
#######################################################
#                                                     #
#                        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  282 ( 2227),  selected  216 , name one
# Molecule2: number of CA atoms  216 ( 1714),  selected  216 , 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:   216      19_A - 267_A       1.88     1.88
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   216      19_A - 267_A       1.88     1.88
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    86      31_A - 116_A       0.98     2.06
  LONGEST_CONTINUOUS_SEGMENT:    86      32_A - 117_A       0.99     2.03
  LCS_AVERAGE:     24.32

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  216
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     Q    19_A     Q    19_A     40  216  216      4    7   60  161  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     E    20_A     E    20_A     40  216  216     18   63  118  162  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     L    21_A     L    21_A     40  216  216     18   82  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     P    22_A     P    22_A     40  216  216     10   39  137  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     A    23_A     A    23_A     40  216  216     14   34   89  132  178  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     Q    24_A     Q    24_A     40  216  216     11   38   92  155  184  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     V    25_A     V    25_A     40  216  216     14   79  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     K    26_A     K    26_A     40  216  216     12   39   92  165  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     G    27_A     G    27_A     40  216  216     11   30   89  132  184  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     L    28_A     L    28_A     74  216  216     11   56  115  164  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     A    29_A     A    29_A     82  216  216     11   81  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     A    30_A     A    30_A     82  216  216     12   39   92  164  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     H    31_A     H    31_A     86  216  216     12   42   92  155  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     I    32_A     I    32_A     86  216  216     18   73  136  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     N    33_A     N    33_A     86  216  216     16   76  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     L    34_A     L    34_A     86  216  216     14   56  136  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     S    35_A     S    35_A     86  216  216     15   56  124  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     L    36_A     L    36_A     86  216  216     18   82  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     S    37_A     S    37_A     86  216  216     20   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     Q    38_A     Q    38_A     86  216  216     18   89  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     D    39_A     D    39_A     86  216  216     18   89  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     L    40_A     L    40_A     86  216  216     25   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     A    41_A     A    41_A     86  216  216     21   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     I    42_A     I    42_A     86  216  216     18   89  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     S    43_A     S    43_A     86  216  216     18   93  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     E    44_A     E    44_A     86  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     S    45_A     S    45_A     86  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     L    46_A     L    46_A     86  216  216     18   93  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     A    47_A     A    47_A     86  216  216     24   93  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     N    48_A     N    48_A     86  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     S    49_A     S    49_A     86  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     Y    50_A     Y    50_A     86  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     F    51_A     F    51_A     86  216  216     23   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     I    52_A     I    52_A     86  216  216     36   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     E    53_A     E    53_A     86  216  216     23   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     Q    54_A     Q    54_A     86  216  216     23   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     W    55_A     W    55_A     86  216  216     14   93  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     V    56_A     V    56_A     86  216  216     12   92  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     R    57_A     R    57_A     86  216  216     12   78  137  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     E    58_A     E    58_A     86  216  216     11   74  137  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     G    59_A     G    59_A     86  216  216      5   77  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     L    60_A     L    60_A     86  216  216     13   84  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     P    61_A     P    61_A     86  216  216     20   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     E    62_A     E    62_A     86  216  216     16   75  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     E    63_A     E    63_A     86  216  216     28   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     R    64_A     R    64_A     86  216  216     28   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     Q    65_A     Q    