
#######################################################
#                                                     #
#                        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   82 (  674),  selected   79 , name one
# Molecule2: number of CA atoms   79 (  632),  selected   79 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:A  -ch2:A  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    79       3_A - 81_A        1.97     1.97
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    79       3_A - 81_A        1.97     1.97
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    41      13_A - 53_A        1.00     2.42
  LCS_AVERAGE:     45.09

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:   79
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     L     3_A     L     3_A     37   79   79     10   29   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     L     4_A     L     4_A     37   79   79     20   30   48   57   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     L     5_A     L     5_A     37   79   79      6   30   48   57   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     C     6_A     C     6_A     37   79   79     20   30   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     P     7_A     P     7_A     37   79   79      6   30   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     N     8_A     N     8_A     37   79   79     20   30   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     C     9_A     C     9_A     37   79   79      4   30   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     Q    10_A     Q    10_A     37   79   79     16   30   48   57   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     V    11_A     V    11_A     37   79   79      6   23   39   52   61   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     G    12_A     G    12_A     37   79   79     20   30   48   57   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     M    13_A     M    13_A     41   79   79     20   30   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     R    14_A     R    14_A     41   79   79     20   30   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    15_A     E    15_A     41   79   79     17   30   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     V    16_A     V    16_A     41   79   79     20   30   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    17_A     E    17_A     41   79   79     18   30   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     R    18_A     R    18_A     41   79   79      7   30   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     R    19_A     R    19_A     41   79   79      7   26   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     G    20_A     G    20_A     41   79   79     12   30   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     V    21_A     V    21_A     41   79   79     20   30   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     L    22_A     L    22_A     41   79   79     20   30   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     I    23_A     I    23_A     41   79   79     20   30   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     D    24_A     D    24_A     41   79   79     20   30   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     V    25_A     V    25_A     41   79   79     20   30   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     C    26_A     C    26_A     41   79   79     20   30   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     P    27_A     P    27_A     41   79   79     20   30   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     Q    28_A     Q    28_A     41   79   79     20   30   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     C    29_A     C    29_A     41   79   79     20   30   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     G    30_A     G    30_A     41   79   79     20   30   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     G    31_A     G    31_A     41   79   79     14   31   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     V    32_A     V    32_A     41   79   79     20   31   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     W    33_A     W    33_A     41   79   79     20   30   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     L    34_A     L    34_A     41   79   79     20   30   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     D    35_A     D    35_A     41   79   79      9   30   48   57   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     K    36_A     K    36_A     41   79   79      9   30   42   52   60   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     G    37_A     G    37_A     41   79   79     17   30   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    38_A     E    38_A     41   79   79     17   31   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     L    39_A     L    39_A     41   79   79     17   31   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    40_A     E    40_A     41   79   79     17   31   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     K    41_A     K    41_A     41   79   79     17   31   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     L    42_A     L    42_A     41   79   79     17   31   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     L    43_A     L    43_A     41   79   79     17   31   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     A    44_A     A    44_A     41   79   79     17   31   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    45_A     E    45_A     41   79   79     17   31   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     A    46_A     A    46_A     41   79   79     17   31   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    47_A     E    47_A     41   79   79     17   31   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    48_A     E    48_A     41   79   79     17   31   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     V    49_A     V    49_A     41   79   79     17   31   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    50_A     E    50_A     41   79   79     17   31   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     R    51_A     R    51_A     41   79   79     17   31   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     R    52_A     R    52_A     41   79   79     17   30   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     Y    53_A     Y    53_A     41   79   79     17   31   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    54_A     E    54_A     35   79   79     17   31   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    55_A     E    55_A     35   79   79     17   31   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    56_A     E    56_A     35   79   79     17   31   47   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     L    57_A     L    57_A     35   79   79     17   31   46   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    58_A     E    58_A     35   79   79     15   31   46   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     G    59_A     G    59_A     35   79   79     15   31   46   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     F    60_A     F    60_A     35   79   79     14   31   46   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     Y    61_A     Y    61_A     35   79   79     15   31   46   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     R    62_A     R    62_A     35   79   79     14   31   46   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     K    63_A     K    63_A     35   79   79     14   31   44   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     E    64_A     E    64_A     35   79   79     14   31   41   58   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     G    65_A     G    65_A     35   79   79     14   26   40   57   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     K    66_A     K    66_A     35   79   79     14   31   44   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     P    67_A     P    67_A     35   79   79      8   31   44   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     Y    68_A     Y    68_A     35   79   79      4   31   45   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     K    69_A     K    69_A     35   79   79      3   14   28   46   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     R    70_A     R    70_A     35   79   79     11   21   32   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     K    71_A     K    71_A     35   79   79     11   18   28   56   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     K    72_A     K    72_A     27   79   79      3    5    9   23   43   60   70   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     G    73_A     G    73_A     26   79   79      3   28   48   57   65   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     F    74_A     F    74_A     24   79   79      4    4   21   31   43   65   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     M    75_A     M    75_A      8   79   79      4   18   48   59   68   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     K    76_A     K    76_A      8   79   79      4   28   48   56   64   70   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     L    77_A     L    77_A      8   79   79      4    5   22   51   58   65   72   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     F    78_A     F    78_A      8   79   79      4    5   10   43   56   63   72   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     D    79_A     D    79_A      8   79   79      4    5   21   37   58   65   74   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     L    80_A     L    80_A      8   79   79      4    5   22   34   44   55   66   77   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_GDT     F    81_A     F    81_A      8   79   79      3    5    9   31   44   51   69   78   79   79   79   79   79   79   79   79   79   79   79   79 
LCS_AVERAGE  LCS_A:  81.70  (  45.09  100.00  100.00 )

