
#######################################################
#                                                     #
#                        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   85 (  714),  selected   85 , name one
# Molecule2: number of CA atoms  108 (  908),  selected   85 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:C  -ch2:C  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    50      12_C - 61_C        4.95    14.20
  LCS_AVERAGE:     37.89

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    41      12_C - 52_C        1.91    15.71
  LCS_AVERAGE:     24.81

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    35      14_C - 48_C        0.99    15.71
  LCS_AVERAGE:     19.64

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:   85
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     D    12_C     D    12_C     24   41   50     11   20   33   37   38   38   39   40   42   43   45   45   45   46   46   46   46   48   52   57 
LCS_GDT     T    13_C     T    13_C     24   41   50     11   20   22   37   38   38   39   40   42   43   45   45   45   46   46   46   46   48   53   58 
LCS_GDT     L    14_C     L    14_C     35   41   50     11   20   34   37   38   38   39   40   42   43   45   45   45   46   46   46   46   50   56   62 
LCS_GDT     L    15_C     L    15_C     35   41   50     11   23   34   37   38   38   39   40   42   43   45   45   45   46   46   46   46   48   53   58 
LCS_GDT     T    16_C     T    16_C     35   41   50     11   22   34   37   38   38   39   40   42   43   45   45   45   46   46   46   46   48   53   58 
LCS_GDT     M    17_C     M    17_C     35   41   50     11   23   34   37   38   38   39   40   42   43   45   45   45   46   46   46   47   53   56   62 
LCS_GDT     V    18_C     V    18_C     35   41   50     11   20   34   37   38   38   39   40   42   43   45   45   45   46   46   46   49   53   56   62 
LCS_GDT     E    19_C     E    19_C     35   41   50     11   20   34   37   38   38   39   40   42   43   45   45   45   46   46   46   46   48   56   60 
LCS_GDT     W    20_C     W    20_C     35   41   50     11   22   34   37   38   38   39   40   42   43   45   45   45   46   46   46   47   53   56   62 
LCS_GDT     V    21_C     V    21_C     35   41   50     11   23   34   37   38   38   39   40   42   43   45   45   45   46   46   48   51   55   59   62 
LCS_GDT     K    22_C     K    22_C     35   41   50     11   20   34   37   38   38   39   40   42   43   45   45   45   46   46   46   47   53   56   62 
LCS_GDT     E    23_C     E    23_C     35   41   50     11   20   34   37   38   38   39   40   42   43   45   45   45   46   46   46   47   51   56   62 
LCS_GDT     L    24_C     L    24_C     35   41   50     11   22   34   37   38   38   39   40   42   43   45   45   45   46   46   48   51   55   59   62 
LCS_GDT     L    25_C     L    25_C     35   41   50     11   20   34   37   38   38   39   40   42   43   45   45   45   46   46   48   51   55   59   62 
LCS_GDT     E    26_C     E    26_C     35   41   50     11   20   34   37   38   38   39   40   42   43   45   45   45   46   46   46   46   50   56   62 
LCS_GDT     E    27_C     E    27_C     35   41   50     11   20   34   37   38   38   39   40   42   43   45   45   45   46   46   48   51   54   56   62 
LCS_GDT     S    28_C     S    28_C     35   41   50     11   23   34   37   38   38   39   40   42   43   45   45   45   46   46   48   51   56   59   62 
LCS_GDT     V    29_C     V    29_C     35   41   50     11   23   34   37   38   38   39   40   42   43   45   45   45   46   46   46   46   48   55   60 
LCS_GDT     E    30_C     E    30_C     35   41   50     10   23   34   37   38   38   39   40   42   43   45   45   45   46   46   46   46   48   56   60 
LCS_GDT     K    31_C     K    31_C     35   41   50     10   23   34   37   38   38   39   40   42   43   45   45   45   46   46   48   51   56   59   62 
LCS_GDT     N    32_C     N    32_C     35   41   50     10   23   34   37   38   38   39   40   42   43   45   45   45   46   46   46   49   54   59   62 