65_A     86  216  216     28   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     N    66_A     N    66_A     86  216  216     35   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     D    67_A     D    67_A     86  216  216     35   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     I    68_A     I    68_A     86  216  216     39   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     A    69_A     A    69_A     86  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     A    70_A     A    70_A     86  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     Y    71_A     Y    71_A     86  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     L    72_A     L    72_A     86  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     A    73_A     A    73_A     86  216  216     34   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     R    74_A     R    74_A     86  216  216     26   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     L    75_A     L    75_A     86  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     M    76_A     M    76_A     86  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     E    77_A     E    77_A     86  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     Q    78_A     Q    78_A     86  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     L    79_A     L    79_A     86  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     D    80_A     D    80_A     86  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     T    81_A     T    81_A     86  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     E    82_A     E    82_A     86  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     L    83_A     L    83_A     86  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     L    84_A     L    84_A     86  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     F    85_A     F    85_A     86  216  216     35   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     I    86_A     I    86_A     86  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     A    87_A     A    87_A     86  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     A    88_A     A    88_A     86  216  216     23   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     Q    89_A     Q    89_A     86  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     H    90_A     H    90_A     86  216  216     35   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     Q    91_A     Q    91_A     86  216  216     33   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     G    92_A     G    92_A     86  216  216     33   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     R    93_A     R    93_A     86  216  216     35   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     G    94_A     G    94_A     86  216  216     30   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     Y    95_A     Y    95_A     86  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     Y    96_A     Y    96_A     86  216  216     35   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     F    97_A     F    97_A     86  216  216     33   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     Q    98_A     Q    98_A     86  216  216     33   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     L    99_A     L    99_A     86  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     R   100_A     R   100_A     86  216  216     23   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     N   101_A     N   101_A     86  216  216      7   61  131  166  187  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     G   102_A     G   102_A     86  216  216      7   46  127  165  187  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     E   103_A     E   103_A     86  216  216     28   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     F   104_A     F   104_A     86  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     L   105_A     L   105_A     86  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     Q   106_A     Q   106_A     86  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     R   107_A     R   107_A     86  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     I   108_A     I   108_A     86  216  216     35   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     I   109_A     I   109_A     86  216  216     28   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     Q   110_A     Q   110_A     86  216  216      6   84  139  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     P   111_A     P   111_A     86  216  216     23   89  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     P   112_A     P   112_A     86  216  216     13   75  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     G   113_A     G   113_A     86  216  216     13   85  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     S   114_A     S   114_A     86  216  216      9   72  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     E   115_A     E   115_A     86  216  216     11   87  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     D   116_A     D   116_A     86  216  216     11   84  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     D   117_A     D   117_A     86  216  216      4    9   35  141  187  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     W   118_A     W   118_A     85  216  216      8   35   71  110  187  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     Y   119_A     Y   119_A     85  216  216      7   39  127  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     Y   120_A     Y   120_A     85  216  216      8   59  134  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     H   121_A     H   121_A     84  216  216     10   61  134  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     F   122_A     F   122_A     74  216  216      7    9  114  165  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     