
#######################################################
#                                                     #
#                        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  222 ( 1696),  selected  222 , name one
# Molecule2: number of CA atoms  222 ( 1696),  selected  222 , 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:   143      61_A - 203_A       4.98    47.64
  LONGEST_CONTINUOUS_SEGMENT:   143      62_A - 204_A       4.99    48.01
  LCS_AVERAGE:     45.57

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   129      72_A - 200_A       1.95    50.90
  LONGEST_CONTINUOUS_SEGMENT:   129      73_A - 201_A       1.83    51.12
  LONGEST_CONTINUOUS_SEGMENT:   129      74_A - 202_A       1.68    51.43
  LONGEST_CONTINUOUS_SEGMENT:   129      75_A - 203_A       1.85    51.43
  LCS_AVERAGE:     35.30

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   126      75_A - 200_A       0.85    51.48
  LCS_AVERAGE:     32.84

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  222
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     G     1_A     G     1_A      3    4   13      0    3    3    3    4    6    6    7    8   10   11   12   12   14   15   17   19   23   24   25 
LCS_GDT     P     2_A     P     2_A      3    5   13      2    3    4    4    5    6    6    7    8   10   11   12   13   14   15   17   19   23   24   25 
LCS_GDT     H     3_A     H     3_A      3    5   13      3    3    4    4    5    6    6    7    8   10   11   12   13   14   15   17   19   23   24   25 
LCS_GDT     M     4_A     M     4_A      3    5   13      3    3    4    4    5    6    6    7    8   10   11   12   13   14   15   17   19   23   24   25 
LCS_GDT     E     5_A     E     5_A      3    5   13      3    3    3    4    5    6    6    7    8   10   11   12   13   14   15   17   19   23   24   25 
LCS_GDT     Q     6_A     Q     6_A      3    5   13      3    3    4    4    5    6    6    7    8   10   11   12   13   13   15   17   19   23   24   25 
LCS_GDT     L     7_A     L     7_A      3    4   13      1    3    3    3    4    4    6    7    8   10   11   12   13   14   15   17   19   23   24   25 
LCS_GDT     E     8_A     E     8_A      3    4   13      0    3    3    3    4    4    5    6    8   10   11   12   13   14   15   17   19   23   24   25 
LCS_GDT     G     9_A     G     9_A      3    4   13      1    3    3    3    4    4    5    5    8   10   11   12   13   14   15   17   19   23   24   25 
LCS_GDT     I    10_A     I    10_A      3    4   13      0    3    3    3    4    4    5    6    8   10   11   12   13   14   15   17   19   23   24   25 
LCS_GDT     M    11_A     M    11_A      3    5   13      3    3    3    3    5    5    5    6    8   10   11   12   13   14   15   17   19   23   24   25 
LCS_GDT     L    12_A     L    12_A      4    5   13      3    4    4    4    5    5    5    7    8    9   11   12   13   14   15   17   19   23   24   25 
LCS_GDT     S    13_A     S    13_A      4    5   13      3    4    4    4    5    5    6    7    8    9   10   11   13   14   15   17   19   23   24   25 
LCS_GDT     P    14_A     P    14_A      4    5   13      3    4    4    4    5    5    6    7    8    9   10   11   13   14   15   17   19   23   24   25 
LCS_GDT     A    15_A     A    15_A      4    5   13      3    4    4    4    5    5    6    7    8    9   10   11   13   14   15   17   19   23   24   25 
LCS_GDT     F    16_A     F    16_A      3    5   11      3    3    3    4    4    5    6    7    8    8    9   11   12   13   15   16   19   23   24   24 
LCS_GDT     Q    17_A     Q    17_A      3    4   11      3    3    3    4    4    5    6    7    8    8    9   11   12   12   13   16   19   23   24   24 
LCS_GDT     E    18_A     E    18_A      3    4   11      3    3    3    4    4    5    6    7    8    8    9   11   12   13   15   17   19   23   24   25 
LCS_GDT     Q    19_A     Q    19_A      3    4   11      0    3    3    3    4    4    6    7    8    8    9   11   12   12   14   16   19   23   24   24 
LCS_GDT     M    20_A     M    20_A      3    4   11      0    3    3    3    3    4    4    5    6    8    9   11   12   12   13   16   19   23   24   24 
LCS_GDT     N    21_A     N    21_A      3    4   11      0    3    3    3    3    4    4    5    6    8    9   11   12   13   15   17   19   23   24   25 
LCS_GDT     A    22_A     A    22_A      3    4   11      0    3    3    3    3    4    4    5    7    8    9   11   12   13   15   17   19   23   24   25 
LCS_GDT     L    23_A     L    23_A      3    4   11      0    3    3    3    4    4    4    5    7    8    9   11   12   13   15   17   19   23   24   25 
LCS_GDT     M    24_A     M    24_A      3    4   10      0    3    3    3    4    5    5    5    7    7    9   10   11   13   15   17   19   21   24   25 
LCS_GDT     L    25_A     L    25_A      4    4   11      2    4    4    4    5    5    6    6    7    8    9   10   11   13   15   17   19   21   23   25 
LCS_GDT     D    26_A     D    26_A      4    4   11      3    4    4    4    5    5    6    6    7    8    9   10   11   13   15   17   19   21   23   25 
LCS_GDT     P    27_A     P    27_A      4    4   11      3    4    4    4    5    5    6    6    7    8    9   10   11   13   15   17   19   21   23   25 
LCS_GDT     R    28_A     R    28_A      4    4   11      3    4    4    4    5    5    6    6    7    8    9   10   11   13   15   17   19   21   23   25 
LCS_GDT     M    29_A     M    29_A      3    4   11      0    3    3    4    5    5    6    6    7    8    9    9   10   12   13   14   16   17   22   25 
LCS_GDT     L    30_A     L    30_A      3    4   11      0    3    3    4    4    4    6    6    7    8    9    9   10   12   13   14   16   16   17   19 
LCS_GDT     D    31_A     D    31_A      3    3   11      3    3    3    3    3    4    4    6    7    8    9    9   10   12   13   14   16   16   17   19 
LCS_GDT     M    32_A     M    32_A      3    3   11      3    3    3    3    3    4    4    6    7    8    9    9   10   12   13   14   14   15   16   19 
LCS_GDT     M    33_A     M    33_A      3    3   11      3    3    3    3    3    4    5    7    7    8    9    9   10   12   13   14   14   15   16   17 
LCS_GDT     I    34_A     I    34_A      3    3   11      3    3    3    3    3    4    5    7    7    8    8    9   10   12   13   14   14   15   16   17 
