
#######################################################
#                                                     #
#                        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  278 ( 2143),  selected  278 , name one
# Molecule2: number of CA atoms  278 ( 2087),  selected  278 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:B  -ch2:B  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   278       1_B - 278_B       1.03     1.03
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   278       1_B - 278_B       1.03     1.03
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   277       2_B - 278_B       0.91     1.03
  LCS_AVERAGE:     99.29

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  278
LCS_GDT     RESIDUE       RESIDUE       SEGMENT_SIZE    GLOBAL DISTANCE TEST COLUMNS: number of residues under the threshold assigned to each residue pair
LCS_GDT   NAME NUMBER   NAME NUMBER    1.0  2.0  5.0    0.5  1.0  1.5  2.0  2.5  3.0  3.5  4.0  4.5  5.0  5.5  6.0  6.5  7.0  7.5  8.0  8.5  9.0  9.5 10.0
LCS_GDT     S     1_B     S     1_B      4  278  278      3    6    6    6    7    8   10   13  240  259  276  277  278  278  278  278  278  278  278  278 
LCS_GDT     A     2_B     A     2_B    277  278  278      3    6   57  112  149  182  268  274  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     M     3_B     M     3_B    277  278  278     31  239  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     L     4_B     L     4_B    277  278  278     48  240  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     L     5_B     L     5_B    277  278  278    134  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     R     6_B     R     6_B    277  278  278    160  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     F     7_B     F     7_B    277  278  278    163  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     T     8_B     T     8_B    277  278  278    163  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     K     9_B     K     9_B    277  278  278    163  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     M    10_B     M    10_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     H    11_B     H    11_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     G    12_B     G    12_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     L    13_B     L    13_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     G    14_B     G    14_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     N    15_B     N    15_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     D    16_B     D    16_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     F    17_B     F    17_B    277  278  278    163  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     M    18_B     M    18_B    277  278  278    163  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     V    19_B     V    19_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     L    20_B     L    20_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     D    21_B     D    21_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     L    22_B     L    22_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     V    23_B     V    23_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     S    24_B     S    24_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     Q    25_B     Q    25_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     H    26_B     H    26_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     A    27_B     A    27_B    277  278  278    161  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     H    28_B     H    28_B    277  278  278    156  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     V    29_B     V    29_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     Q    30_B     Q    30_B    277  278  278    161  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     P    31_B     P    31_B    277  278  278    118  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     K    32_B     K    32_B    277  278  278    144  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     H    33_B     H    33_B    277  278  278    148  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     V    34_B     V    34_B    277  278  278    127  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     K    35_B     K    35_B    277  278  278    122  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     L    36_B     L    36_B    277  278  278    127  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     W    37_B     W    37_B    277  278  278    126  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     G    38_B     G    38_B    277  278  278    127  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     D    39_B     D    39_B    277  278  278    118  247  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     R    40_B     R    40_B    277  278  278    114  244  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     N    41_B     N    41_B    277  278  278     90  174  267  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     T    42_B     T    42_B    277  278  278     90  219  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     G    43_B     G    43_B    277  278  278     90  244  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     V    44_B     V    44_B    277  278  278    122  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     G    45_B     G    45_B    277  278  278    127  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     F    46_B     F    46_B    277  278  278    138  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     D    47_B     D    47_B    277  278  278    127  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     Q    48_B     Q    48_B    277  278  278    127  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     L    49_B     L    49_B    277  278  278    156  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     L    50_B     L    50_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     I    51_B     I    51_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     V    52_B     V    52_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     E    53_B     E    53_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     A    54_B     A    54_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     P    55_B     P    55_B    277  278  278    146  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     S    56_B     S    56_B    277  278  278     68  239  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     S    57_B     S    57_B    277  278  278    137  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     P    58_B     P    58_B    277  278  278    129  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     D    59_B     D    59_B    277  278  278    102  239  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     V    60_B     V    60_B    277  278  278    146  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     D    61_B     D    61_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     F    62_B     F    62_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     R    63_B     R    63_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     Y    64_B     Y    64_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     R    65_B     R    65_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     I    66_B     I    66_B    277  278  278    166  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     F    67_B     F    67_B    277  278  278    151  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     N    68_B     N    68_B    277  278  278    144  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     A    69_B     A    69_B    277  278  278    127  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     D    70_B     D    70_B    277  278  278    122  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     G    71_B     G    71_B    277  278  278     90  247  