T   123_A     T   123_A     74  216  216      7    9  117  163  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     D   124_A     D   124_A     74  216  216      7   58  134  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     S   125_A     S   125_A     74  216  216      8   57  134  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     D   126_A     D   126_A     74  216  216      9   92  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     N   127_A     N   127_A     74  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     A   128_A     A   128_A     74  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     Y   129_A     Y   129_A     74  216  216     36   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     E   130_A     E   130_A     74  216  216     27   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     L   131_A     L   131_A     74  216  216     21   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     N   132_A     N   132_A     13  216  216      7   38   83  151  187  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     L   133_A     L   133_A     13  216  216     12   54  129  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     D   134_A     D   134_A     13  216  216     13   71  129  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     S   135_A     S   135_A     13  216  216     13   71  125  166  187  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     D   136_A     D   136_A      4  216  216      6   23   40   55   78  148  205  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     T   137_A     T   137_A     16  216  216     10   54  116  159  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     F   138_A     F   138_A     16  216  216      3    4   25   36  125  169  192  211  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     S   139_A     S   139_A     16  216  216     10   41   87  145  178  199  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     P   140_A     P   140_A     16  216  216      8   40   81  124  167  188  203  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     D   141_A     D   141_A     16  216  216     12   40   81  124  169  190  203  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     D   142_A     D   142_A     16  216  216      8   41   83  138  176  191  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     A   143_A     A   143_A     16  216  216     12   41   85  145  178  199  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     F   144_A     F   144_A     16  216  216     13   71  131  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     V   145_A     V   145_A     16  216  216     13   78  137  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     Y   146_A     Y   146_A     22  216  216     13   83  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     V   147_A     V   147_A     28  216  216     17   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     N   148_A     N   148_A     28  216  216     21   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     Y   149_A     Y   149_A     28  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     R   150_A     R   150_A     28  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     S   151_A     S   151_A     28  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     T   152_A     T   152_A     28  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     V   153_A     V   153_A     28  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     N   154_A     N   154_A     28  216  216     12   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     A   155_A     A   155_A     28  216  216      8   89  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     A   156_A     A   156_A     28  216  216      8   68  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     N   157_A     N   157_A     28  216  216      8   19  113  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     G   158_A     G   158_A     28  216  216      8   68  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     R   159_A     R   159_A     28  216  216      8   68  131  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     P   160_A     P   160_A     28  216  216      8   89  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     L   161_A     L   161_A     28  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     V   162_A     V   162_A     28  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     V   163_A     V   163_A     28  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     A   164_A     A   164_A     28  216  216     22   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     G   165_A     G   165_A     28  216  216     12   70  137  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     A   166_A     A   166_A     28  216  216     23   93  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     G   167_A     G   167_A     28  216  216     17   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     L   168_A     L   168_A     28  216  216     10   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     D   169_A     D   169_A     28  216  216     17   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     L   170_A     L   170_A     28  216  216     37   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     S   171_A     S   171_A     28  216  216     23   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     Q   172_A     Q   172_A     28  216  216     10   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     M   173_A     M   173_A     28  216  216     17   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     A   174_A     A   174_A     28  216  216     23   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     S   175_A     S   175_A     19  216  216     14   82  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     L   176_A     L   176_A     19  216  216     