LCS_GDT     D    35_A     D    35_A      3    3   13      3    3    3    3    4    4    5    7    7    8    8    9   10   12   13   14   14   15   18   18 
LCS_GDT     Q    36_A     Q    36_A      4    4   20      3    3    4    4    4    4    5    8   10   11   14   15   17   17   19   21   22   23   23   23 
LCS_GDT     N    37_A     N    37_A      4    4   21      3    3    4    4    4    5    6    8   10   14   16   16   17   19   21   22   22   24   24   24 
LCS_GDT     P    38_A     P    38_A      4    4   21      3    3    4    4    4    6    8   10   12   14   16   16   19   20   22   23   23   24   24   24 
LCS_GDT     Q    39_A     Q    39_A      4    4   21      3    3    4    4    5    6    7   10   12   14   16   16   19   20   22   23   23   24   24   24 
LCS_GDT     L    40_A     L    40_A      3    4   21      3    3    3    4    5    6    8   10   12   14   16   16   19   20   22   23   23   24   24   24 
LCS_GDT     R    41_A     R    41_A      3    5   21      3    3    3    4    5    6    8   10   12   14   16   16   19   20   22   23   23   24   24   24 
LCS_GDT     N    42_A     N    42_A      3    5   21      3    3    3    4    5    6    8   10   12   14   16   16   19   20   22   23   23   24   24   24 
LCS_GDT     M    43_A     M    43_A      3    5   21      3    3    3    4    5    6    7   10   12   14   16   16   19   20   22   23   23   24   24   24 
LCS_GDT     G    44_A     G    44_A      3    5   21      3    3    3    4    5    6    7   10   12   14   16   16   19   20   22   23   23   24   24   24 
LCS_GDT     P    45_A     P    45_A      3    5   21      3    3    3    4    5    6    8   10   12   14   16   16   19   20   22   23   23   24   24   24 
LCS_GDT     E    46_A     E    46_A      3    5   21      3    3    3    4    5    5    6    9   12   14   16   16   19   20   22   23   23   24   24   24 
LCS_GDT     A    47_A     A    47_A      3    5   21      3    3    3    4    5    6    8   10   12   14   16   16   19   20   22   23   23   24   24   24 
LCS_GDT     R    48_A     R    48_A      3    3   21      3    3    3    3    4    5    8   10   12   14   16   16   19   20   22   23   23   24   24   24 
LCS_GDT     Q    49_A     Q    49_A      3    4   21      3    3    3    4    5    6    7   10   12   14   16   16   19   20   22   23   23   24   24   24 
LCS_GDT     M    50_A     M    50_A      3    4   21      3    3    3    4    5    6    8   10   12   14   16   16   19   20   22   23   23   24   24   24 
LCS_GDT     L    51_A     L    51_A      3    4   21      3    3    3    3    4    4    6    8    9   11   15   16   19   20   22   23   23   24   24   24 
LCS_GDT     R    52_A     R    52_A      3    4   21      3    3    3    3    5    6    7   10   12   14   16   16   19   20   22   23   23   24   24   24 
LCS_GDT     P    53_A     P    53_A      3    4   21      3    3    3    3    4    6    7   10   11   14   16   16   19   25   28   30   52   55   59   65 
LCS_GDT     M    54_A     M    54_A      3    4   21      3    3    3    3    4    5    5    8    9    9   14   16   18   20   21   23   33   38   40   44 
LCS_GDT     F    55_A     F    55_A      3    4   21      3    3    3    3    4    5    5    8    9   11   14   16   19   20   22   23   23   24   24   26 
LCS_GDT     R    56_A     R    56_A      3    4   21      3    3    3    3    4    5    5    8    9   10   14   16   19   20   22   30   33   38   40   65 
LCS_GDT     E    57_A     E    57_A      3    4   21      3    3    3    3    4    5    6   10   17   21   25   27   31   35   46   53   57   63   68   74 
LCS_GDT     M    58_A     M    58_A      3    4   19      3    3    3    3    4    5    6    8    9   10   13   18   19   25   38   44   57   63   68   74 
LCS_GDT     M    59_A     M    59_A      3    4   13      3    3    3    3    4    4    6    8    8   10   12   26   31   35   38   44   52   63   68   77 
LCS_GDT     S    60_A     S    60_A      4    6  141      3    4    4    4    5    6    7   10   19   30   39   54   60   71   82   89  101  111  119  130 
LCS_GDT     N    61_A     N    61_A      4    6  143      3    4    4    4    5    6   20   29   41   51   69   75   82   94  110  119  127  131  135  136 
LCS_GDT     P    62_A     P    62_A      4    6  143      3    4    4    6    8   13   23   30   39   49   62   72   81   93  103  114  123  130  133  136 
LCS_GDT     E    63_A     E    63_A      4    6  143      3    4    4    4    5    6    7    7    9   26   50   66  108  121  126  129  134  135  136  137 
LCS_GDT     S    64_A     S    64_A      3    6  143      3    3    4    4    9   22   38   56   74   88  100  111  119  124  127  129  134  135  136  137 
LCS_GDT     M    65_A     M    65_A      3    6  143      3    3    4    4    5    6    9   22   52   79   95  108  117  124  130  132  134  135  136  137 
LCS_GDT     R    66_A     R    66_A      3    3  143      3    3    4    4    4    6    8   13   33   40   68   87  109  124  130  132  134  135  136  137 
LCS_GDT     S    67_A     S    67_A      3    3  143      1    3    4    4    5    7   22   26   33   40  122  127  129  130  131  132  134  135  136  137 
LCS_GDT     M    68_A     M    68_A      3    3  143      0    3    3    3    4    7   22   26   33   40   49   57  101  128  131  132  134  135  136  137 
LCS_GDT     M    69_A     M    69_A      3    4  143      3    3    3    3    5    7    8    9   12   15   20   28   33   70   94  101  129  134  134  137 
LCS_GDT     N    70_A     N    70_A      3    4  143      3    3    3    3    4    7    8    9   12   13   16   20   25   30   36   90  104  117  122  135 
LCS_GDT     M    71_A     M    71_A      3    4  143      3    3    3    3    4   10   12   19   56   73  119  127  129  130  131  132  133  134  136  137 
LCS_GDT     G    72_A     G    72_A      3  129  143      3    3    3    3    4    7   38   43   52   60   93  122  129  130  131  132  134  135  136  137 
LCS_GDT     R    73_A     R    73_A      3  129  143      3    3    3    4    4   29   38   43   52   60   68  108  127  130  131  132  134  135  136  137 