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     S    72_B     S    72_B    277  278  278    110  248  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     E    73_B     E    73_B    277  278  278     82  248  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     V    74_B     V    74_B    277  278  278      3  229  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     E    75_B     E    75_B    277  278  278      3    3   11   19  141  246  269  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     Q    76_B     Q    76_B    277  278  278      3    4    4    6   37   71  147  176  273  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     C    77_B     C    77_B    277  278  278      3    4    4   39   92  246  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     G    78_B     G    78_B    277  278  278      5   25   98  261  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     N    79_B     N    79_B    277  278  278     53  193  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     G    80_B     G    80_B    277  278  278    166  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     A    81_B     A    81_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     R    82_B     R    82_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     C    83_B     C    83_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     F    84_B     F    84_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     A    85_B     A    85_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     R    86_B     R    86_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     F    87_B     F    87_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     V    88_B     V    88_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     Q    89_B     Q    89_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     D    90_B     D    90_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     K    91_B     K    91_B    277  278  278    163  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     R    92_B     R    92_B    277  278  278    156  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     L    93_B     L    93_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     T    94_B     T    94_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     V    95_B     V    95_B    277  278  278    170  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     K    96_B     K    96_B    277  278  278    163  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     K    97_B     K    97_B    277  278  278    150  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     S    98_B     S    98_B    277  278  278    155  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     I    99_B     I    99_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     R   100_B     R   100_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     V   101_B     V   101_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     E   102_B     E   102_B    277  278  278    149  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     T   103_B     T   103_B    277  278  278    125  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     K   104_B     K   104_B    277  278  278    129  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     G   105_B     G   105_B    277  278  278     82  246  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     G   106_B     G   106_B    277  278  278    138  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     I   107_B     I   107_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     I   108_B     I   108_B    277  278  278     68  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     E   109_B     E   109_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     L   110_B     L   110_B    277  278  278    155  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     N   111_B     N   111_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     I   112_B     I   112_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     R   113_B     R   113_B    277  278  278    163  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     P   114_B     P   114_B    277  278  278    146  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     D   115_B     D   115_B    277  278  278    166  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     G   116_B     G   116_B    277  278  278    163  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     Q   117_B     Q   117_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     V   118_B     V   118_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     T   119_B     T   119_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     V   120_B     V   120_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     D   121_B     D   121_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     M   122_B     M   122_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     G   123_B     G   123_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     P   124_B     P   124_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     P   125_B     P   125_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     R   126_B     R   126_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     L   127_B     L   127_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     A   128_B     A   128_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     P   129_B     P   129_B    277  278  278    134  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     A   130_B     A   130_B    277  278  278     37  197  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     E   131_B     E   131_B    277  278  278     26  230  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     I   132_B     I   132_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     P   133_B     P   133_B    277  278  278    100  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     F   134_B     F   134_B    277  278  278    156  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     Q   135_B     Q   135_B    277  278  278    152  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     A   136_B     A   136_B    277  278  278    120  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     E   137_B     E   137_B    277  278  278     37  193  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     R   138_B     R   138_B    277  278  278    156  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     E   139_B     E   139_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     A   140_B     A   140_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     L   141_B     L   141_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     S   142_B     S   142_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     Y   143_B     Y   143_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     E   144_B     E   144_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     I   145_B     I   145_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     E   146_B     E   146_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     V   147_B     V   147_B    277  278  278    166  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     N   148_B     N   148_B    277  278  278     48  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     G   149_B     G   149_B    277  278  278    109  246  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     Q   150_B     Q   150_B    277  278  278     12  244  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     R   151_B     R   151_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     V   152_B     V   152_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     E   153_B     E   153_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     L   154_B     L   154_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     A   155_B     A   155_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     A   156_B     A   156_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     