10   48  137  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     I   177_A     I   177_A     19  216  216     10   54  132  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     D   178_A     D   178_A     19  216  216     10   39  111  165  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     D   179_A     D   179_A     18  216  216      4   36   73  137  187  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     F   180_A     F   180_A     18  216  216      3   30   98  151  187  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     R   181_A     R   181_A     18  216  216     10   38   79  151  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     L   182_A     L   182_A     18  216  216      4   57  117  162  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     G   183_A     G   183_A     18  216  216      3   26   87  137  184  199  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     G   184_A     G   184_A     18  216  216      3    6   25   75  102  144  198  210  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     S   185_A     S   185_A     17  216  216      3    5   25   75  106  189  205  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     G   186_A     G   186_A     19  216  216     11   87  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     H   187_A     H   187_A     19  216  216     16   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     A   188_A     A   188_A     19  216  216     16   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     S   189_A     S   189_A     19  216  216     27   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     L   190_A     L   190_A     19  216  216     27   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     L   191_A     L   191_A     19  216  216     22   91  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     S   192_A     S   192_A     19  216  216     16   85  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     A   193_A     A   193_A     19  216  216     16   37  102  156  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     E   194_A     E   194_A     19  216  216     16   37   95  156  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     G   195_A     G   195_A     19  216  216      9   48  102  156  187  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     E   196_A     E   196_A     19  216  216     10   62  122  161  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     L   197_A     L   197_A     19  216  216     16   91  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     L   198_A     L   198_A     19  216  216     18   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     V   199_A     V   199_A     19  216  216     23   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     R   200_A     R   200_A     19  216  216     18   93  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     S   201_A     S   201_A     19  216  216     16   78  138  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     L   235_A     L   235_A     19  216  216      3   30   64  111  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     Q   236_A     Q   236_A     19  216  216      3   19   58   96  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     V   237_A     V   237_A     19  216  216     11   87  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     H   238_A     H   238_A     18  216  216     11   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     E   239_A     E   239_A     18  216  216     35   93  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     A   240_A     A   240_A     18  216  216      9   87  137  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     T   241_A     T   241_A     18  216  216      8   77  131  165  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     R   242_A     R   242_A     18  216  216      3   38   77  115  169  198  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     D   243_A     D   243_A     18  216  216     11   38   77  115  169  198  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     G   244_A     G   244_A     19  216  216      9   21   43   83  117  173  196  210  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     Q   245_A     Q   245_A     22  216  216      9   38   81  125  176  200  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     E   246_A     E   246_A     22  216  216     11   77  133  165  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     V   247_A     V   247_A     22  216  216     28   89  138  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     L   248_A     L   248_A     22  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     V   249_A     V   249_A     22  216  216     27   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     S   250_A     S   250_A     22  216  216     11   83  139  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     T   251_A     T   251_A     22  216  216     16   86  137  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     I   252_A     I   252_A     22  216  216     16   39  137  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     W   253_A     W   253_A     22  216  216     13   54  134  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     L   254_A     L   254_A     22  216  216     12   61  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     P   255_A     P   255_A     22  216  216     14   86  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     E   256_A     E   256_A     22  216  216     15   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     L   257_A     L   257_A     22  216  216     24   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     Q   258_A     Q   258_A     22  216  216     22   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     R   259_A     R   259_A     22  216  216     16   91  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     Y   