LCS_GDT     S    33_C     S    33_C     35   41   50     10   23   34   37   38   38   39   40   42   43   45   45   45   46   50   53   55   58   59   62 
LCS_GDT     R    34_C     R    34_C     35   41   50     14   23   34   37   38   38   39   40   42   43   45   45   45   46   46   46   46   50   57   60 
LCS_GDT     M    35_C     M    35_C     35   41   50     14   23   34   37   38   38   39   40   42   43   45   45   45   46   50   53   55   58   59   60 
LCS_GDT     R    36_C     R    36_C     35   41   50     14   23   34   37   38   38   39   40   42   43   45   45   45   46   50   53   55   58   59   62 
LCS_GDT     H    37_C     H    37_C     35   41   50     14   23   34   37   38   38   39   40   42   43   45   45   45   46   50   53   55   58   59   62 
LCS_GDT     I    38_C     I    38_C     35   41   50     14   23   34   37   38   38   39   40   42   43   45   45   45   46   46   53   55   58   59   60 
LCS_GDT     R    39_C     R    39_C     35   41   50     14   23   34   37   38   38   39   40   42   43   45   45   45   46   50   53   55   58   59   61 
LCS_GDT     A    40_C     A    40_C     35   41   50     14   23   34   37   38   38   39   40   42   43   45   45   45   46   50   53   55   58   59   62 
LCS_GDT     V    41_C     V    41_C     35   41   50     14   23   34   37   38   38   39   40   42   43   45   45   45   46   50   53   55   58   59   62 
LCS_GDT     M    42_C     M    42_C     35   41   50     14   23   34   37   38   38   39   40   42   43   45   45   45   46   50   53   55   58   59   60 
LCS_GDT     W    43_C     W    43_C     35   41   50     14   23   34   37   38   38   39   40   42   43   45   45   45   46   50   53   55   58   59   62 
LCS_GDT     A    44_C     A    44_C     35   41   50     14   23   34   37   38   38   39   40   42   43   45   45   45   46   50   53   55   58   59   62 
LCS_GDT     E    45_C     E    45_C     35   41   50     14   23   34   37   38   38   39   40   42   43   45   45   45   46   50   53   55   58   59   62 
LCS_GDT     Y    46_C     Y    46_C     35   41   50     14   23   34   37   38   38   39   40   42   43   45   45   45   46   50   53   55   58   59   62 
LCS_GDT     M    47_C     M    47_C     35   41   50     14   23   34   37   38   38   39   40   42   43   45   45   45   46   50   53   55   58   59   62 
LCS_GDT     L    48_C     L    48_C     35   41   50      3   18   34   37   38   38   39   40   42   43   45   45   45   46   50   53   55   58   59   62 
LCS_GDT     E    49_C     E    49_C     23   41   50      3    5    7   31   38   38   39   40   42   43   45   45   45   46   50   53   55   58   59   62 
LCS_GDT     I    50_C     I    50_C      7   41   50      4    6    7    7    7   11   22   25   31   41   45   45   45   46   50   53   55   58   59   62 
LCS_GDT     A    51_C     A    51_C      7   41   50      4    6    7    7    7   20   34   40   42   43   45   45   45   46   50   53   55   58   59   62 
LCS_GDT     R    52_C     R    52_C      7   41   50      4    6   17   19   22   24   39   40   41   43   45   45   45   46   50   53   55   58   59   62 
LCS_GDT     S    53_C     S    53_C      7   40   50      4   12   16   19   22   24   36   39   40   43   45   45   45   46   50   53   55   58   59   62 
LCS_GDT     L    54_C     L    54_C      7    8   50      4   10   16   19   22   24   36   40   42   43   45   45   45   46   50   53   55   58   59   62 
LCS_GDT     E    55_C     E    55_C      7    8   50      4    6    7    7   22   30   39   40   42   43   45   45   45   46   50   53   55   58   59   62 
LCS_GDT     D    56_C     D    56_C      3    8   50      3    3    3    5    7   23   39   40   42   43   45   45   45   46   50   53   55   58   59   62 
LCS_GDT     E    57_C     E    57_C      3    4   50      3    3    4    4    5    7   11   33   41   42   43   44   45   46   50   53   55   58   59   62 
LCS_GDT     K    58_C     K    58_C      3   14   50      3    3    4    4    7    8   10   15   21   22   25   30   31   34   41   50   54   58   59   62 
