
#######################################################
#                                                     #
#                        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        4.89     6.09
  LCS_AVERAGE:     93.54

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    48       9_B - 56_B        1.96     7.58
  LCS_AVERAGE:     55.92

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    27      35_B - 66_B        0.95     7.71
  LONGEST_CONTINUOUS_SEGMENT:    27      36_B - 67_B        0.99     7.47
  LCS_AVERAGE:     33.55

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   48   72      8   16   24   27   39   46   53   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     P    10_B     P    10_B     26   48   72     17   24   28   38   44   49   54   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     K    11_B     K    11_B     26   48   72     17   24   30   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     E    12_B     E    12_B     26   48   72     17   24   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     E    13_B     E    13_B     26   48   72     17   24   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     K    14_B     K    14_B     26   48   72     17   24   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     F    15_B     F    15_B     26   48   72     17   24   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     K    16_B     K    16_B     26   48   72     17   24   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     K    17_B     K    17_B     26   48   72     17   24   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     K    18_B     K    18_B     26   48   72     17   24   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     L    19_B     L    19_B     26   48   72     17   24   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     E    20_B     E    20_B     26   48   72     17   24   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     E    21_B     E    21_B     26   48   72     17   24   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     E    22_B     E    22_B     26   48   72     17   24   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     L    23_B     L    23_B     26   48   72     17   24   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     K    24_B     K    24_B     26   48   72     17   24   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     K    25_B     K    25_B     26   48   72     17   24   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     I    26_B     I    26_B     26   48   72     17   24   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     R    27_B     R    27_B     26   48   72     16   24   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     E    28_B     E    28_B     26   48   72     16   24   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     R    29_B     R    29_B     26   48   72     16   24   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     L    30_B     L    30_B     26   48   72     15   24   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     L    31_B     L    31_B     26   48   72     13   24   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     M    32_B     M    32_B     26   48   72     13   24   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     V    33_B     V    33_B     26   48   72      4   20   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     F    34_B     F    34_B     26   48   72      4   20   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     D    35_B     D    35_B     27   48   72      5   18   28   37   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     E    36_B     E    36_B     27   48   72      6   20   28   37   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     E    37_B     E    37_B     27   48   72      3   12   25   29   37   48   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     R    38_B     R    38_B     27   48   72     12   22   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     V    39_B     V    39_B     27   48   72     18   22   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     E    40_B     E    40_B     27   48   72     18   22   28   38   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     E    41_B     E    41_B     27   48   72     18   22   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     Y    42_B     Y    42_B     27   48   72     18   22   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     M    43_B     M    43_B     27   48   72     18   22   29   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     K    44_B     K    44_B     27   48   72     18   22   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     I    45_B     I    45_B     27   48   72     18   22   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     M    46_B     M    46_B     27   48   72     18   22   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     K    47_B     K    47_B     27   48   72     18   22   29   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     E    48_B     E    48_B     27   48   72     18   22   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     V    49_B     V    49_B     27   48   72     18   22   25   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     I    50_B     I    50_B     27   48   72     18   22   25   31   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     E    51_B     E    51_B     