260_A     Y   260_A     22  216  216     16   79  137  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     L   261_A     L   261_A     22  216  216     16   86  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     M   262_A     M   262_A     22  216  216     21   91  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     V   263_A     V   263_A     22  216  216     27   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     E   264_A     E   264_A     22  216  216     40   94  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     V   265_A     V   265_A     22  216  216     20   88  140  166  188  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     D   266_A     D   266_A     22  216  216     11   41  123  161  187  201  208  212  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_GDT     K   267_A     K   267_A      8  216  216      7   16   74   92  137  179  196  207  215  216  216  216  216  216  216  216  216  216  216  216 
LCS_AVERAGE  LCS_A:  74.77  (  24.32  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     40     94    140    166    188    201    208    212    215    216    216    216    216    216    216    216    216    216    216    216 
GDT PERCENT_AT  18.52  43.52  64.81  76.85  87.04  93.06  96.30  98.15  99.54 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00
GDT RMS_LOCAL    0.36   0.68   0.97   1.14   1.38   1.52   1.66   1.75   1.84   1.88   1.88   1.88   1.88   1.88   1.88   1.88   1.88   1.88   1.88   1.88
GDT RMS_ALL_AT   2.10   2.04   1.96   1.97   1.92   1.91   1.89   1.89   1.88   1.88   1.88   1.88   1.88   1.88   1.88   1.88   1.88   1.88   1.88   1.88

# Checking swapping
#   possible swapping detected:  E    20_A      E    20_A
#   possible swapping detected:  Y    50_A      Y    50_A
#   possible swapping detected:  E    63_A      E    63_A
#   possible swapping detected:  E    82_A      E    82_A
#   possible swapping detected:  F    85_A      F    85_A
#   possible swapping detected:  Y    95_A      Y    95_A
#   possible swapping detected:  E   115_A      E   115_A
#   possible swapping detected:  D   117_A      D   117_A
#   possible swapping detected:  Y   120_A      Y   120_A
#   possible swapping detected:  F   122_A      F   122_A
#   possible swapping detected:  Y   129_A      Y   129_A
#   possible swapping detected:  E   130_A      E   130_A
#   possible swapping detected:  D   136_A      D   136_A
#   possible swapping detected:  F   138_A      F   138_A
#   possible swapping detected:  F   144_A      F   144_A
#   possible swapping detected:  Y   146_A      Y   146_A
#   possible swapping detected:  Y   149_A      Y   149_A
#   possible swapping detected:  D   243_A      D   243_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    Q    19_A      Q    19_A     2.735     0    0.583   1.036     7.271   55.357   35.079
LGA    E    20_A      E    20_A     2.514     0    0.149   0.921     5.444   64.881   54.021
LGA    L    21_A      L    21_A     1.473     0    0.020   0.972     2.587   79.286   76.250
LGA    P    22_A      P    22_A     1.775     0    0.124   0.343     2.510   70.952   69.592
LGA    A    23_A      A    23_A     3.383     0    0.053   0.052     4.101   51.786   48.857
LGA    Q    24_A      Q    24_A     3.013     0    0.034   0.884     3.452   57.262   56.455
LGA    V    25_A      V    25_A     1.351     0    0.027   0.073     1.835   77.143   81.565
LGA    K    26_A      K    26_A     2.329     0    0.011   0.734     5.078   62.976   54.074
LGA    G    27_A      G    27_A     3.267     0    0.083   0.083     3.267   55.357   55.357
LGA    L    28_A      L    28_A     2.300     0    0.031   0.877     3.574   66.905   62.202
LGA    A    29_A      A    29_A     1.223     0    0.015   0.018     1.558   79.286   79.714
LGA    A    30_A      A    30_A     2.438     0    0.036   0.037     3.099   64.762   61.810
LGA    H    31_A      H    31_A     2.659     0    0.041   1.142     2.910   59.048   63.571
LGA    I    32_A      I    32_A     1.648     0    0.035   0.624     3.070   77.143   74.286
LGA    N    33_A      N    33_A     1.250     0    0.018   0.855     3.537   81.429   71.548
LGA    L    34_A      L    34_A     1.667     0    0.027   1.018     2.800   72.857   73.155
LGA    S    35_A      S    35_A     1.746     0    0.030   0.676     1.872   72.857   74.286
LGA    L    36_A      L    36_A     1.122     0    0.020   0.956     3.593   85.952   78.988
LGA    S    37_A      S    37_A     0.828     0    0.040   0.042     1.088   88.214   88.968
LGA    Q    38_A      Q    38_A     1.186     0    0.045   0.832     4.722   81.429   66.720
LGA    D    39_A      D    39_A     1.198     0    0.008   0.844     4.241   81.429   67.202
LGA    L    40_A      L    40_A     1.078     0    0.038   1.389     4.261   81.429   71.726
LGA    A    41_A      A    41_A     0.958     0    0.030   0.033     1.070   85.952   86.857
LGA    I    42_A      I    42_A     1.440     0    0.017   0.073     1.742   79.286   76.071
LGA    S    43_A      S    43_A     1.338     0    0.041   0.061     1.349   81.429   81.429
LGA    E    44_A      E    44_A     1.125     0    0.028   0.100     1.253   81.429   84.444
LGA    S    45_A      S    45_A     1.248     0    0.060   0.646     2.403   79.286   77.222
LGA    L    46_A      L    46_A     1.618     0    0.025   1.390     3.128   75.000   71.131
LGA    A    47_A      A    47_A     1.573     0    0.024   0.028     1.721   72.857   74.571
LGA    N    48_A      N    48_A     1.347     0    0.039   0.234     1.634   81.429   80.357
LGA    S    49_A      S    49_A     1.391     0    0.000   0.030     1.391   83.690   82.937
LGA    Y    50_A      Y    50_A     1.228     0    0.010   1.336     6.488   81.429   64.802
LGA    F    51_A      F    51_A     1.058     0    0.082   1.195     6.680   81.429   55.541
LGA    I    52_A      I    52_A     1.276     0    0.022   0.072     1.478   81.429   81.429