LCS_GDT     I    59_C     I    59_C     13   14   50      5   12   12   13   15   15   16   17   21   23   25   30   36   44   50   53   55   58   59   62 
LCS_GDT     L    60_C     L    60_C     13   14   50      9   12   12   13   15   15   16   17   21   26   32   38   41   45   50   53   55   58   59   62 
LCS_GDT     E    61_C     E    61_C     13   14   50      9   12   12   13   15   15   16   17   21   26   32   38   41   45   50   53   55   58   59   62 
LCS_GDT     I    62_C     I    62_C     13   14   33      9   12   12   13   15   15   16   17   21   26   32   38   41   45   50   53   55   58   59   62 
LCS_GDT     A    63_C     A    63_C     13   14   33      9   12   12   13   15   15   16   17   21   26   32   38   41   45   50   53   55   58   59   62 
LCS_GDT     E    64_C     E    64_C     13   14   33      9   12   12   13   15   15   16   17   21   26   32   38   41   45   50   53   55   58   59   62 
LCS_GDT     K    65_C     K    65_C     13   14   33      9   12   12   13   15   15   16   17   21   26   32   38   41   45   50   53   55   58   59   62 
LCS_GDT     L    66_C     L    66_C     13   14   33      9   12   12   13   15   15   16   17   21   26   32   38   41   45   50   53   55   58   59   62 
LCS_GDT     E    67_C     E    67_C     13   14   33      9   12   12   13   15   15   16   17   21   26   32   38   41   45   50   53   55   58   59   62 
LCS_GDT     K    68_C     K    68_C     13   14   33      9   12   12   13   15   15   16   17   21   26   32   38   41   45   50   53   55   58   59   62 
LCS_GDT     A    69_C     A    69_C     13   14   33      8   12   12   13   15   15   16   16   21   26   32   38   41   45   50   53   55   58   59   62 
LCS_GDT     L    70_C     L    70_C     13   14   33      5   12   12   13   15   15   16   16   21   26   32   38   41   45   50   53   55   58   59   62 
LCS_GDT     P    71_C     P    71_C     13   14   33      3    3    9   13   15   15   16   16   20   24   31   34   40   44   48   53   55   58   59   62 
LCS_GDT     E    72_C     E    72_C      4   14   33      4    4    4    5    7    8   13   17   21   23   25   30   31   33   40   46   50   56   59   62 
LCS_GDT     K    73_C     K    73_C      4    5   33      4    4    4    5    7    8    9   15   21   23   25   30   31   34   41   49   53   58   59   60 
LCS_GDT     S    74_C     S    74_C      4    5   33      4    4    4    5    5    8    9   16   17   18   19   21   25   28   34   40   48   51   55   59 
LCS_GDT     K    75_C     K    75_C      4    5   33      4    4    4    7   15   15   16   16   17   22   24   31   36   43   47   50   54   58   59   62 
LCS_GDT     M    76_C     M    76_C      3    5   33      0    3    3   10   15   15   16   16   17   22   26   35   40   44   50   53   55   58   59   62 
LCS_GDT     F    77_C     F    77_C      3    3   32      0    3    3    8   13   15   16   16   21   26   32   38   41   45   50   53   55   58   59   62 
LCS_GDT     T    78_C     T    78_C      3    3   25      3    3    4    6    7    9   11   13   16   23   26   31   39   43   46   48   53   58   59   62 
LCS_GDT     K    79_C     K    79_C      3    4   24      3    3    4    6    7    9   11   13   16   22   25   31   40   43   46   48   53   58   59   62 
LCS_GDT     E    80_C     E    80_C      3   17   24      3    3    3    3    5    7   10   14   21   23   28   30   40   41   44   48   51   56   59   62 
LCS_GDT     E    81_C     E    81_C     16   17   24     11   17   17   19   22   24   25   26   28   30   34   37   41   45   50   53   55   58   59   62 
LCS_GDT     Y    82_C     Y    82_C     16   17   24      5   17   17   19   22   24   25   26   28   30   34   38   41   45   50   53   55   58   59   62 
LCS_GDT     E    83_C     E    83_C     16   17   24      8   17   17   19   22   24   25   26   28   30   34   38   41   45   50   53   55   58   59   62 
LCS_GDT     K    84_C     K    84_C     16   17   24     11   17   17   19   22   24   25   26   28   30   34   38   41   45   50   53   55   58   59   62 