V   157_B     V   157_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     S   158_B     S   158_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     M   159_B     M   159_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     G   160_B     G   160_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     N   161_B     N   161_B    277  278  278    163  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     P   162_B     P   162_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     H   163_B     H   163_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     G   164_B     G   164_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     V   165_B     V   165_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     L   166_B     L   166_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     R   167_B     R   167_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     V   168_B     V   168_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     E   169_B     E   169_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     N   170_B     N   170_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     V   171_B     V   171_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     D   172_B     D   172_B    277  278  278    170  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     S   173_B     S   173_B    277  278  278    161  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     A   174_B     A   174_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     P   175_B     P   175_B    277  278  278    172  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     V   176_B     V   176_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     H   177_B     H   177_B    277  278  278    157  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     S   178_B     S   178_B    277  278  278    155  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     L   179_B     L   179_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     G   180_B     G   180_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     P   181_B     P   181_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     Q   182_B     Q   182_B    277  278  278    172  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     L   183_B     L   183_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     E   184_B     E   184_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     V   185_B     V   185_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     H   186_B     H   186_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     P   187_B     P   187_B    277  278  278    163  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     R   188_B     R   188_B    277  278  278    160  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     F   189_B     F   189_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     P   190_B     P   190_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     K   191_B     K   191_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     K   192_B     K   192_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     A   193_B     A   193_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     N   194_B     N   194_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     I   195_B     I   195_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     G   196_B     G   196_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     F   197_B     F   197_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     L   198_B     L   198_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     Q   199_B     Q   199_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     V   200_B     V   200_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     L   201_B     L   201_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     D   202_B     D   202_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     P   203_B     P   203_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     H   204_B     H   204_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     H   205_B     H   205_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     A   206_B     A   206_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     R   207_B     R   207_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     L   208_B     L   208_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     R   209_B     R   209_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     V   210_B     V   210_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     W   211_B     W   211_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     E   212_B     E   212_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     R   213_B     R   213_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     G   214_B     G   214_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     V   215_B     V   215_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     G   216_B     G   216_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     E   217_B     E   217_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     T   218_B     T   218_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     Q   219_B     Q   219_B    277  278  278    170  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     A   220_B     A   220_B    277  278  278    172  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     C   221_B     C   221_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     G   222_B     G   222_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     T   223_B     T   223_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     G   224_B     G   224_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     A   225_B     A   225_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     C   226_B     C   226_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     A   227_B     A   227_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     A   228_B     A   228_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     A   229_B     A   229_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     V   230_B     V   230_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     A   231_B     A   231_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     G   232_B     G   232_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     I   233_B     I   233_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     R   234_B     R   234_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     Q   235_B     Q   235_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     G   236_B     G   236_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     W   237_B     W   237_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     L   238_B     L   238_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     Q   239_B     Q   239_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     S   240_B     S   240_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     P   241_B     P   241_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     V   242_B     V   242_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     Q   243_B     Q   243_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     I   244_B     I   244_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     D   245_B     D   245_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     L   246_B     L   246_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     P   247_B     P   247_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     G   248_B     G   248_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     G   249_B     G   249_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     R   250_B     R   250_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     L   251_B     L   251_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     H   252_B     H   252_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     I   253_B     I   