LCS_GDT     A    74_A     A    74_A      3  129  143      3    3    3   12   22   28   65  120  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     W    75_A     W    75_A    126  129  143      4   25   65  117  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     G    76_A     G    76_A    126  129  143      3   24   65  117  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     S    77_A     S    77_A    126  129  143     29  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     K    78_A     K    78_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     K    79_A     K    79_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     I    80_A     I    80_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     L    81_A     L    81_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     I    82_A     I    82_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     V    83_A     V    83_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     E    84_A     E    84_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     S    85_A     S    85_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     D    86_A     D    86_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     T    87_A     T    87_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     A    88_A     A    88_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     L    89_A     L    89_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     S    90_A     S    90_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     A    91_A     A    91_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     T    92_A     T    92_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     L    93_A     L    93_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     R    94_A     R    94_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     S    95_A     S    95_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     A    96_A     A    96_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     L    97_A     L    97_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     E    98_A     E    98_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     G    99_A     G    99_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     R   100_A     R   100_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     G   101_A     G   101_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     F   102_A     F   102_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     T   103_A     T   103_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     V   104_A     V   104_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     D   105_A     D   105_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     E   106_A     E   106_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     T   107_A     T   107_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     T   108_A     T   108_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     D   109_A     D   109_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     G   110_A     G   110_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     K   111_A     K   111_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     G   112_A     G   112_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     S   113_A     S   113_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     V   114_A     V   114_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     E   115_A     E   115_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     Q   116_A     Q   116_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     I   117_A     I   117_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     R   118_A     R   118_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     R   119_A     R   119_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     D   120_A     D   120_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     R   121_A     R   121_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     P   122_A     P   122_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     D   123_A     D   123_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     L   124_A     L   124_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     V   125_A     V   125_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     V   126_A     V   126_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     L   127_A     L   127_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     A   128_A     A   128_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     V   129_A     V   129_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     D   130_A     D   130_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     L   131_A     L   131_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     S   132_A     S   132_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     A   133_A     A   133_A    126  129  143     22   82  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     G   134_A     G   134_A    126  129  143     22   63  117  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     Q   135_A     Q   135_A    126  129  143     20  108  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     N   136_A     N   136_A    126  129  143      4  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     G   137_A     G   137_A    126  129  143     61  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     Y   138_A     Y   138_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     L   139_A     L   139_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     I   140_A     I   140_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     C   141_A     C   141_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     G   142_A     G   142_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     K   143_A     K   143_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     L   144_A     L   144_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     K   145_A     K   145_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     K   146_A     K   146_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     D   147_A     D   147_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     D   148_A     D   148_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     D   149_A     D   149_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     L   150_A     L   150_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     