LCS_GDT     L    85_C     L    85_C     16   17   24     11   17   17   19   22   24   25   26   28   30   34   38   41   45   50   53   55   58   59   62 
LCS_GDT     M    86_C     M    86_C     16   17   24     11   17   17   19   22   24   25   26   28   30   34   38   41   45   50   53   55   58   59   62 
LCS_GDT     E    87_C     E    87_C     16   17   24     11   17   17   19   22   24   25   26   28   30   34   38   41   45   50   53   55   58   59   62 
LCS_GDT     V    88_C     V    88_C     16   17   24     11   17   17   19   22   24   25   26   28   30   34   38   41   45   50   53   55   58   59   62 
LCS_GDT     L    89_C     L    89_C     16   17   24     11   17   17   19   22   24   25   26   28   30   34   38   41   45   50   53   55   58   59   62 
LCS_GDT     E    90_C     E    90_C     16   17   24     11   17   17   19   22   24   25   26   28   30   34   38   41   45   50   53   55   58   59   62 
LCS_GDT     E    91_C     E    91_C     16   17   23     11   17   17   19   22   24   25   26   28   30   34   38   41   45   50   53   55   58   59   62 
LCS_GDT     L    92_C     L    92_C     16   17   23     11   17   17   19   22   24   25   26   28   30   34   38   41   45   50   53   55   58   59   62 
LCS_GDT     E    93_C     E    93_C     16   17   23     11   17   17   19   22   24   25   26   28   30   34   38   41   45   50   53   55   58   59   62 
LCS_GDT     E    94_C     E    94_C     16   17   23     11   17   17   19   22   24   25   26   28   30   34   38   41   45   50   53   55   58   59   62 
LCS_GDT     V    95_C     V    95_C     16   17   23      7   17   17   19   22   24   25   26   28   30   34   38   41   45   50   53   55   58   59   62 
LCS_GDT     L    96_C     L    96_C     16   17   23      7   17   17   19   22   24   25   26   28   30   34   38   41   45   50   53   55   58   59   62 
LCS_AVERAGE  LCS_A:  27.45  (  19.64   24.81   37.89 )

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     14     23     34     37     38     38     39     40     42     43     45     45     45     46     50     53     55     58     59     62 
GDT PERCENT_AT  12.96  21.30  31.48  34.26  35.19  35.19  36.11  37.04  38.89  39.81  41.67  41.67  41.67  42.59  46.30  49.07  50.93  53.70  54.63  57.41
GDT RMS_LOCAL    0.28   0.65   0.94   1.09   1.19   1.19   1.36   1.50   1.97   2.04   2.35   2.35   2.35   2.71   5.44   5.67   5.81   6.07   6.30   6.57
GDT RMS_ALL_AT  16.19  15.94  15.76  15.68  15.79  15.79  15.77  15.62  15.31  15.55  15.53  15.53  15.53  15.28  10.90  10.91  11.02  11.03  10.04   9.94

# Checking swapping
#   possible swapping detected:  E    19_C      E    19_C
#   possible swapping detected:  E    45_C      E    45_C
#   possible swapping detected:  Y    46_C      Y    46_C
#   possible swapping detected:  E    49_C      E    49_C
#   possible swapping detected:  E    64_C      E    64_C
#   possible swapping detected:  E    72_C      E    72_C
#   possible swapping detected:  E    80_C      E    80_C
#   possible swapping detected:  E    81_C      E    81_C
#   possible swapping detected:  Y    82_C      Y    82_C
#   possible swapping detected:  E    87_C      E    87_C
#   possible swapping detected:  E    90_C      E    90_C
#   possible swapping detected:  E    93_C      E    93_C

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    D    12_C      D    12_C     1.118     0    0.346   0.413     2.057   77.262   80.476
LGA    T    13_C      T    13_C     1.830     0    0.033   0.100     2.794   77.143   69.660
LGA    L    14_C      L    14_C     1.177     0    0.021   1.001     4.638   85.952   72.321
LGA    L    15_C      L    15_C     0.670     0    0.048   1.142     3.876   92.857   78.452
LGA    T    16_C      T    16_C     0.695     0    0.040   0.998     3.027   92.857   81.293
LGA    M    17_C      M    17_C     0.623     0    0.098   0.888     3.182   92.857   88.988
LGA    V    18_C      V    18_C     1.571     0    0.019   0.100     2.701   75.000   70.680
LGA    E    19_C      E    19_C     1.871     0    0.054   0.587     5.119   77.143   55.503