LGA    E    53_A      E    53_A     1.332     0    0.037   0.112     1.494   81.429   81.429
LGA    Q    54_A      Q    54_A     1.419     0    0.037   0.852     3.977   79.286   70.847
LGA    W    55_A      W    55_A     1.391     0    0.019   1.410     8.114   81.429   48.333
LGA    V    56_A      V    56_A     1.385     0    0.067   0.092     1.545   79.286   80.204
LGA    R    57_A      R    57_A     1.941     0    0.027   0.824     3.000   68.810   69.394
LGA    E    58_A      E    58_A     1.974     0    0.017   0.168     4.432   77.143   60.794
LGA    G    59_A      G    59_A     1.300     0    0.632   0.632     3.384   73.571   73.571
LGA    L    60_A      L    60_A     1.139     0    0.205   0.842     5.629   85.952   61.071
LGA    P    61_A      P    61_A     0.870     0    0.043   0.075     1.124   88.214   86.599
LGA    E    62_A      E    62_A     1.174     0    0.054   1.216     4.489   85.952   73.122
LGA    E    63_A      E    63_A     0.766     0    0.068   0.884     2.492   90.476   81.746
LGA    R    64_A      R    64_A     0.275     0    0.048   1.379     7.733  100.000   66.061
LGA    Q    65_A      Q    65_A     0.472     0    0.064   0.238     1.641  100.000   90.741
LGA    N    66_A      N    66_A     0.836     0    0.128   1.194     4.250   88.214   76.250
LGA    D    67_A      D    67_A     0.757     0    0.093   0.254     1.250   88.214   88.214
LGA    I    68_A      I    68_A     0.729     0    0.043   0.633     2.021   90.476   86.131
LGA    A    69_A      A    69_A     0.728     0    0.071   0.078     0.728   90.476   90.476
LGA    A    70_A      A    70_A     0.858     0    0.031   0.037     0.960   90.476   90.476
LGA    Y    71_A      Y    71_A     0.870     0    0.026   0.175     1.456   90.476   87.460
LGA    L    72_A      L    72_A     0.872     0    0.004   0.050     1.172   90.476   88.214
LGA    A    73_A      A    73_A     0.744     0    0.028   0.043     0.785   90.476   90.476
LGA    R    74_A      R    74_A     0.485     0    0.077   0.813     3.090   92.857   82.944
LGA    L    75_A      L    75_A     1.113     0    0.013   0.192     1.357   83.690   82.560
LGA    M    76_A      M    76_A     1.217     0    0.017   0.997     3.147   79.286   74.524
LGA    E    77_A      E    77_A     1.265     0    0.054   0.115     1.570   79.286   83.492
LGA    Q    78_A      Q    78_A     1.524     0    0.010   0.964     4.343   75.000   66.349
LGA    L    79_A      L    79_A     1.289     0    0.027   1.045     2.976   81.429   78.452
LGA    D    80_A      D    80_A     1.363     0    0.010   0.230     1.969   81.429   77.143
LGA    T    81_A      T    81_A     0.905     0    0.095   0.192     1.044   85.952   87.891
LGA    E    82_A      E    82_A     0.947     0    0.032   1.495     6.435   88.214   65.767
LGA    L    83_A      L    83_A     0.667     0    0.050   0.130     0.727   90.476   94.048
LGA    L    84_A      L    84_A     0.823     0    0.023   1.351     3.609   88.214   74.940
LGA    F    85_A      F    85_A     0.801     0    0.034   0.113     1.378   90.476   88.009
LGA    I    86_A      I    86_A     0.557     0    0.035   0.064     1.737   92.857   86.071
LGA    A    87_A      A    87_A     0.284     0    0.162   0.187     0.414  100.000  100.000
LGA    A    88_A      A    88_A     1.022     0    0.031   0.039     1.036   88.214   86.857
LGA    Q    89_A      Q    89_A     0.917     0    0.036   1.060     3.132   90.476   75.556
LGA    H    90_A      H    90_A     0.507     0    0.053   0.201     1.099   92.857   87.810
LGA    Q    91_A      Q    91_A     0.431     0    0.023   0.836     3.467   97.619   83.439
LGA    G    92_A      G    92_A     0.421     0    0.140   0.140     0.466  100.000  100.000
LGA    R    93_A      R    93_A     0.874     0    0.048   1.166     5.137   90.476   68.182
LGA    G    94_A      G    94_A     0.963     0    0.017   0.017     1.059   88.214   88.214
LGA    Y    95_A      Y    95_A     0.527     0    0.076   0.161     1.251   90.476   89.762
LGA    Y    96_A      Y    96_A     0.703     0    0.032   0.180     1.185   90.476   88.214
LGA    F    97_A      F    97_A     0.947     0    0.043   0.090     1.098   88.214   88.831
LGA    Q    98_A      Q    98_A     0.989     0    0.057   0.311     1.596   88.214   83.492
LGA    L    99_A      L    99_A     0.711     0    0.029   0.954     2.911   90.476   85.179
LGA    R   100_A      R   100_A     0.869     0    0.033   1.006     5.805   85.952   72.251
LGA    N   101_A      N   101_A     2.228     0    0.012   0.055     2.736   64.881   65.833
LGA    G   102_A      G   102_A     2.456     0    0.046   0.046     2.456   64.762   64.762
LGA    E   103_A      E   103_A     1.532     0    0.044   0.707     1.919   79.405   76.720
LGA    F   104_A      F   104_A     1.021     0    0.100   0.326     1.373   81.429   84.719
LGA    L   105_A      L   105_A     1.030     0    0.000   0.179     1.161   85.952   84.821
LGA    Q   106_A      Q   106_A     0.708     0    0.020   0.592     1.723   90.476   87.513
LGA    R   107_A      R   107_A     0.722     0    0.046   0.911     3.481   90.476   85.974
LGA    I   108_A      I   108_A     1.076     0    0.013   0.088     1.604   81.429   80.357
LGA    I   109_A      I   109_A     1.113     0    0.024   0.070     1.224   81.429   83.690
LGA    Q   110_A      Q   110_A     1.552     0    0.053   0.534     2.386   79.286   74.868
LGA    P   111_A      P   111_A     0.938     0    0.053   0.063     1.211   85.952   85.306
LGA    P   112_A      P   112_A     1.045     0    0.060   0.330     1.874   83.690   82.789
LGA    G   113_A      G   113_A     0.843     0    0.033   0.033     1.011   88.214   88.214
LGA    S   114_A      S   114_A     1.266     0    0.035   0.037     1.580   81.429   80.000
LGA    E   115_A      E   115_A     1.527     0    0.099   0.973     2.930   79.286   73.069
LGA    D   116_A      D   116_A     1.408     0    0.285   0.951     3.755   79.286   68.452
LGA    D   117_A      D   117_A     2.680     0    0.034   0.961     3.781   60.952   56.429