27   48   72     18   22   25   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     K    52_B     K    52_B     27   48   72     18   22   25   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     I    53_B     I    53_B     27   48   72     18   22   25   29   37   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     L    54_B     L    54_B     27   48   72     18   22   25   29   40   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     E    55_B     E    55_B     27   48   72     18   22   25   31   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     N    56_B     N    56_B     27   48   72     17   22   25   29   37   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     R    57_B     R    57_B     27   47   72     17   22   25   29   37   44   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     K    58_B     K    58_B     27   45   72     18   22   25   29   37   48   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     K    64_B     K    64_B     27   44   72      4   10   15   24   28   34   39   44   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     V    65_B     V    65_B     27   44   72      5   11   23   26   32   39   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     E    66_B     E    66_B     27   44   72      7   22   25   29   40   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     I    67_B     I    67_B     27   44   72      4   17   24   28   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     P    68_B     P    68_B     23   44   72      5   23   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     P    69_B     P    69_B     23   44   72     13   24   31   39   45   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     G    70_B     G    70_B     23   40   72      4   20   22   25   34   46   51   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     M    71_B     M    71_B     23   38   72     10   20   22   25   28   48   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     E    72_B     E    72_B     23   35   72     14   20   22   25   38   49   55   58   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     W    73_B     W    73_B     23   34   72     10   20   22   25   27   31   33   53   60   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     F    74_B     F    74_B     23   31   72     14   20   22   25   27   31   33   36   55   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     Y    75_B     Y    75_B     23   28   72     14   20   22   25   27   31   33   36   55   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     E    76_B     E    76_B     23   26   72     14   20   22   25   27   31   33   36   55   62   63   63   64   67   67   68   70   71   71   72 
LCS_GDT     N    77_B     N    77_B     23   26   72     14   20   22   25   27   31   33   35   36   40   59   63   64   67   67   68   70   71   71   72 
LCS_GDT     F    78_B     F    78_B     23   26   72     14   20   22   25   27   31   33   35   36   38   40   59   64   67   67   68   70   71   71   72 
LCS_GDT     L    79_B     L    79_B     23   26   72     12   20   22   25   27   31   33   35   36   38   40   59   63   67   67   68   70   71   71   72 
LCS_GDT     R    80_B     R    80_B     23   26   72     12   20   22   25   27   31   33   35   36   38   40   51   63   67   67   68   70   71   71   72 
LCS_GDT     Y    81_B     Y    81_B     23   26   72     14   20   22   25   27   31   33   35   36   38   39   41   45   51   61   68   70   71   71   72 
LCS_GDT     Y    82_B     Y    82_B     23   26   72     14   20   22   25   27   31   33   35   36   38   39   41   44   50   58   63   70   71   71   72 
LCS_GDT     D    83_B     D    83_B     23   26   72     14   20   22   25   27   31   33   35   36   38   39   41   44   50   58   62   70   71   71   72 
LCS_GDT     Y    84_B     Y    84_B     23   26   72     14   20   22   25   27   31   33   35   36   38   39   41   44   46   58   62   65   71   71   72 
LCS_GDT     E    85_B     E    85_B     23   26   72     14   20   22   25   27   31   33   35   36   38   39   41   44   46   49   54   60   66   69   72 
LCS_GDT     E    86_B     E    86_B     23   26   59     14   20   22   25   27   31   33   35   36   38   39   41   43   46   48   50   57   62   68   72 
LCS_GDT     E    87_B     E    87_B     23   26   54      8   20   22   25   27   31   33   35   36   38   39   41   43   46   48   49   54   60   65   71 
LCS_GDT     K    88_B     K    88_B     23   26   53     14   20   22   25   27   31   33   35   36   38   39   41   43   46   48   49   53   58   61   68 
LCS_GDT     L    89_B     L    89_B     23   26   53     14   20   22   25   27   31   33   35   36   38   39   41   43   46   48   49   53   58   61   68 
LCS_AVERAGE  LCS_A:  61.01  (  33.55   55.92   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     18     24     31     39     45     49     55     58     60     62     63     63     64     67     67     68     70     71     71     72 
GDT PERCENT_AT  23.68  31.58  40.79  51.32  59.21  64.47  72.37  76.32  78.95  81.58  82.89  82.89  84.21  88.16  88.16  89.47  92.11  93.42  93.42  94.74
GDT RMS_LOCAL    0.29   0.55   1.05   1.38   1.62   1.83   2.22   2.31   2.52   2.75   2.88   2.88   3.07   3.66   3.66   3.91   4.39   4.64   4.64   4.89
GDT RMS_ALL_AT   7.46   7.84   7.91   7.75   7.71   7.59   7.39   7.35   7.22   7.09   7.01   7.01   6.91   6.61   6.61   6.50   6.28   6.18   6.18   6.09