K   151_A     K   151_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     N   152_A     N   152_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     V   153_A     V   153_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     P   154_A     P   154_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     I   155_A     I   155_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     V   156_A     V   156_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     I   157_A     I   157_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     I   158_A     I   158_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     G   159_A     G   159_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     N   160_A     N   160_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     P   161_A     P   161_A    126  129  143     96  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     D   162_A     D   162_A    126  129  143     96  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     G   163_A     G   163_A    126  129  143     10  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     F   164_A     F   164_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     A   165_A     A   165_A    126  129  143     69  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     Q   166_A     Q   166_A    126  129  143     69  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     H   167_A     H   167_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     R   168_A     R   168_A    126  129  143     99  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     K   169_A     K   169_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     L   170_A     L   170_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     K   171_A     K   171_A    126  129  143     71  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     A   172_A     A   172_A    126  129  143      4  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     H   173_A     H   173_A    126  129  143     73  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     A   174_A     A   174_A    126  129  143     99  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     D   175_A     D   175_A    126  129  143     99  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     E   176_A     E   176_A    126  129  143     95  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     Y   177_A     Y   177_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     V   178_A     V   178_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     A   179_A     A   179_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     K   180_A     K   180_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     P   181_A     P   181_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     V   182_A     V   182_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     D   183_A     D   183_A    126  129  143     89  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     A   184_A     A   184_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     D   185_A     D   185_A    126  129  143     98  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     Q   186_A     Q   186_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     L   187_A     L   187_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     V   188_A     V   188_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     E   189_A     E   189_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     R   190_A     R   190_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     A   191_A     A   191_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     G   192_A     G   192_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     A   193_A     A   193_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     L   194_A     L   194_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     I   195_A     I   195_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     G   196_A     G   196_A    126  129  143     30  114  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     F   197_A     F   197_A    126  129  143    100  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     P   198_A     P   198_A    126  129  143     72  117  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     E   199_A     E   199_A    126  129  143     29  112  122  123  125  125  126  126  126  126  127  127  129  130  131  132  134  135  136  137 
LCS_GDT     G   200_A     G   200_A    126  129  143      3    3    4  108  123  124  126  126  126  126  127  127  127  128  131  132  133  135  136  137 
LCS_GDT     N   201_A     N   201_A      3  129  143      3    3    4    5    8    8   11   61   85  118  124  125  127  128  129  129  132  133  133  136 
LCS_GDT     S   202_A     S   202_A      3  129  143      3    3    4    4    8    8   21   29   70   94  120  125  126  128  129  129  132  133  133  136 
LCS_GDT     M   203_A     M   203_A      3  129  143      3    6   10   19   33   43   63   79   99  114  118  125  126  128  129  129  132  133  133  136 
LCS_GDT     M   204_A     M   204_A      3    3  143      3    3    4    5    5    6   10   13   19   42   60   72   88  111  118  125  129  133  133  136 
LCS_GDT     I   205_A     I   205_A      3    3  142      1    3    3    4    4    6    7   10   11   15   23   32   39   47   89  105  124  130  133  136 
LCS_GDT     A   206_A     A   206_A      4    4  140      3    3    4    5    5    6    6    6   17   32   44   58   74   87  102  117  124  131  133  136 
LCS_GDT     L   207_A     L   207_A      4    4  138      3    3    4    4    4    4    5    6    7    9    9   11   17   19   25   29   42   50   66   78 
LCS_GDT     G   208_A     G   208_A      4    4  136      3    3    4    4    4    4    5    6    7    9   12   16   20   24   28   32   41   46   53   73 
LCS_GDT     V   209_A     V   209_A      4    4  135      0    3    4    5    5    6    6   15   23   32   38   53   63   72   85   99  113  125  131  135 
LCS_GDT     A   210_A     A   210_A      3    4   11      0    3    4    5    5    6    6    6    9   32   38   53   65   72   87  100  115  125  132  135 
LCS_GDT     C   211_A     C   211_A      3    3   11      0    3    3    5    5    7   11   15   26   32   44   53   63   72   86   98  111  123  131  135 