LGA    W    20_C      W    20_C     0.909     0    0.040   1.562     5.083   88.214   70.136
LGA    V    21_C      V    21_C     0.737     0    0.050   0.166     1.592   90.595   88.027
LGA    K    22_C      K    22_C     1.655     0    0.028   0.839     6.302   79.286   58.624
LGA    E    23_C      E    23_C     1.388     0    0.039   0.857     5.457   83.690   62.434
LGA    L    24_C      L    24_C     0.896     0    0.023   1.386     3.328   88.214   80.952
LGA    L    25_C      L    25_C     1.241     0    0.035   1.391     3.990   83.690   75.655
LGA    E    26_C      E    26_C     1.189     0    0.039   0.687     3.634   88.214   73.757
LGA    E    27_C      E    27_C     1.104     0    0.048   0.833     2.282   83.690   81.587
LGA    S    28_C      S    28_C     1.214     0    0.042   0.519     2.952   81.548   77.460
LGA    V    29_C      V    29_C     0.924     0    0.037   1.292     3.053   90.476   79.728
LGA    E    30_C      E    30_C     0.445     0    0.044   0.278     1.093   95.238   94.762
LGA    K    31_C      K    31_C     0.860     0    0.134   1.136     4.316   88.214   71.905
LGA    N    32_C      N    32_C     0.946     0    0.033   1.094     3.100   85.952   78.690
LGA    S    33_C      S    33_C     1.043     0    0.042   0.093     1.043   85.952   87.460
LGA    R    34_C      R    34_C     1.417     0    0.063   0.710     4.765   81.429   56.667
LGA    M    35_C      M    35_C     1.365     0    0.040   1.165     4.675   81.429   68.571
LGA    R    36_C      R    36_C     1.314     0    0.024   1.096     2.924   81.429   78.485
LGA    H    37_C      H    37_C     1.034     0    0.049   1.454     4.066   81.429   71.476
LGA    I    38_C      I    38_C     1.330     0    0.041   1.246     4.063   81.429   74.821
LGA    R    39_C      R    39_C     1.448     0    0.042   1.168     4.754   81.429   70.996
LGA    A    40_C      A    40_C     1.183     0    0.027   0.041     1.226   81.429   81.429
LGA    V    41_C      V    41_C     0.904     0    0.032   0.895     2.074   90.476   84.286
LGA    M    42_C      M    42_C     1.007     0    0.026   0.793     3.614   83.690   75.774
LGA    W    43_C      W    43_C     0.925     0    0.067   0.527     4.560   90.476   65.952
LGA    A    44_C      A    44_C     0.925     0    0.036   0.044     1.042   85.952   86.857
LGA    E    45_C      E    45_C     1.397     0    0.029   1.210     4.356   79.286   69.365
LGA    Y    46_C      Y    46_C     1.446     0    0.034   0.827     5.369   81.429   58.611
LGA    M    47_C      M    47_C     0.824     0    0.029   1.429     5.234   90.595   76.607
LGA    L    48_C      L    48_C     0.722     0    0.600   0.943     2.862   88.452   79.762
LGA    E    49_C      E    49_C     2.887     0    0.575   1.176     9.850   48.690   29.259
LGA    I    50_C      I    50_C     6.693     0    0.066   0.657    12.782   19.524    9.940
LGA    A    51_C      A    51_C     6.148     0    0.052   0.056     7.486   24.048   21.238
LGA    R    52_C      R    52_C     3.889     0    0.168   1.754    14.648   41.786   19.394
LGA    S    53_C      S    53_C     5.360     0    0.066   0.075     7.967   29.048   21.746
LGA    L    54_C      L    54_C     6.023     0    0.098   1.068     9.607   22.976   14.583
LGA    E    55_C      E    55_C     4.028     0    0.293   0.921     4.805   37.262   44.392
LGA    D    56_C      D    56_C     5.764     0    0.579   0.938     9.377   15.357   18.095
LGA    E    57_C      E    57_C    10.367     0    0.117   1.132    14.448    0.714    0.317
LGA    K    58_C      K    58_C    15.974     0    0.331   0.949    19.291    0.000    0.000
LGA    I    59_C      I    59_C    16.899     0    0.597   0.965    20.464    0.000    0.000
LGA    L    60_C      L    60_C    16.731     0    0.046   1.416    18.383    0.000    0.000
LGA    E    61_C      E    61_C    21.191     0    0.032   0.245    27.155    0.000    0.000
LGA    I    62_C      I    62_C    19.564     0    0.034   0.530    22.596    0.000    0.000
LGA    A    63_C      A    63_C    16.326     0    0.041   0.056    17.542    0.000    0.000
