    31_B     L    31_B     27   48   72     19   25   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     M    32_B     M    32_B     27   48   72     19   25   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     V    33_B     V    33_B     27   48   72      6   23   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     F    34_B     F    34_B     27   48   72      6   23   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     D    35_B     D    35_B     27   48   72      6   19   26   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     E    36_B     E    36_B     26   48   72      8   23   26   38   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     E    37_B     E    37_B     26   48   72      3   11   19   28   36   47   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     R    38_B     R    38_B     26   48   72     21   23   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     V    39_B     V    39_B     26   48   72     20   23   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     E    40_B     E    40_B     26   48   72     21   23   28   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     E    41_B     E    41_B     26   48   72     21   23   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     Y    42_B     Y    42_B     26   48   72     21   23   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     M    43_B     M    43_B     26   48   72     21   23   31   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     K    44_B     K    44_B     26   48   72     21   23   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     I    45_B     I    45_B     26   48   72     21   23   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     M    46_B     M    46_B     26   48   72     21   23   31   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     K    47_B     K    47_B     26   48   72     21   23   28   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     E    48_B     E    48_B     26   48   72     21   23   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     V    49_B     V    49_B     26   48   72     21   23   25   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     I    50_B     I    50_B     26   48   72     21   23   25   37   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     E    51_B     E    51_B     26   48   72     21   23   25   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     K    52_B     K    52_B     26   48   72     21   23   25   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     I    53_B     I    53_B     26   48   72     21   23   25   30   37   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     L    54_B     L    54_B     26   48   72     21   23   25   30   39   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     E    55_B     E    55_B     26   48   72     21   23   25   31   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     N    56_B     N    56_B     26   48   72     21   23   25   30   37   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     R    57_B     R    57_B     26   48   72     21   23   25   27   36   46   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     K    58_B     K    58_B     26   47   72     21   23   25   30   37   51   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     K    64_B     K    64_B     26   41   72      5   11   20   26   29   31   33   36   41   48   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     V    65_B     V    65_B     26   41   72      6   17   24   27   34   39   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     E    66_B     E    66_B     26   41   72     21   23   25   30   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     I    67_B     I    67_B     25   41   72      6   21   24   35   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     P    68_B     P    68_B     23   41   72      6   25   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     P    69_B     P    69_B     23   41   72     19   25   32   39   46   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     G    70_B     G    70_B     23   39   72      6   17   23   38   45   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     M    71_B     M    71_B     23   37   72      6   17   23   26   44   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     E    72_B     E    72_B     23   36   72     10   17   23   26   43   52   56   58   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     W    73_B     W    73_B     23   34   72     10   17   23   26   29   31   33   53   59   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     F    74_B     F    74_B     23   31   72     10   17   23   26   29   31   33   37   54   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     Y    75_B     Y    75_B     23   28   72     10   17   23   26   29   31   33   37   56   61   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     E    76_B     E    76_B     23   26   72     10   17   23   26   29   31   33   37   46   60   63   63   64   66   67   68   69   70   72   72 
LCS_GDT     N    77_B     N    77_B     23   26   72     10   17   23   26   29   31   33   36   36   48   59   63   64   66   67   68   69   70   72   72 
LCS_GDT     F    78_B     F    78_B     23   26   72     10   17   23   26   29   31   33   36   36   38   40   49   63   66   67   68   69   70   72   72 
LCS_GDT     L    79_B     L    79_B     23   26   72     10   16   23   26   29   31   33   36   36   38   40   45   59   66   67   68   69   70   72   72 
LCS_GDT     R    80_B     R    80_B     23   26   72     10   17   23   26   29   31   33   36   36   38   40   45   56   66   67   68   69   70   72   72 
LCS_GDT     Y    81_B     Y    81_B     23   26   72     10   17   23   26   29   31   33   36   36   38   40   41   44   53   59   68   69   70   72   72 
LCS_GDT     Y    82_B     Y    82_B     23   26   72     10   17   23   26   29   31   33   36   36   38   40   41   44   48   57   64   69   70   72   72 
LCS_GDT     D    83_B     D    83_B     23   26   72     10   17   23   26   29   31   33   36   36   38   40   41   44   46   53   62   67   70   72   72 
LCS_GDT     Y    84_B     Y    84_B     23   26   72     10   17   23   26   29   31   33   36   36   38   40   41   44   46   50   57   62   69   72   72 
LCS_GDT     E    85_B     E    85_B     23   26   72     10   17   23   26   29   31   33   36   36   38   40   41   44   46   49   54   59   66   72   72 
LCS_GDT     E    86_B     E    86_B     23   26   59      8   17   23   26   29   31   33   36   36   38   40   41   44   46   48   53   57   64   69   71 
LCS_GDT     E    87_B     E    87_B     23   26   54      8   17   23   26   29   31   33   36   36   38   40   41   43   46   48   49   55   60   65   68 
LCS_GDT     K    88_B     K    88_B     23   26   53      8   17   23   26   29   31   33   36   36   38   40   41   43   46   48   49   55   59   62   68 
LCS_GDT     L    89_B     L    89_B     23   26   53      8   15   23   26   29   31   33   36   36   38   40   41   43   46   48   49   55   59   62   68 
LCS_AVERAGE  LCS_A:  60.90  (  33.52   55.64   93.54 )