LCS_GDT     A   212_A     A   212_A      3    3   10      3    3    3    4    5    7   20   30   41   47   60   71   78   94  104  117  124  131  132  136 
LCS_GDT     I   213_A     I   213_A      3    3   10      3    3    7   13   22   29   40   50   64   83  100  111  120  126  127  129  132  133  133  136 
LCS_GDT     A   214_A     A   214_A      3    3   10      3    3    7   14   22   29   40   50   64   82   99  108  118  123  127  129  132  133  133  136 
LCS_GDT     L   215_A     L   215_A      3    3   10      0    3    5    7   16   24   37   48   61   72   86   98  110  119  123  129  132  133  133  136 
LCS_GDT     A   216_A     A   216_A      3    3   10      1    3    3    3    7    7   10   27   48   61   78   90  103  117  123  129  132  133  133  136 
LCS_GDT     I   217_A     I   217_A      3    3    9      3    3    3    3    4    6    7   13   36   49   58   82   98  112  123  129  132  133  133  136 
LCS_GDT     A   218_A     A   218_A      3    3    9      3    3    3    3    3    5    5    6    7   11   57   69   96  110  123  129  132  133  133  136 
LCS_GDT     A   219_A     A   219_A      3    4    9      3    3    3    3    4    4    4    5   16   19   24   27   32   53   56   63   76   85  111  119 
LCS_GDT     V   220_A     V   220_A      3    4    9      3    3    3    3    4    4    4    8    8   12   14   19   21   27   29   35   37   41   47   84 
LCS_GDT     Y   221_A     Y   221_A      3    4    9      3    3    3    3    4    4    4    5    6    7    7   17   18   20   21   24   26   27   43   44 
LCS_GDT     F   222_A     F   222_A      3    4    8      3    3    3    3    4    5    7    8    8   12   14   17   22   25   27   29   31   36   43   44 
LCS_AVERAGE  LCS_A:  37.90  (  32.84   35.30   45.57 )

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    100    117    122    123    125    125    126    126    126    126    127    127    129    130    131    132    134    135    136    137 
GDT PERCENT_AT  45.05  52.70  54.95  55.41  56.31  56.31  56.76  56.76  56.76  56.76  57.21  57.21  58.11  58.56  59.01  59.46  60.36  60.81  61.26  61.71
GDT RMS_LOCAL    0.28   0.39   0.51   0.55   0.77   0.77   0.85   0.85   0.85   0.85   1.12   1.12   2.08   2.32   2.57   2.60   3.54   3.56   3.64   3.80
GDT RMS_ALL_AT  51.92  51.89  51.78  51.74  51.52  51.52  51.48  51.48  51.48  51.48  51.41  51.41  50.72  50.53  50.22  50.22  48.41  48.45  48.48  48.40

# Checking swapping
#   possible swapping detected:  E     5_A      E     5_A
#   possible swapping detected:  E     8_A      E     8_A
#   possible swapping detected:  E    18_A      E    18_A
#   possible swapping detected:  D    26_A      D    26_A
#   possible swapping detected:  D    35_A      D    35_A
#   possible swapping detected:  E    57_A      E    57_A
#   possible swapping detected:  E    63_A      E    63_A
#   possible swapping detected:  D    86_A      D    86_A
#   possible swapping detected:  F   102_A      F   102_A
#   possible swapping detected:  D   105_A      D   105_A
#   possible swapping detected:  E   115_A      E   115_A
#   possible swapping detected:  D   147_A      D   147_A
#   possible swapping detected:  D   149_A      D   149_A
#   possible swapping detected:  E   176_A      E   176_A
#   possible swapping detected:  Y   177_A      Y   177_A
#   possible swapping detected:  D   183_A      D   183_A
#   possible swapping detected:  D   185_A      D   185_A
#   possible swapping detected:  Y   221_A      Y   221_A
#   possible swapping detected:  F   222_A      F   222_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    G     1_A      G     1_A   117.920     0    0.104   0.104   122.003    0.000    0.000
LGA    P     2_A      P     2_A   121.690     0    0.611   0.550   123.063    0.000    0.000
LGA    H     3_A      H     3_A   125.099     0    0.252   1.202   128.606    0.000    0.000
LGA    M     4_A      M     4_A   125.577     0    0.669   1.102   129.028    0.000    0.000
LGA    E     5_A      E     5_A   124.472     0    0.602   1.387   127.613    0.000    0.000
LGA    Q     6_A      Q     6_A   130.015     0    0.629   0.799   138.769    0.000    0.000
LGA    L     7_A      L     7_A   128.073     0    0.633   0.926   129.394    0.000    0.000
LGA    E     8_A      E     8_A   125.247     0    0.640   1.562   125.650    0.000    0.000
LGA    G     9_A      G     9_A   126.717     0    0.575   0.575   128.322    0.000    0.000
LGA    I    10_A      I    10_A   128.393     0    0.602   0.845   132.607    0.000    0.000
LGA    M    11_A      M    11_A   122.513     0    0.658   1.050   124.677    0.000    0.000
LGA    L    12_A      L    12_A   120.502     0    0.678   0.844   121.015    0.000    0.000
LGA    S    13_A      S    13_A   123.201     0    0.057   0.106   125.506    0.000    0.000
LGA    P    14_A      P    14_A   121.167     0    0.143   0.321   122.273    0.000    0.000
LGA    A    15_A      A    15_A   124.999     0    0.613   0.593   127.244    0.000    0.000
LGA    F    16_A      F    16_A   121.650     0    0.620   0.636   122.448    0.000    0.000
LGA    Q    17_A      Q    17_A   120.870     0    0.618   1.005   121.004    0.000    0.000
LGA    E    18_A      E    18_A   122.259     0    0.630   1.366   125.233    0.000    0.000
LGA    Q    19_A      Q    19_A   124.404     0    0.630   1.148   129.409    0.000    0.000
LGA    M    20_A      M    20_A   119.355     0    0.650   1.058   121.201    0.000    0.000
LGA    N    21_A      N    21_A   119.914     0    0.596   0.962   121.355    0.000    0.000
LGA    A    22_A      A    22_A   121.341     0    0.619   0.604   122.543    0.000    0.000
LGA    L    23_A      L    23_A   120.969     0    0.651   1.396   124.862    0.000    0.000
LGA    M    24_A      M    24_A   115.558     0    0.660   1.268   117.448    0.000    0.000
LGA    L    25_A      L    25_A   117.531     0    0.629   1.272   124.177    0.000    0.000
LGA    D    26_A      D    26_A   116.537     0    0.126   1.008   117.482    0.000    0.000
LGA    P    27_A      P    27_A   113.722     0    0.743   0.599   115.085    0.000    0.000
LGA    R    28_A      R    28_A   113.394     0    0.603   1.100   117.859    0.000    0.000
LGA    M    29_A      M    29_A   110.933     0    0.576   1.236   115.474    0.000    0.000