# Checking swapping
#   possible swapping detected:  E    13_B      E    13_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    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     3.474     0    0.204   0.681     4.674   50.357   45.000
LGA    P    10_B      P    10_B     2.336     0    0.024   0.313     2.613   64.881   64.898
LGA    K    11_B      K    11_B     1.799     0    0.041   0.067     2.657   70.833   68.413
LGA    E    12_B      E    12_B     1.851     0    0.025   0.217     3.056   72.857   64.233
LGA    E    13_B      E    13_B     1.918     0    0.030   1.118     5.807   72.857   60.582
LGA    K    14_B      K    14_B     1.535     0    0.013   0.803     4.263   72.857   63.228
LGA    F    15_B      F    15_B     1.548     0    0.008   0.107     1.660   72.857   77.532
LGA    K    16_B      K    16_B     1.895     0    0.090   0.963     4.179   72.857   68.254
LGA    K    17_B      K    17_B     1.713     0    0.044   1.008     6.676   72.857   55.238
LGA    K    18_B      K    18_B     1.914     0    0.061   0.580     3.366   72.857   65.873
LGA    L    19_B      L    19_B     1.899     0    0.017   0.121     2.055   72.857   71.845
LGA    E    20_B      E    20_B     1.984     0    0.021   0.167     2.543   70.833   68.413
LGA    E    21_B      E    21_B     1.911     0    0.017   0.842     3.081   72.857   67.672
LGA    E    22_B      E    22_B     1.943     0    0.012   0.858     5.510   72.857   58.571
LGA    L    23_B      L    23_B     1.910     0    0.055   1.399     4.460   72.857   64.464
LGA    K    24_B      K    24_B     1.896     0    0.012   1.067     6.725   72.857   54.497
LGA    K    25_B      K    25_B     1.996     0    0.013   0.637     2.441   72.857   72.063
LGA    I    26_B      I    26_B     1.774     0    0.061   0.070     2.183   75.000   71.905
LGA    R    27_B      R    27_B     1.493     0    0.015   1.150     8.376   79.286   50.563
LGA    E    28_B      E    28_B     1.602     0    0.061   0.133     2.234   75.000   72.910
LGA    R    29_B      R    29_B     1.581     0    0.015   1.214     5.104   75.000   56.061
LGA    L    30_B      L    30_B     1.374     0    0.055   1.150     4.021   83.690   75.952
LGA    L    31_B      L    31_B     1.098     0    0.093   1.372     2.913   81.429   76.310
LGA    M    32_B      M    32_B     1.294     0    0.016   1.023     5.572   79.286   68.631
LGA    V    33_B      V    33_B     1.834     0    0.041   0.098     2.355   70.833   68.231
LGA    F    34_B      F    34_B     1.911     0    0.052   0.082     2.806   72.857   68.528
LGA    D    35_B      D    35_B     2.728     0    0.098   0.523     3.894   60.952   53.810
LGA    E    36_B      E    36_B     2.695     0    0.071   1.062     6.153   57.143   46.085
LGA    E    37_B      E    37_B     3.856     0    0.097   0.815     6.882   46.667   33.915
LGA    R    38_B      R    38_B     1.875     0    0.079   0.798     3.004   72.976   62.944
LGA    V    39_B      V    39_B     1.408     0    0.022   0.056     1.602   75.000   76.531
LGA    E    40_B      E    40_B     2.122     0    0.018   0.959     6.913   70.833   48.730
LGA    E    41_B      E    41_B     1.863     0    0.006   0.821     3.064   77.143   68.624
LGA    Y    42_B      Y    42_B     1.014     0    0.021   1.284     8.631   85.952   53.175
LGA    M    43_B      M    43_B     1.466     0    0.052   1.328     7.372   81.429   60.893
LGA    K    44_B      K    44_B     1.438     0    0.034   1.041     5.577   81.429   65.026
LGA    I    45_B      I    45_B     0.643     0    0.020   0.689     2.313   90.476   86.131
LGA    M    46_B      M    46_B     1.070     0    0.026   1.124     3.129   83.690   78.631
LGA    K    47_B      K    47_B     1.591     0    0.074   0.994     5.910   79.286   61.111
LGA    E    48_B      E    48_B     0.700     0    0.011   0.141     1.559   88.214   87.513
LGA    V    49_B      V    49_B     1.516     0    0.042   0.113     2.366   75.000   74.150
LGA    I    50_B      I    50_B     2.136     0    0.020   0.641     2.645   66.786   68.036