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     25     32     39     46     52     56     58     59     61     63     63     64     66     67     68     69     70     72     72 
GDT PERCENT_AT  27.63  32.89  42.11  51.32  60.53  68.42  73.68  76.32  77.63  80.26  82.89  82.89  84.21  86.84  88.16  89.47  90.79  92.11  94.74  94.74
GDT RMS_LOCAL    0.29   0.49   1.07   1.28   1.60   1.94   2.19   2.23   2.34   2.61   2.89   2.89   3.07   3.47   3.69   3.93   4.17   4.41   4.92   4.92
GDT RMS_ALL_AT   7.32   7.88   7.85   7.79   7.70   7.45   7.36   7.35   7.29   7.16   7.00   7.00   6.90   6.72   6.61   6.50   6.40   6.29   6.10   6.10

# Checking swapping
#   possible swapping detected:  E    22_B      E    22_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:  E    55_B      E    55_B
#   possible swapping detected:  E    66_B      E    66_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     3.630     0    0.236   0.718     5.042   43.690   39.683
LGA    P    10_B      P    10_B     2.302     0    0.082   0.293     2.715   64.881   64.898
LGA    K    11_B      K    11_B     1.773     0    0.055   0.067     2.497   70.833   69.259
LGA    E    12_B      E    12_B     1.789     0    0.012   0.871     4.638   72.857   59.206
LGA    E    13_B      E    13_B     1.924     0    0.014   1.116     6.572   72.857   51.905
LGA    K    14_B      K    14_B     1.532     0    0.013   0.814     4.521   77.143   63.651
LGA    F    15_B      F    15_B     1.488     0    0.016   0.062     1.559   77.143   79.870
LGA    K    16_B      K    16_B     1.774     0    0.091   0.982     4.358   72.857   68.254
LGA    K    17_B      K    17_B     1.642     0    0.010   0.074     1.785   72.857   77.619
LGA    K    18_B      K    18_B     1.736     0    0.008   0.864     4.903   72.857   60.159
LGA    L    19_B      L    19_B     1.842     0    0.031   0.114     2.106   72.857   71.845
LGA    E    20_B      E    20_B     1.837     0    0.019   0.175     2.430   72.857   71.058
LGA    E    21_B      E    21_B     1.814     0    0.012   0.135     1.847   72.857   73.810
LGA    E    22_B      E    22_B     1.913     0    0.037   1.019     6.513   72.857   53.333
LGA    L    23_B      L    23_B     1.724     0    0.053   1.396     4.313   75.000   66.488
LGA    K    24_B      K    24_B     1.720     0    0.038   0.120     1.973   72.857   72.857
LGA    K    25_B      K    25_B     1.810     0    0.009   0.650     2.236   72.857   73.862
LGA    I    26_B      I    26_B     1.624     0    0.033   0.058     2.070   77.143   75.060
LGA    R    27_B      R    27_B     1.360     0    0.019   1.131     8.297   81.429   51.818
LGA    E    28_B      E    28_B     1.512     0    0.046   0.111     2.353   79.286   73.016
LGA    R    29_B      R    29_B     1.390     0    0.015   1.192     5.783   81.429   57.792
LGA    L    30_B      L    30_B     1.559     0    0.094   1.329     4.676   79.286   70.952
LGA    L    31_B      L    31_B     1.246     0    0.095   1.378     3.024   81.429   75.417
LGA    M    32_B      M    32_B     1.307     0    0.012   1.019     5.573   79.286   68.631
LGA    V    33_B      V    33_B     1.896     0    0.038   0.095     2.356   70.833   68.231
LGA    F    34_B      F    34_B     1.778     0    0.047   0.139     2.478   72.857   71.429
LGA    D    35_B      D    35_B     2.578     0    0.097   0.832     6.671   62.857   45.298
LGA    E    36_B      E    36_B     2.610     0    0.063   1.069     6.242   57.143   46.085
LGA    E    37_B      E    37_B     3.906     0    0.075   0.856     7.652   46.667   30.794
LGA    R    38_B      R    38_B     1.787     0    0.088   0.789     3.332   72.976   63.680
LGA    V    39_B      V    39_B     1.461     0    0.025   0.062     1.711   75.000   75.306
LGA    E    40_B      E    40_B     2.097     0    0.017   0.959     6.849   70.833   48.730
LGA    E    41_B      E    41_B     1.744     0    0.008   0.824     3.103   77.143   69.524
LGA    Y    42_B      Y    42_B     1.028     0    0.020   1.297     8.955   83.690   51.627
LGA    M    43_B      M    43_B     1.530     0    0.059   1.323     7.256   79.286   59.762
LGA    K    44_B      K    44_B     1.350     0    0.035   1.040     5.660   81.429   65.291
LGA    I    45_B      I    45_B     0.685     0    0.023   0.094     1.275   90.476   89.345
LGA    M    46_B      M    46_B     1.106     0    0.023   1.127     3.136   83.690   77.560