LGA    L    30_A      L    30_A   103.494     0    0.645   0.633   106.101    0.000    0.000
LGA    D    31_A      D    31_A   100.937     0    0.628   0.746   101.978    0.000    0.000
LGA    M    32_A      M    32_A   100.115     0    0.603   1.098   101.993    0.000    0.000
LGA    M    33_A      M    33_A    96.415     0    0.634   1.125    97.602    0.000    0.000
LGA    I    34_A      I    34_A    89.203     0    0.601   1.208    91.850    0.000    0.000
LGA    D    35_A      D    35_A    89.204     0    0.660   1.201    92.125    0.000    0.000
LGA    Q    36_A      Q    36_A    87.478     0    0.668   1.284    88.792    0.000    0.000
LGA    N    37_A      N    37_A    82.394     0    0.170   1.087    84.027    0.000    0.000
LGA    P    38_A      P    38_A    78.803     0    0.641   0.662    82.572    0.000    0.000
LGA    Q    39_A      Q    39_A    71.685     0    0.699   1.367    74.326    0.000    0.000
LGA    L    40_A      L    40_A    69.316     0    0.700   0.990    70.536    0.000    0.000
LGA    R    41_A      R    41_A    69.426     0    0.685   1.582    75.908    0.000    0.000
LGA    N    42_A      N    42_A    64.114     0    0.707   1.243    65.689    0.000    0.000
LGA    M    43_A      M    43_A    62.567     0    0.174   0.964    66.124    0.000    0.000
LGA    G    44_A      G    44_A    59.597     0    0.162   0.162    60.661    0.000    0.000
LGA    P    45_A      P    45_A    57.607     0    0.658   0.578    58.034    0.000    0.000
LGA    E    46_A      E    46_A    54.265     0    0.616   1.221    56.428    0.000    0.000
LGA    A    47_A      A    47_A    52.548     0    0.633   0.610    53.564    0.000    0.000
LGA    R    48_A      R    48_A    53.125     0    0.641   1.195    53.839    0.000    0.000
LGA    Q    49_A      Q    49_A    52.218     0    0.680   0.817    52.339    0.000    0.000
LGA    M    50_A      M    50_A    47.050     0    0.689   0.976    49.056    0.000    0.000
LGA    L    51_A      L    51_A    48.704     0    0.616   0.701    49.423    0.000    0.000
LGA    R    52_A      R    52_A    52.211     0    0.593   1.233    63.239    0.000    0.000
LGA    P    53_A      P    53_A    47.566     0    0.636   0.691    49.254    0.000    0.000
LGA    M    54_A      M    54_A    46.944     0    0.670   1.544    47.818    0.000    0.000
LGA    F    55_A      F    55_A    51.188     0    0.620   1.454    58.760    0.000    0.000
LGA    R    56_A      R    56_A    49.079     0    0.594   0.976    49.834    0.000    0.000
LGA    E    57_A      E    57_A    43.227     0    0.629   0.748    45.334    0.000    0.000
LGA    M    58_A      M    58_A    40.237     0    0.628   0.808    44.659    0.000    0.000
LGA    M    59_A      M    59_A    39.436     0    0.685   1.309    40.702    0.000    0.000
LGA    S    60_A      S    60_A    34.703     0    0.667   0.755    36.436    0.000    0.000
LGA    N    61_A      N    61_A    28.413     0    0.186   1.359    30.443    0.000    0.000
LGA    P    62_A      P    62_A    27.568     0    0.517   0.469    29.804    0.000    0.000
LGA    E    63_A      E    63_A    20.559     0    0.613   1.065    23.114    0.000    0.000
LGA    S    64_A      S    64_A    19.688     0    0.566   0.574    22.871    0.000    0.000
LGA    M    65_A      M    65_A    18.870     0    0.617   0.610    19.467    0.000    0.000
LGA    R    66_A      R    66_A    18.631     0    0.624   1.002    26.706    0.000    0.000
LGA    S    67_A      S    67_A    13.451     0    0.612   0.981    15.193    0.000    0.079
LGA    M    68_A      M    68_A    15.632     0    0.626   1.291    18.464    0.000    0.000
LGA    M    69_A      M    69_A    17.433     0    0.638   0.619    18.578    0.000    0.000
LGA    N    70_A      N    70_A    18.118     0    0.583   0.544    23.274    0.000    0.000
LGA    M    71_A      M    71_A    12.028     0    0.585   1.447    14.136    0.000    4.464
LGA    G    72_A      G    72_A    13.526     0    0.588   0.588    13.526    0.000    0.000
LGA    R    73_A      R    73_A    13.861     0    0.058   1.013    22.605    0.000    0.000
LGA    A    74_A      A    74_A     8.499     0    0.655   0.618    10.345    8.810    9.048
LGA    W    75_A      W    75_A     4.424     0    0.702   0.896     9.880   37.976   17.313
LGA    G    76_A      G    76_A     3.984     0    0.455   0.455     4.370   41.905   41.905
LGA    S    77_A      S    77_A     1.197     0    0.094   0.160     2.241   79.524   80.159
LGA    K    78_A      K    78_A     0.719     0    0.070   0.784     3.904   97.619   77.249
LGA    K    79_A      K    79_A     0.344     0    0.027   1.232     3.824  100.000   80.952
LGA    I    80_A      I    80_A     0.158     0    0.035   0.617     1.693  100.000   95.417
LGA    L    81_A      L    81_A     0.234     0    0.040   0.955     2.308  100.000   91.012
LGA    I    82_A      I    82_A     0.177     0    0.032   0.566     1.862  100.000   96.607
LGA    V    83_A      V    83_A     0.202     0    0.027   0.068     0.215  100.000  100.000
LGA    E    84_A      E    84_A     0.241     0    0.028   0.171     0.702  100.000   98.942
LGA    S    85_A      S    85_A     0.335     0    0.039   0.038     0.495  100.000  100.000
LGA    D    86_A      D    86_A     0.574     0    0.094   0.805     2.913   97.619   86.548
LGA    T    87_A      T    87_A     0.299     0    0.035   0.181     0.797  100.000   98.639
LGA    A    88_A      A    88_A     0.164     0    0.043   0.044     0.370  100.000  100.000
LGA    L    89_A      L    89_A     0.176     0    0.029   0.116     0.573  100.000   98.810
LGA    S    90_A      S    90_A     0.088     0    0.027   0.555     1.979  100.000   95.476
LGA    A    91_A      A    91_A     0.217     0    0.030   0.038     0.398  100.000  100.000
LGA    T    92_A      T    92_A     0.267     0    0.042   0.143     0.632  100.000   98.639
LGA    L    93_A      L    93_A     0.233     0    0.043   0.052     0.299  100.000  100.000
LGA    R    94_A      R    94_A     0.281     0    0.030   0.840     2.906  100.000   90.130
LGA    S    95_A      S    95_A     0.460     0    0.053   0.089     0.956  100.000   96.825
LGA    A    96_A      A    96_A     0.387     0    0.024   0.042     0.442  100.000  100.000
LGA    L    97_A      L    97_A     0.292     0    0.033   0.770     1.705  100.000   92.024