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     20     31     48     59     68     70     74     78     79     79     79     79     79     79     79     79     79     79     79     79 
GDT PERCENT_AT  25.32  39.24  60.76  74.68  86.08  88.61  93.67  98.73 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00
GDT RMS_LOCAL    0.28   0.65   0.98   1.26   1.46   1.53   1.71   1.92   1.97   1.97   1.97   1.97   1.97   1.97   1.97   1.97   1.97   1.97   1.97   1.97
GDT RMS_ALL_AT   5.28   2.53   2.74   2.02   2.05   2.04   2.00   1.98   1.97   1.97   1.97   1.97   1.97   1.97   1.97   1.97   1.97   1.97   1.97   1.97

# Checking swapping
#   possible swapping detected:  E    17_A      E    17_A
#   possible swapping detected:  E    38_A      E    38_A
#   possible swapping detected:  E    40_A      E    40_A
#   possible swapping detected:  E    47_A      E    47_A
#   possible swapping detected:  E    48_A      E    48_A
#   possible swapping detected:  Y    53_A      Y    53_A
#   possible swapping detected:  E    54_A      E    54_A
#   possible swapping detected:  E    55_A      E    55_A
#   possible swapping detected:  F    60_A      F    60_A
#   possible swapping detected:  E    64_A      E    64_A
#   possible swapping detected:  Y    68_A      Y    68_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    L     3_A      L     3_A     1.612     0    0.256   1.387     5.204   68.929   54.940
LGA    L     4_A      L     4_A     2.268     0    0.037   0.692     2.953   60.952   62.917
LGA    L     5_A      L     5_A     2.680     4    0.023   0.023     2.698   60.952   30.476
LGA    C     6_A      C     6_A     1.288     0    0.034   0.085     1.944   75.000   78.651
LGA    P     7_A      P     7_A     2.043     0    0.018   0.034     2.482   70.833   69.388
LGA    N     8_A      N     8_A     0.296     0    0.147   0.769     1.634   88.452   87.262
LGA    C     9_A      C     9_A     1.235     0    0.069   0.774     2.342   77.381   77.302
LGA    Q    10_A      Q    10_A     2.542     0    0.089   1.152     5.739   59.286   49.048
LGA    V    11_A      V    11_A     3.116     0    0.095   1.187     4.870   57.262   51.497
LGA    G    12_A      G    12_A     2.525     0    0.031   0.031     2.673   60.952   60.952
LGA    M    13_A      M    13_A     1.213     0    0.021   0.859     2.566   75.119   75.238
LGA    R    14_A      R    14_A     1.243     0    0.103   1.101     6.867   81.429   61.126
LGA    E    15_A      E    15_A     0.611     0    0.035   0.740     3.500   90.476   77.672
LGA    V    16_A      V    16_A     0.550     0    0.040   0.069     0.633   90.476   91.837
LGA    E    17_A      E    17_A     0.674     0    0.038   0.227     2.729   86.071   79.894
LGA    R    18_A      R    18_A     1.386     3    0.041   0.159     2.382   83.690   55.455
LGA    R    19_A      R    19_A     1.605     5    0.034   0.427     3.117   81.667   40.130
LGA    G    20_A      G    20_A     0.539     0    0.091   0.091     1.189   88.214   88.214
LGA    V    21_A      V    21_A     1.351     0    0.037   0.094     2.487   85.952   78.027
LGA    L    22_A      L    22_A     1.356     0    0.076   0.905     4.741   79.286   67.917