LGA    E    64_C      E    64_C    20.587     0    0.017   0.905    25.179    0.000    0.000
LGA    K    65_C      K    65_C    22.859     0    0.051   0.659    29.544    0.000    0.000
LGA    L    66_C      L    66_C    18.510     0    0.047   1.374    19.753    0.000    0.000
LGA    E    67_C      E    67_C    19.492     0    0.057   1.225    21.566    0.000    0.000
LGA    K    68_C      K    68_C    24.312     0    0.070   1.154    31.744    0.000    0.000
LGA    A    69_C      A    69_C    22.478     0    0.141   0.138    22.749    0.000    0.000
LGA    L    70_C      L    70_C    20.041     0    0.565   1.202    21.692    0.000    0.000
LGA    P    71_C      P    71_C    24.743     0    0.623   0.827    26.851    0.000    0.000
LGA    E    72_C      E    72_C    22.537     0    0.622   0.770    25.326    0.000    0.000
LGA    K    73_C      K    73_C    17.340     0    0.085   0.865    19.162    0.000    0.000
LGA    S    74_C      S    74_C    22.383     0    0.179   0.644    24.947    0.000    0.000
LGA    K    75_C      K    75_C    25.725     0    0.606   0.912    33.065    0.000    0.000
LGA    M    76_C      M    76_C    22.523     0    0.531   1.529    23.829    0.000    0.000
LGA    F    77_C      F    77_C    21.284     0    0.620   1.595    23.362    0.000    0.000
LGA    T    78_C      T    78_C    27.663     0    0.569   1.064    31.390    0.000    0.000
LGA    K    79_C      K    79_C    28.871     0    0.093   0.943    35.794    0.000    0.000
LGA    E    80_C      E    80_C    26.460     0    0.346   1.081    30.098    0.000    0.000
LGA    E    81_C      E    81_C    24.682     0    0.600   1.088    26.858    0.000    0.000
LGA    Y    82_C      Y    82_C    20.559     0    0.046   1.373    22.277    0.000    0.000
LGA    E    83_C      E    83_C    26.877     0    0.044   1.002    32.215    0.000    0.000
LGA    K    84_C      K    84_C    26.763     0    0.072   1.114    35.042    0.000    0.000
LGA    L    85_C      L    85_C    19.555     0    0.052   0.957    21.980    0.000    0.000
LGA    M    86_C      M    86_C    22.900     0    0.037   0.867    24.950    0.000    0.000
LGA    E    87_C      E    87_C    27.997     0    0.050   1.080    34.066    0.000    0.000
LGA    V    88_C      V    88_C    22.924     0    0.036   1.089    24.478    0.000    0.000
LGA    L    89_C      L    89_C    19.831     0    0.044   0.185    22.103    0.000    0.000
LGA    E    90_C      E    90_C    26.869     0    0.033   0.948    34.110    0.000    0.000
LGA    E    91_C      E    91_C    27.005     0    0.060   0.307    29.731    0.000    0.000
LGA    L    92_C      L    92_C    20.166     0    0.053   0.188    22.332    0.000    0.000
LGA    E    93_C      E    93_C    24.165     0    0.036   1.047    28.963    0.000    0.000
LGA    E    94_C      E    94_C    29.255     0    0.055   1.005    36.493    0.000    0.000
LGA    V    95_C      V    95_C    24.131     0    0.066   0.130    25.567    0.000    0.000
LGA    L    96_C      L    96_C    21.608     0    0.090   0.243    24.142    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:       85     340    340  100.00     714    714  100.00               108
SUMMARY(RMSD_GDC):     9.218          8.975                 10.218           31.332   27.381

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)   85  108    4.0     40    1.50    35.417    33.506     2.501

LGA_LOCAL      RMSD:   1.499  Number of atoms:   40  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  15.618  Number of assigned atoms:   85 
Std_ASGN_ATOMS RMSD:   9.218  Standard rmsd on all 85 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.058853 * X  +   0.713473 * Y  +   0.698207 * Z  + -19.225086
  Y_new =  -0.854396 * X  +  -0.325722 * Y  +   0.404861 * Z  + -34.927792
  Z_new =   0.516279 * X  +  -0.620373 * Y  +   0.590419 * Z  + -19.474537 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -1.502023 -0.542500 -0.810132   [DEG:  -86.0596  -31.0830  -46.4172 ]
ZXZ:  2.096274  0.939219  2.447519   [DEG:  120.1077   53.8133  140.2325 ]
 
# END of job