LGA    E    98_A      E    98_A     0.320     0    0.031   0.142     0.899  100.000   95.767
LGA    G    99_A      G    99_A     0.343     0    0.101   0.101     0.750   97.619   97.619
LGA    R   100_A      R   100_A     0.327     0    0.104   0.448     1.714  100.000   91.645
LGA    G   101_A      G   101_A     0.173     0    0.036   0.036     0.268  100.000  100.000
LGA    F   102_A      F   102_A     0.385     0    0.040   0.221     0.679  100.000   96.537
LGA    T   103_A      T   103_A     0.305     0    0.074   0.080     0.474  100.000  100.000
LGA    V   104_A      V   104_A     0.250     0    0.057   0.077     0.596  100.000   97.279
LGA    D   105_A      D   105_A     0.240     0    0.047   0.825     3.280  100.000   84.940
LGA    E   106_A      E   106_A     0.278     0    0.029   0.583     1.526  100.000   92.751
LGA    T   107_A      T   107_A     0.424     0    0.041   1.031     2.578  100.000   88.844
LGA    T   108_A      T   108_A     0.415     0    0.054   0.935     2.278  100.000   91.088
LGA    D   109_A      D   109_A     0.285     0    0.048   0.110     0.539  100.000   98.810
LGA    G   110_A      G   110_A     0.331     0    0.027   0.027     0.387  100.000  100.000
LGA    K   111_A      K   111_A     0.500     0    0.034   1.033     3.655  100.000   83.598
LGA    G   112_A      G   112_A     0.533     0    0.097   0.097     0.533   97.619   97.619
LGA    S   113_A      S   113_A     0.264     0    0.043   0.583     2.148  100.000   94.127
LGA    V   114_A      V   114_A     0.407     0    0.024   0.910     2.628  100.000   88.639
LGA    E   115_A      E   115_A     0.396     0    0.041   0.722     2.909  100.000   79.894
LGA    Q   116_A      Q   116_A     0.436     0    0.027   1.068     2.799  100.000   89.048
LGA    I   117_A      I   117_A     0.361     0    0.033   0.110     0.528  100.000   98.810
LGA    R   118_A      R   118_A     0.317     0    0.024   0.984     2.770  100.000   90.130
LGA    R   119_A      R   119_A     0.493     0    0.042   1.119     2.603   97.619   88.485
LGA    D   120_A      D   120_A     0.431     0    0.063   0.250     1.433  100.000   94.107
LGA    R   121_A      R   121_A     0.367     0    0.075   1.010     3.228  100.000   86.234
LGA    P   122_A      P   122_A     0.315     0    0.049   0.312     0.815  100.000   98.639
LGA    D   123_A      D   123_A     0.249     0    0.074   0.161     0.910  100.000   97.619
LGA    L   124_A      L   124_A     0.183     0    0.035   0.492     1.391  100.000   96.488
LGA    V   125_A      V   125_A     0.122     0    0.022   0.065     0.196  100.000  100.000
LGA    V   126_A      V   126_A     0.134     0    0.049   0.081     0.270  100.000  100.000
LGA    L   127_A      L   127_A     0.085     0    0.036   0.136     0.456  100.000  100.000
LGA    A   128_A      A   128_A     0.315     0    0.021   0.036     0.412  100.000  100.000
LGA    V   129_A      V   129_A     0.447     0    0.026   0.139     0.807  100.000   95.918
LGA    D   130_A      D   130_A     0.205     0    0.151   1.207     4.353   97.619   79.345
LGA    L   131_A      L   131_A     0.448     0    0.066   0.279     0.937   97.619   94.048
LGA    S   132_A      S   132_A     0.314     0    0.347   0.465     3.479   82.857   80.952
LGA    A   133_A      A   133_A     1.605     0    0.207   0.202     2.422   75.238   73.143
LGA    G   134_A      G   134_A     2.166     0    0.042   0.042     2.206   68.810   68.810
LGA    Q   135_A      Q   135_A     1.271     0    0.069   0.870     3.782   83.810   75.450
LGA    N   136_A      N   136_A     1.061     0    0.035   1.064     3.955   85.952   71.131
LGA    G   137_A      G   137_A     0.896     0    0.031   0.031     1.059   88.214   88.214
LGA    Y   138_A      Y   138_A     0.696     0    0.053   0.227     1.250   90.476   86.706
LGA    L   139_A      L   139_A     0.759     0    0.052   1.032     4.863   90.476   72.976
LGA    I   140_A      I   140_A     0.668     0    0.035   0.613     2.364   90.476   87.262
LGA    C   141_A      C   141_A     0.573     0    0.049   0.053     0.640   90.476   90.476
LGA    G   142_A      G   142_A     0.578     0    0.047   0.047     0.631   90.476   90.476
LGA    K   143_A      K   143_A     0.655     0    0.034   0.847     4.912   90.476   70.476
LGA    L   144_A      L   144_A     0.418     0    0.026   0.171     0.789  100.000   98.810
LGA    K   145_A      K   145_A     0.319     0    0.082   0.139     0.869   95.238   93.651
LGA    K   146_A      K   146_A     0.595     0    0.138   1.011     3.065   92.857   77.725
LGA    D   147_A      D   147_A     0.619     0    0.018   0.454     1.526   92.857   88.333
LGA    D   148_A      D   148_A     0.555     0    0.051   0.789     2.597   90.476   84.048
LGA    D   149_A      D   149_A     0.716     0    0.015   0.331     1.860   90.476   86.012
LGA    L   150_A      L   150_A     0.171     0    0.090   1.150     2.463  100.000   90.000
LGA    K   151_A      K   151_A     0.288     0    0.068   0.761     4.244   97.619   82.540
LGA    N   152_A      N   152_A     0.360     0    0.148   0.780     2.882   97.619   87.619
LGA    V   153_A      V   153_A     0.334     0    0.031   0.058     0.730  100.000   95.918
LGA    P   154_A      P   154_A     0.188     0    0.045   0.081     0.285  100.000  100.000
LGA    I   155_A      I   155_A     0.243     0    0.018   0.175     0.615  100.000   98.810
LGA    V   156_A      V   156_A     0.115     0    0.030   0.058     0.257  100.000  100.000
LGA    I   157_A      I   157_A     0.108     0    0.030   0.671     2.087  100.000   94.405
LGA    I   158_A      I   158_A     0.219     0    0.047   0.136     0.853  100.000   97.619
LGA    G   159_A      G   159_A     0.381     0    0.032   0.032     0.381  100.000  100.000
LGA    N   160_A      N   160_A     0.316     0    0.043   0.307     1.363   97.619   95.298
LGA    P   161_A      P   161_A     0.396     0    0.087   0.107     0.525  100.000   98.639
LGA    D   162_A      D   162_A     0.329     0    0.065   1.047     4.520  100.000   77.798
LGA    G   163_A      G   163_A     0.872     0    0.149   0.149     0.872   92.857   92.857
LGA    F   164_A      F   164_A     0.247     0    0.047   0.331     0.792  100.000   96.537
LGA    A   165_A      A   165_A     0.870     0    0.022   0.036     1.149   90.476   88.667