LGA    I    23_A      I    23_A     1.106     0    0.050   0.272     1.447   88.333   84.881
LGA    D    24_A      D    24_A     0.858     0    0.064   0.227     2.073   88.214   80.595
LGA    V    25_A      V    25_A     0.529     0    0.023   0.090     0.990   90.476   90.476
LGA    C    26_A      C    26_A     0.767     0    0.062   0.095     1.123   85.952   87.460
LGA    P    27_A      P    27_A     1.833     0    0.011   0.033     2.266   72.976   70.612
LGA    Q    28_A      Q    28_A     1.776     0    0.077   0.188     2.473   72.857   71.958
LGA    C    29_A      C    29_A     1.217     0    0.063   0.083     1.814   79.286   84.603
LGA    G    30_A      G    30_A     1.618     0    0.019   0.019     1.836   77.143   77.143
LGA    G    31_A      G    31_A     1.428     0    0.089   0.089     1.428   83.690   83.690
LGA    V    32_A      V    32_A     1.155     0    0.029   1.106     3.563   79.286   74.762
LGA    W    33_A      W    33_A     1.547     0    0.028   0.353     3.465   77.143   68.027
LGA    L    34_A      L    34_A     1.692     0    0.055   0.696     2.468   70.833   71.905
LGA    D    35_A      D    35_A     2.073     0    0.068   0.152     2.237   68.810   66.786
LGA    K    36_A      K    36_A     3.169     0    0.607   1.002     9.384   48.929   34.497
LGA    G    37_A      G    37_A     1.178     0    0.147   0.147     1.178   83.690   83.690
LGA    E    38_A      E    38_A     0.982     0    0.019   0.909     3.541   88.214   79.259
LGA    L    39_A      L    39_A     0.494     0    0.052   0.066     0.671   97.619   98.810
LGA    E    40_A      E    40_A     0.886     0    0.024   0.811     3.577   90.476   77.513
LGA    K    41_A      K    41_A     1.089     0    0.051   0.151     2.236   83.690   76.825
LGA    L    42_A      L    42_A     0.670     0    0.023   1.353     3.830   95.238   76.905
LGA    L    43_A      L    43_A     0.318     0    0.082   0.089     0.845  100.000   95.238
LGA    A    44_A      A    44_A     1.098     0    0.050   0.063     1.436   83.690   83.238
LGA    E    45_A      E    45_A     1.225     0    0.019   0.641     3.626   85.952   68.730
LGA    A    46_A      A    46_A     0.686     0    0.046   0.054     0.841   92.857   92.381
LGA    E    47_A      E    47_A     0.843     0    0.015   0.438     2.187   88.214   79.735
LGA    E    48_A      E    48_A     1.442     0    0.028   0.779     2.996   81.429   71.376
LGA    V    49_A      V    49_A     1.156     0    0.016   0.046     1.449   85.952   84.014
LGA    E    50_A      E    50_A     0.467     0    0.029   0.596     2.452   92.857   86.772
LGA    R    51_A      R    51_A     1.066     0    0.055   1.039     6.933   83.690   58.355
LGA    R    52_A      R    52_A     1.392     0    0.030   0.784     4.940   81.429   62.381
LGA    Y    53_A      Y    53_A     0.960     0    0.011   1.203     6.254   88.214   66.429
LGA    E    54_A      E    54_A     0.253     0    0.041   0.951     3.802  100.000   88.624
LGA    E    55_A      E    55_A     0.270     0    0.019   0.149     1.032  100.000   94.762
LGA    E    56_A      E    56_A     0.735     0    0.012   0.914     3.990   90.476   70.741
LGA    L    57_A      L    57_A     0.864     0    0.064   0.063     1.195   88.214   88.214