LGA    W   118_A      W   118_A     2.885     0    0.027   1.030     7.506   57.143   40.612
LGA    Y   119_A      Y   119_A     2.016     0    0.065   0.216     2.594   66.786   68.175
LGA    Y   120_A      Y   120_A     1.759     0    0.053   0.291     1.914   72.857   76.468
LGA    H   121_A      H   121_A     1.590     0    0.048   1.362     6.572   75.000   53.381
LGA    F   122_A      F   122_A     2.139     0    0.045   1.298     3.682   64.881   66.753
LGA    T   123_A      T   123_A     2.266     0    0.125   1.042     3.658   66.786   61.769
LGA    D   124_A      D   124_A     1.907     0    0.080   0.157     2.126   68.810   69.821
LGA    S   125_A      S   125_A     1.825     0    0.056   0.571     1.894   75.000   75.714
LGA    D   126_A      D   126_A     1.479     0    0.061   0.159     2.014   79.286   75.060
LGA    N   127_A      N   127_A     1.155     0    0.073   1.003     2.548   81.429   79.524
LGA    A   128_A      A   128_A     0.993     0    0.040   0.040     1.091   88.214   86.857
LGA    Y   129_A      Y   129_A     0.716     0    0.052   0.122     1.275   90.476   87.460
LGA    E   130_A      E   130_A     0.486     0    0.063   0.681     4.227   95.238   77.302
LGA    L   131_A      L   131_A     0.708     0    0.240   1.026     2.727   85.952   80.833
LGA    N   132_A      N   132_A     2.711     0    0.181   0.635     5.154   59.048   48.333
LGA    L   133_A      L   133_A     2.110     0    0.022   0.760     3.509   64.762   63.095
LGA    D   134_A      D   134_A     2.238     0    0.045   0.220     2.469   64.762   64.762
LGA    S   135_A      S   135_A     2.354     0    0.659   0.564     4.824   59.405   52.063
LGA    D   136_A      D   136_A     4.541     0    0.669   1.281    10.530   48.929   26.310
LGA    T   137_A      T   137_A     2.473     0    0.127   0.137     3.350   53.690   56.327
LGA    F   138_A      F   138_A     4.823     0    0.571   0.545     7.265   26.190   23.203
LGA    S   139_A      S   139_A     3.599     0    0.266   0.274     4.352   43.452   45.635
LGA    P   140_A      P   140_A     4.248     0    0.045   0.108     4.460   37.143   38.027
LGA    D   141_A      D   141_A     4.211     0    0.050   0.095     4.426   37.143   37.143
LGA    D   142_A      D   142_A     3.696     0    0.073   0.140     3.892   43.333   44.167
LGA    A   143_A      A   143_A     3.288     0    0.035   0.045     3.671   51.905   50.190
LGA    F   144_A      F   144_A     2.055     0    0.079   0.260     2.481   68.810   74.502
LGA    V   145_A      V   145_A     1.694     0    0.115   0.109     2.198   79.405   75.442
LGA    Y   146_A      Y   146_A     1.314     0    0.027   0.093     1.930   81.429   77.857
LGA    V   147_A      V   147_A     0.844     0    0.165   0.152     1.028   90.476   89.184
LGA    N   148_A      N   148_A     0.626     0    0.118   0.734     2.469   90.476   88.452
LGA    Y   149_A      Y   149_A     1.061     0    0.026   0.489     4.178   83.690   67.778
LGA    R   150_A      R   150_A     1.333     0    0.028   1.326     4.501   75.119   68.442
LGA    S   151_A      S   151_A     1.373     0    0.020   0.601     1.450   81.429   81.429
LGA    T   152_A      T   152_A     1.542     0    0.139   1.041     2.609   79.405   74.354
LGA    V   153_A      V   153_A     0.990     0    0.076   0.148     1.281   83.690   86.599
LGA    N   154_A      N   154_A     1.147     0    0.051   0.493     2.657   83.690   80.655
LGA    A   155_A      A   155_A     1.391     0    0.054   0.086     1.681   81.429   79.714
LGA    A   156_A      A   156_A     1.534     0    0.020   0.020     1.780   75.000   74.571
LGA    N   157_A      N   157_A     2.041     0    0.039   0.519     2.690   70.833   66.845
LGA    G   158_A      G   158_A     1.526     0    0.021   0.021     1.697   77.143   77.143
LGA    R   159_A      R   159_A     1.716     0    0.056   0.186     3.061   75.000   65.108
LGA    P   160_A      P   160_A     1.493     0    0.000   0.025     1.905   77.143   75.306
LGA    L   161_A      L   161_A     1.241     0    0.025   1.366     4.103   81.429   71.726
LGA    V   162_A      V   162_A     1.244     0    0.069   0.075     1.293   81.429   81.429
LGA    V   163_A      V   163_A     0.975     0    0.113   0.135     1.283   88.214   87.891
LGA    A   164_A      A   164_A     1.113     0    0.027   0.044     1.558   79.286   79.714
LGA    G   165_A      G   165_A     1.584     0    0.043   0.043     1.584   81.548   81.548
LGA    A   166_A      A   166_A     0.946     0    0.109   0.142     1.240   90.595   88.762
LGA    G   167_A      G   167_A     1.030     0    0.098   0.098     1.431   83.690   83.690
LGA    L   168_A      L   168_A     1.208     0    0.045   0.544     1.765   79.286   80.357
LGA    D   169_A      D   169_A     1.006     0    0.009   0.308     1.387   85.952   87.143
LGA    L   170_A      L   170_A     0.600     0    0.038   1.196     4.580   90.476   74.762
LGA    S   171_A      S   171_A     0.453     0    0.068   0.608     2.079   92.857   89.365
LGA    Q   172_A      Q   172_A     0.842     0    0.027   0.824     4.919   90.476   69.471
LGA    M   173_A      M   173_A     0.930     0    0.026   0.797     4.896   90.476   76.548
LGA    A   174_A      A   174_A     0.443     0    0.050   0.048     0.920   95.238   94.286
LGA    S   175_A      S   175_A     1.124     0    0.112   0.649     2.937   81.548   78.968
LGA    L   176_A      L   176_A     1.518     0    0.132   0.975     4.233   72.976   66.429
LGA    I   177_A      I   177_A     1.707     0    0.104   1.297     3.790   72.857   70.238
LGA    D   178_A      D   178_A     2.266     0    0.149   0.498     3.752   61.190   63.393
LGA    D   179_A      D   179_A     3.206     0    0.143   0.932     5.445   51.786   44.702
LGA    F   180_A      F   180_A     3.105     0    0.262   0.756     4.837   51.786   41.472
LGA    R   181_A      R   181_A     2.729     0    0.280   1.318     5.851   57.143   51.385