LGA    Q   166_A      Q   166_A     0.813     0    0.047   1.197     3.076   95.238   80.370
LGA    H   167_A      H   167_A     0.327     0    0.030   0.112     0.963  100.000   95.238
LGA    R   168_A      R   168_A     0.377     0    0.022   1.046     4.138  100.000   82.641
LGA    K   169_A      K   169_A     0.480     0    0.124   0.679     1.360   97.619   89.630
LGA    L   170_A      L   170_A     0.338     0    0.021   1.036     2.668  100.000   90.238
LGA    K   171_A      K   171_A     0.827     0    0.046   1.016     3.871   88.214   75.767
LGA    A   172_A      A   172_A     0.900     0    0.498   0.454     2.316   84.048   81.810
LGA    H   173_A      H   173_A     0.810     0    0.078   0.163     0.909   90.476   92.381
LGA    A   174_A      A   174_A     0.452     0    0.030   0.042     0.639   92.857   94.286
LGA    D   175_A      D   175_A     0.593     0    0.069   0.277     0.972   90.476   90.476
LGA    E   176_A      E   176_A     0.618     0    0.034   0.631     1.748   90.476   86.561
LGA    Y   177_A      Y   177_A     0.329     0    0.021   0.105     0.790  100.000   96.032
LGA    V   178_A      V   178_A     0.285     0    0.068   0.872     2.469  100.000   91.088
LGA    A   179_A      A   179_A     0.321     0    0.023   0.035     0.424  100.000  100.000
LGA    K   180_A      K   180_A     0.340     0    0.070   0.620     1.220  100.000   93.757
LGA    P   181_A      P   181_A     0.591     0    0.071   0.423     2.206   92.857   86.871
LGA    V   182_A      V   182_A     0.502     0    0.040   1.157     2.807   95.238   84.762
LGA    D   183_A      D   183_A     0.893     0    0.069   0.674     3.422   90.476   75.833
LGA    A   184_A      A   184_A     0.541     0    0.050   0.057     0.681   92.857   92.381
LGA    D   185_A      D   185_A     0.843     0    0.042   0.543     2.012   90.476   82.798
LGA    Q   186_A      Q   186_A     0.691     0    0.031   0.953     4.814   95.238   77.037
LGA    L   187_A      L   187_A     0.289     0    0.031   0.061     0.341  100.000  100.000
LGA    V   188_A      V   188_A     0.362     0    0.036   0.189     0.585  100.000   97.279
LGA    E   189_A      E   189_A     0.460     0    0.038   0.933     4.781  100.000   79.153
LGA    R   190_A      R   190_A     0.324     0    0.036   0.288     1.475  100.000   93.983
LGA    A   191_A      A   191_A     0.279     0    0.028   0.039     0.360  100.000  100.000
LGA    G   192_A      G   192_A     0.293     0    0.081   0.081     0.560   97.619   97.619
LGA    A   193_A      A   193_A     0.345     0    0.026   0.038     0.367  100.000  100.000
LGA    L   194_A      L   194_A     0.303     0    0.016   0.820     2.055  100.000   92.202
LGA    I   195_A      I   195_A     0.436     0    0.603   1.291     2.725   86.905   82.143
LGA    G   196_A      G   196_A     1.432     0    0.089   0.089     1.742   83.810   83.810
LGA    F   197_A      F   197_A     0.298     0    0.070   0.233     1.189   95.238   91.472
LGA    P   198_A      P   198_A     0.616     0    0.051   0.156     1.420   90.595   90.544
LGA    E   199_A      E   199_A     1.634     0    0.647   0.894     9.932   73.214   40.847
LGA    G   200_A      G   200_A     3.918     0    0.631   0.631     6.118   36.667   36.667
LGA    N   201_A      N   201_A     9.454     0    0.630   1.292    11.705    2.143    1.131
LGA    S   202_A      S   202_A    10.909     0    0.639   0.964    11.286    0.000    0.000
LGA    M   203_A      M   203_A    13.458     0    0.648   1.091    16.836    0.000    0.000
LGA    M   204_A      M   204_A    19.178     0    0.625   1.364    22.575    0.000    0.000
LGA    I   205_A      I   205_A    22.566     0    0.616   0.853    24.272    0.000    0.000
LGA    A   206_A      A   206_A    23.034     0    0.621   0.610    25.409    0.000    0.000
LGA    L   207_A      L   207_A    29.239     0    0.637   0.560    35.510    0.000    0.000
LGA    G   208_A      G   208_A    31.032     0    0.614   0.614    31.032    0.000    0.000
LGA    V   209_A      V   209_A    26.331     0    0.614   1.457    28.328    0.000    0.000
LGA    A   210_A      A   210_A    25.857     0    0.627   0.614    25.944    0.000    0.000
LGA    C   211_A      C   211_A    26.673     0    0.624   0.825    28.690    0.000    0.000
LGA    A   212_A      A   212_A    26.162     0    0.628   0.612    26.807    0.000    0.000
LGA    I   213_A      I   213_A    21.052     0    0.605   0.690    23.488    0.000    0.000
LGA    A   214_A      A   214_A    22.386     0    0.617   0.608    22.689    0.000    0.000
LGA    L   215_A      L   215_A    23.831     0    0.640   1.326    26.764    0.000    0.000
LGA    A   216_A      A   216_A    24.149     0    0.634   0.616    24.149    0.000    0.000
LGA    I   217_A      I   217_A    23.337     0    0.594   0.895    25.691    0.000    0.000
LGA    A   218_A      A   218_A    23.677     0    0.613   0.604    26.855    0.000    0.000
LGA    A   219_A      A   219_A    30.361     0    0.633   0.609    32.087    0.000    0.000
LGA    V   220_A      V   220_A    32.102     0    0.700   0.772    34.943    0.000    0.000
LGA    Y   221_A      Y   221_A    33.056     0    0.681   0.922    39.464    0.000    0.000
LGA    F   222_A      F   222_A    34.911     0    0.701   1.254    38.273    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      222     888    888  100.00    1696   1696  100.00               222
SUMMARY(RMSD_GDC):    36.503         36.435                 37.056           53.919   50.660

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  222  222    4.0    126    0.85    56.081    51.109    13.314

LGA_LOCAL      RMSD:   0.846  Number of atoms:  126  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  51.476  Number of assigned atoms:  222 
Std_ASGN_ATOMS RMSD:  36.503  Standard rmsd on all 222 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.853122 * X  +   0.004819 * Y  +  -0.521690 * Z  +  16.147015
  Y_new =   0.043535 * X  +   0.995812 * Y  +   0.080391 * Z  +  18.001856
  Z_new =   0.519892 * X  +  -0.091295 * Y  +   0.849339 * Z  +  37.520966 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  0.050986 -0.546725 -0.107078   [DEG:    2.9213  -31.3250   -6.1351 ]
ZXZ: -1.723690  0.556064  1.744627   [DEG:  -98.7602   31.8601   99.9598 ]
 
# END of job