LGA    E    58_A      E    58_A     0.782     0    0.041   0.845     3.354   88.214   77.302
LGA    G    59_A      G    59_A     1.060     0    0.013   0.013     1.758   81.548   81.548
LGA    F    60_A      F    60_A     1.711     0    0.064   1.220     4.673   72.976   63.290
LGA    Y    61_A      Y    61_A     1.815     0    0.016   0.107     2.160   70.833   72.183
LGA    R    62_A      R    62_A     1.808     0    0.028   1.145     4.758   68.810   64.892
LGA    K    63_A      K    63_A     2.357     2    0.065   0.682     4.517   60.952   44.974
LGA    E    64_A      E    64_A     2.775     0    0.016   0.735     3.433   55.357   54.762
LGA    G    65_A      G    65_A     2.998     0    0.073   0.073     2.998   57.143   57.143
LGA    K    66_A      K    66_A     2.478     3    0.008   0.045     2.557   62.857   42.328
LGA    P    67_A      P    67_A     2.299     0    0.078   0.383     2.736   66.786   63.741
LGA    Y    68_A      Y    68_A     2.114     0    0.009   0.121     2.445   64.762   79.762
LGA    K    69_A      K    69_A     2.928     2    0.099   0.521     6.640   60.952   35.767
LGA    R    70_A      R    70_A     1.966     0    0.069   0.904     5.901   66.786   53.896
LGA    K    71_A      K    71_A     1.992     0    0.673   0.966     3.930   68.810   60.952
LGA    K    72_A      K    72_A     4.130     0    0.390   0.690    11.543   46.905   27.831
LGA    G    73_A      G    73_A     2.504     0    0.630   0.630     3.825   53.690   53.690
LGA    F    74_A      F    74_A     3.548     0    0.079   1.262     9.544   51.905   28.615
LGA    M    75_A      M    75_A     1.371     0    0.035   0.329     2.622   79.286   73.155
LGA    K    76_A      K    76_A     2.765     0    0.171   0.461     6.503   55.833   43.651
LGA    L    77_A      L    77_A     4.067     0    0.145   0.454     5.911   41.905   33.631
LGA    F    78_A      F    78_A     4.038     0    0.079   0.154     5.049   40.238   36.797
LGA    D    79_A      D    79_A     3.640     0    0.033   0.159     4.137   40.238   48.750
LGA    L    80_A      L    80_A     4.590     0    0.029   1.281     8.876   32.857   22.202
LGA    F    81_A      F    81_A     4.255     0    0.151   0.141     6.202   41.905   30.823

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:       79     316    316  100.00     632    632  100.00                79
SUMMARY(RMSD_GDC):     1.975          1.965                  2.721           74.934   67.355

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)   82   79    4.0     78    1.92    78.165    88.458     3.862

LGA_LOCAL      RMSD:   1.919  Number of atoms:   78  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   1.976  Number of assigned atoms:   79 
Std_ASGN_ATOMS RMSD:   1.975  Standard rmsd on all 79 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.520532 * X  +   0.457752 * Y  +   0.720770 * Z  + -13.169421
  Y_new =   0.156930 * X  +   0.778479 * Y  +  -0.607736 * Z  +  -7.520916
  Z_new =  -0.839297 * X  +   0.429456 * Y  +   0.333389 * Z  +  19.004076 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  0.292813  0.995989  0.910672   [DEG:   16.7770   57.0659   52.1777 ]
ZXZ:  0.870277  1.230901 -1.097844   [DEG:   49.8632   70.5254  -62.9018 ]
 
# END of job