LGA    K    47_B      K    47_B     1.639     0    0.075   0.995     5.828   79.286   61.111
LGA    E    48_B      E    48_B     0.756     0    0.012   0.128     1.433   85.952   87.460
LGA    V    49_B      V    49_B     1.524     0    0.044   0.097     2.291   75.000   74.150
LGA    I    50_B      I    50_B     2.134     0    0.023   0.638     2.599   66.786   68.036
LGA    E    51_B      E    51_B     1.765     0    0.027   0.082     1.990   72.857   75.714
LGA    K    52_B      K    52_B     1.991     0    0.023   0.925     5.290   66.905   59.947
LGA    I    53_B      I    53_B     3.222     0    0.016   0.044     4.126   50.119   45.952
LGA    L    54_B      L    54_B     3.124     0    0.053   1.390     6.070   53.571   47.738
LGA    E    55_B      E    55_B     2.316     0    0.014   0.607     3.432   59.048   59.788
LGA    N    56_B      N    56_B     3.399     0    0.010   0.908     4.078   46.905   45.952
LGA    R    57_B      R    57_B     4.255     0    0.066   1.322     4.615   38.690   46.840
LGA    K    58_B      K    58_B     3.783     0    0.093   0.724     4.080   41.786   47.196
LGA    K    64_B      K    64_B     7.934     0    0.658   0.734    11.418    6.190    3.228
LGA    V    65_B      V    65_B     4.498     0    0.100   0.144     5.297   32.976   34.830
LGA    E    66_B      E    66_B     3.236     0    0.024   0.874     4.050   57.738   49.788
LGA    I    67_B      I    67_B     2.185     0    0.039   0.138     5.172   69.048   55.714
LGA    P    68_B      P    68_B     0.657     0    0.031   0.327     1.887   88.214   85.374
LGA    P    69_B      P    69_B     1.235     0    0.023   0.346     2.558   77.381   73.197
LGA    G    70_B      G    70_B     2.657     0    0.222   0.222     2.741   61.071   61.071
LGA    M    71_B      M    71_B     3.213     0    0.145   0.694     4.082   48.571   59.881
LGA    E    72_B      E    72_B     3.580     0    0.037   0.759     5.300   37.738   42.434
LGA    W    73_B      W    73_B     6.047     0    0.036   1.197     9.022   17.976   12.483
LGA    F    74_B      F    74_B     7.127     0    0.049   1.424    13.306   10.476    5.325
LGA    Y    75_B      Y    75_B     7.093     0    0.041   0.196     8.805    8.333    8.373
LGA    E    76_B      E    76_B     8.181     0    0.008   1.046    10.651    4.167    3.280
LGA    N    77_B      N    77_B     9.862     0    0.015   0.775    11.331    0.833    1.250
LGA    F    78_B      F    78_B    10.654     0    0.047   1.186    14.765    0.000    0.043
LGA    L    79_B      L    79_B    11.552     0    0.020   0.102    13.139    0.000    0.000
LGA    R    80_B      R    80_B    12.795     0    0.019   1.336    14.480    0.000    1.169
LGA    Y    81_B      Y    81_B    13.988     0    0.024   1.282    18.454    0.000    0.000
LGA    Y    82_B      Y    82_B    14.442     0    0.054   0.263    16.300    0.000    0.000
LGA    D    83_B      D    83_B    15.997     0    0.013   0.164    17.689    0.000    0.000
LGA    Y    84_B      Y    84_B    17.393     0    0.053   1.266    19.080    0.000    0.000
LGA    E    85_B      E    85_B    17.804     0    0.061   1.183    19.441    0.000    0.000
LGA    E    86_B      E    86_B    18.861     0    0.008   0.597    20.862    0.000    0.000
LGA    E    87_B      E    87_B    20.967     0    0.088   0.971    22.496    0.000    0.000
LGA    K    88_B      K    88_B    21.967     0    0.032   0.075    23.324    0.000    0.000
LGA    L    89_B      L    89_B    22.113     0    0.119   0.145    24.117    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):     5.907          6.004                  6.387           53.315   48.295

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)   89   76    4.0     58    2.23    62.500    63.888     2.488

LGA_LOCAL      RMSD:   2.231  Number of atoms:   58  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   7.354  Number of assigned atoms:   76 
Std_ASGN_ATOMS RMSD:   5.907  Standard rmsd on all 76 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.937211 * X  +  -0.092391 * Y  +  -0.336303 * Z  +  19.432135
  Y_new =  -0.013343 * X  +   0.973065 * Y  +  -0.230143 * Z  + -47.460751
  Z_new =   0.348508 * X  +  -0.211205 * Y  +  -0.913200 * Z  +   3.659544 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -3.127357 -0.355979 -2.914309   [DEG: -179.1843  -20.3961 -166.9776 ]
ZXZ: -0.970664  2.721866  2.115635   [DEG:  -55.6149  155.9514  121.2170 ]
 
# END of job