LGA    L   182_A      L   182_A     2.520     0    0.591   1.440     7.168   67.024   49.583
LGA    G   183_A      G   183_A     3.757     0    0.694   0.694     4.647   38.810   38.810
LGA    G   184_A      G   184_A     5.585     0    0.044   0.044     5.842   23.810   23.810
LGA    S   185_A      S   185_A     4.643     0    0.634   0.753     5.853   30.357   32.619
LGA    G   186_A      G   186_A     1.212     0    0.042   0.042     1.808   79.286   79.286
LGA    H   187_A      H   187_A     0.795     0    0.096   1.097     2.610   88.214   83.667
LGA    A   188_A      A   188_A     0.658     0    0.088   0.117     0.816   90.476   90.476
LGA    S   189_A      S   189_A     1.049     0    0.067   0.078     1.240   83.690   84.444
LGA    L   190_A      L   190_A     0.917     0    0.031   0.922     2.556   90.476   85.179
LGA    L   191_A      L   191_A     1.255     0    0.071   0.444     2.738   81.429   75.238
LGA    S   192_A      S   192_A     1.466     0    0.069   0.168     1.877   77.143   77.143
LGA    A   193_A      A   193_A     2.510     0    0.059   0.062     2.760   59.048   58.667
LGA    E   194_A      E   194_A     2.626     0    0.032   0.526     5.039   57.143   50.635
LGA    G   195_A      G   195_A     2.941     0    0.077   0.077     2.941   57.143   57.143
LGA    E   196_A      E   196_A     2.294     0    0.064   0.904     3.081   68.810   65.820
LGA    L   197_A      L   197_A     1.204     0    0.019   0.648     1.954   79.286   80.536
LGA    L   198_A      L   198_A     0.608     0    0.033   1.145     4.860   90.476   75.714
LGA    V   199_A      V   199_A     0.425     0    0.075   0.210     0.705  100.000   95.918
LGA    R   200_A      R   200_A     0.682     0    0.052   0.643     2.659   83.810   73.983
LGA    S   201_A      S   201_A     1.378     0    0.299   0.327     2.559   75.476   77.460
LGA    L   235_A      L   235_A     2.635     0    0.146   0.763     3.840   59.048   58.274
LGA    Q   236_A      Q   236_A     2.615     0    0.140   1.232     3.292   57.262   62.751
LGA    V   237_A      V   237_A     1.168     0    0.042   1.093     3.359   79.286   74.490
LGA    H   238_A      H   238_A     1.082     0    0.046   1.121     5.484   85.952   64.190
LGA    E   239_A      E   239_A     1.168     0    0.076   1.017     4.516   75.119   63.492
LGA    A   240_A      A   240_A     1.592     0    0.108   0.142     1.635   75.000   76.286
LGA    T   241_A      T   241_A     2.169     0    0.581   0.998     4.715   75.595   61.156
LGA    R   242_A      R   242_A     3.895     0    0.267   1.165     6.165   33.810   40.303
LGA    D   243_A      D   243_A     4.229     0    0.622   1.181     7.464   29.643   32.262
LGA    G   244_A      G   244_A     5.983     0    0.498   0.498     5.983   30.357   30.357
LGA    Q   245_A      Q   245_A     3.858     0    0.139   1.394     5.849   43.690   36.455
LGA    E   246_A      E   246_A     2.226     0    0.117   0.320     3.453   66.905   64.180
LGA    V   247_A      V   247_A     1.345     0    0.093   1.178     4.440   81.548   73.946
LGA    L   248_A      L   248_A     0.391     0    0.027   1.014     2.328  100.000   89.881
LGA    V   249_A      V   249_A     0.868     0    0.070   1.023     2.539   85.952   78.163
LGA    S   250_A      S   250_A     1.754     0    0.029   0.083     2.596   77.143   71.746
LGA    T   251_A      T   251_A     1.677     0    0.067   0.159     2.090   72.857   71.701
LGA    I   252_A      I   252_A     1.954     0    0.082   0.633     5.238   72.857   64.048
LGA    W   253_A      W   253_A     1.983     0    0.036   0.425     2.628   70.833   64.320
LGA    L   254_A      L   254_A     1.490     0    0.206   1.022     2.971   75.000   73.095
LGA    P   255_A      P   255_A     1.138     0    0.024   0.331     1.380   85.952   85.306
LGA    E   256_A      E   256_A     0.708     0    0.042   0.397     1.250   90.476   90.529
LGA    L   257_A      L   257_A     0.573     0    0.037   1.026     3.775   90.476   79.167
LGA    Q   258_A      Q   258_A     0.722     0    0.123   0.833     5.160   90.476   69.947
LGA    R   259_A      R   259_A     1.175     0    0.057   0.872     5.153   83.690   61.299
LGA    Y   260_A      Y   260_A     1.705     0    0.111   0.277     2.456   77.143   71.587
LGA    L   261_A      L   261_A     1.598     0    0.092   1.387     3.202   77.143   68.274
LGA    M   262_A      M   262_A     1.373     0    0.126   1.098     2.657   81.548   74.286
LGA    V   263_A      V   263_A     0.992     0    0.017   1.059     2.631   88.214   79.456
LGA    E   264_A      E   264_A     0.591     0    0.092   0.460     3.838   88.452   73.069
LGA    V   265_A      V   265_A     1.283     0    0.031   1.197     3.102   81.548   74.626
LGA    D   266_A      D   266_A     2.541     0    0.068   0.362     3.579   53.810   58.393
LGA    K   267_A      K   267_A     5.298     0    0.079   0.956    14.352   25.476   12.593

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      216     864    864  100.00    1714   1714  100.00               216
SUMMARY(RMSD_GDC):     1.881          1.893                  2.434           76.614   71.800

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  282  216    4.0    212    1.75    79.630    89.683    11.449

LGA_LOCAL      RMSD:   1.752  Number of atoms:  212  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   1.887  Number of assigned atoms:  216 
Std_ASGN_ATOMS RMSD:   1.881  Standard rmsd on all 216 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.663231 * X  +   0.214284 * Y  +   0.717082 * Z  +  54.031078
  Y_new =   0.683456 * X  +  -0.217029 * Y  +   0.696984 * Z  +  34.519489
  Z_new =   0.304980 * X  +   0.952356 * Y  +  -0.002513 * Z  +  23.984045 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  2.341178 -0.309917  1.573435   [DEG:  134.1396  -17.7569   90.1512 ]
ZXZ:  2.341983  1.573310  0.309918   [DEG:  134.1857   90.1440   17.7570 ]
 
# END of job