LGA    E    51_B      E    51_B     1.741     0    0.025   0.085     1.979   72.857   75.714
LGA    K    52_B      K    52_B     1.993     0    0.024   0.924     5.173   66.905   61.534
LGA    I    53_B      I    53_B     3.202     0    0.017   0.050     4.106   50.119   45.952
LGA    L    54_B      L    54_B     3.089     0    0.050   1.390     6.079   55.357   49.524
LGA    E    55_B      E    55_B     2.244     0    0.022   0.610     3.297   60.952   60.635
LGA    N    56_B      N    56_B     3.403     0    0.007   0.926     4.141   46.905   45.952
LGA    R    57_B      R    57_B     4.365     0    0.057   0.817     4.718   38.690   44.459
LGA    K    58_B      K    58_B     3.802     0    0.096   0.711     4.101   41.786   47.937
LGA    K    64_B      K    64_B     6.100     0    0.021   0.058     8.932   22.738   14.339
LGA    V    65_B      V    65_B     4.481     0    0.027   0.077     5.237   34.405   35.646
LGA    E    66_B      E    66_B     3.242     0    0.026   0.903     3.825   53.810   50.265
LGA    I    67_B      I    67_B     2.476     0    0.043   0.102     5.383   66.905   53.036
LGA    P    68_B      P    68_B     0.502     0    0.110   0.327     2.078   86.071   81.701
LGA    P    69_B      P    69_B     0.631     0    0.621   0.793     3.193   86.071   77.143
LGA    G    70_B      G    70_B     3.927     0    0.127   0.127     4.396   43.452   43.452
LGA    M    71_B      M    71_B     3.736     0    0.023   0.149     4.379   41.786   42.679
LGA    E    72_B      E    72_B     3.896     0    0.007   0.713     5.355   36.071   40.370
LGA    W    73_B      W    73_B     5.992     0    0.013   1.253     8.782   17.738   13.061
LGA    F    74_B      F    74_B     7.161     0    0.051   1.450    13.520   10.476    5.195
LGA    Y    75_B      Y    75_B     7.087     0    0.032   0.172     8.831    8.333    8.651
LGA    E    76_B      E    76_B     8.099     0    0.009   1.034    10.700    4.167    3.492
LGA    N    77_B      N    77_B     9.905     0    0.015   0.824    11.359    0.833    0.536
LGA    F    78_B      F    78_B    10.604     0    0.055   1.196    14.612    0.119    0.087
LGA    L    79_B      L    79_B    11.442     0    0.019   0.094    12.984    0.000    0.000
LGA    R    80_B      R    80_B    12.565     0    0.017   1.316    14.251    0.000    1.169
LGA    Y    81_B      Y    81_B    13.916     0    0.043   0.274    16.696    0.000    0.000
LGA    Y    82_B      Y    82_B    14.480     0    0.040   0.209    16.274    0.000    0.000
LGA    D    83_B      D    83_B    15.922     0    0.019   0.174    17.595    0.000    0.000
LGA    Y    84_B      Y    84_B    17.316     0    0.077   1.314    19.143    0.000    0.000
LGA    E    85_B      E    85_B    17.869     0    0.076   1.078    19.600    0.000    0.000
LGA    E    86_B      E    86_B    18.974     0    0.010   0.595    20.984    0.000    0.000
LGA    E    87_B      E    87_B    21.043     0    0.092   0.974    22.593    0.000    0.000
LGA    K    88_B      K    88_B    22.047     0    0.030   0.076    23.386    0.000    0.000
LGA    L    89_B      L    89_B    22.198     0    0.115   0.142    24.137    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):     5.897          5.988                  6.328           53.105   47.733

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)   89   76    4.0     58    2.31    62.171    63.530     2.405

LGA_LOCAL      RMSD:   2.311  Number of atoms:   58  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   7.351  Number of assigned atoms:   76 
Std_ASGN_ATOMS RMSD:   5.897  Standard rmsd on all 76 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.470182 * X  +  -0.602107 * Y  +  -0.645288 * Z  +  21.300142
  Y_new =   0.658503 * X  +   0.247475 * Y  +  -0.710725 * Z  + -46.645836
  Z_new =   0.587625 * X  +  -0.759094 * Y  +   0.280131 * Z  +   2.520693 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  2.190867 -0.628121 -1.217267   [DEG:  125.5275  -35.9887  -69.7443 ]
ZXZ: -0.737179  1.286866  2.482836   [DEG:  -42.2372   73.7320  142.2560 ]
 
# END of job