253_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     E   254_B     E   254_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     W   255_B     W   255_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     A   256_B     A   256_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     G   257_B     G   257_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     P   258_B     P   258_B    277  278  278    169  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     G   259_B     G   259_B    277  278  278    161  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     Q   260_B     Q   260_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     P   261_B     P   261_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     V   262_B     V   262_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     M   263_B     M   263_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     M   264_B     M   264_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     T   265_B     T   265_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     G   266_B     G   266_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     P   267_B     P   267_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     A   268_B     A   268_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     V   269_B     V   269_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     R   270_B     R   270_B    277  278  278    173  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     V   271_B     V   271_B    277  278  278    160  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     Y   272_B     Y   272_B    277  278  278    150  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     E   273_B     E   273_B    277  278  278    156  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     G   274_B     G   274_B    277  278  278    126  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     Q   275_B     Q   275_B    277  278  278    156  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     V   276_B     V   276_B    277  278  278    137  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     R   277_B     R   277_B    277  278  278    137  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_GDT     L   278_B     L   278_B    277  278  278    137  250  269  272  273  273  274  275  275  276  277  277  278  278  278  278  278  278  278  278 
LCS_AVERAGE  LCS_A:  99.76  (  99.29  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    173    250    269    272    273    273    274    275    275    276    277    277    278    278    278    278    278    278    278    278 
GDT PERCENT_AT  62.23  89.93  96.76  97.84  98.20  98.20  98.56  98.92  98.92  99.28  99.64  99.64 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00
GDT RMS_LOCAL    0.30   0.50   0.60   0.62   0.64   0.64   0.69   0.75   0.75   0.83   0.91   0.91   1.03   1.03   1.03   1.03   1.03   1.03   1.03   1.03
GDT RMS_ALL_AT   1.08   1.04   1.04   1.04   1.04   1.04   1.04   1.04   1.04   1.03   1.03   1.03   1.03   1.03   1.03   1.03   1.03   1.03   1.03   1.03

# Checking swapping
#   possible swapping detected:  F    17_B      F    17_B
#   possible swapping detected:  F    46_B      F    46_B
#   possible swapping detected:  Y    64_B      Y    64_B
#   possible swapping detected:  F    67_B      F    67_B
#   possible swapping detected:  E    73_B      E    73_B
#   possible swapping detected:  F    84_B      F    84_B
#   possible swapping detected:  F    87_B      F    87_B
#   possible swapping detected:  E   131_B      E   131_B
#   possible swapping detected:  F   134_B      F   134_B
#   possible swapping detected:  E   139_B      E   139_B
#   possible swapping detected:  E   184_B      E   184_B
#   possible swapping detected:  F   197_B      F   197_B
#   possible swapping detected:  E   217_B      E   217_B
#   possible swapping detected:  E   254_B      E   254_B
#   possible swapping detected:  Y   272_B      Y   272_B
#   possible swapping detected:  E   273_B      E   273_B

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    S     1_B      S     1_B     8.190     0    0.315   0.678     8.740   15.476   11.905
LGA    A     2_B      A     2_B     6.206     0    0.077   0.100     8.231   28.452   23.714
LGA    M     3_B      M     3_B     1.342     0    0.633   1.037     9.956   79.524   48.036
LGA    L     4_B      L     4_B     1.315     0    0.165   1.108     4.072   83.690   73.810
LGA    L     5_B      L     5_B     0.683     0    0.059   1.353     2.812   90.476   81.964
LGA    R     6_B      R     6_B     0.501     0    0.035   1.093     6.051   95.238   76.970
LGA    F     7_B      F     7_B     0.369     0    0.047   0.046     0.929   97.619   93.939
LGA    T     8_B      T     8_B     0.376     0    0.021   0.039     0.435  100.000  100.000
LGA    K     9_B      K     9_B     0.413     0    0.013   0.151     0.831  100.000   95.767
LGA    M    10_B      M    10_B     0.260     0    0.038   0.155     0.661  100.000   98.810
LGA    H    11_B      H    11_B     0.287     0    0.032   0.131     0.415  100.000  100.000
LGA    G    12_B      G    12_B     0.282     0    0.015   0.015     0.349  100.000  100.000
LGA    L    13_B      L    13_B     0.442     0    0.040   0.082     0.699   97.619   94.048
LGA    G    14_B      G    14_B     0.408     0    0.151   0.151     1.011   92.976   92.976
LGA    N    15_B      N    15_B     0.436     0    0.044   0.148     0.650  100.000   95.238
LGA    D    16_B      D    16_B     0.283     0    0.017   0.309     1.199  100.000   94.167
LGA    F    17_B      F    17_B     0.470     0    0.027   0.052     0.520  100.000   99.134
LGA    M    18_B      M    18_B     0.457     0    0.019   0.115     0.822   97.619   95.238
LGA    V    19_B      V    19_B     0.201     0    0.016   0.046     0.261  100.000  100.000
LGA    L    20_B      L    20_B     0.223     0    0.014   0.130     0.421  100.000  100.000
LGA    D    21_B      D    21_B     0.279     0    0.022   0.028     0.440  100.000  100.000
LGA    L    22_B      L    22_B     0.378     0    0.035   0.084     0.512  100.000   98.810
LGA    V    23_B      V    23_B     0.486     0    0.037   0.052     0.653   95.238   93.197
LGA    S    24_B      S    24_B     0.433     0    0.090   0.653     1.585  100.000   93.889
LGA    Q    25_B      Q    25_B     0.370     0    0.059   0.064     0.801   97.619   94.709
LGA    H    26_B      H    26_B     0.233     3    0.121   0.852     2.945  100.000   63.000
LGA    A    27_B      A    27_B     0.565     0    0.050   0.062     0.637   92.857   92.381
LGA    H    28_B      H    28_B     0.671     1    0.040   1.528     6.278   90.476   60.810
LGA    V    29_B      V    29_B     0.264     0    0.032   0.066     0.321  100.000  100.000
LGA    Q    30_B      Q    30_B     0.590     4    0.014   0.017     0.658   92.857   51.323
LGA    P    31_B      P    31_B     1.025     0    0.034   0.309     1.833   88.214   84.082
LGA    K    32_B      K    32_B     0.910     3    0.044   0.208     0.959   90.476   60.317
LGA    H    33_B      H    33_B     0.692     0    0.026   0.369     1.415   90.476   90.571
LGA    V    34_B      V    34_B     0.901     0    0.040   0.106     1.094   88.214   87.891
LGA    K    35_B      K    35_B     1.059     3    0.050   0.049     1.213   83.690   55.291
LGA    L    36_B      L    36_B     1.015     2    0.031   0.764     3.228   81.429   58.274
LGA    W    37_B      W    37_B     0.983     0    0.017   0.084     1.032   85.952   89.184
LGA    G    38_B      G    38_B     0.976     0    0.015   0.015     1.026   85.952   85.952
LGA    D    39_B      D    39_B     1.280     0    0.037   0.175     1.944   81.429   78.214
LGA    R    40_B      R    40_B     1.367     0    0.051   0.111     1.605   77.143   84.805
LGA    N    41_B      N    41_B     2.020     0    0.085   0.230     2.454   70.833   67.798
LGA    T    42_B      T    42_B     1.729     0    0.102   0.112     1.884   72.857   72.857
LGA    G    43_B      G    43_B     1.354     0    0.042   0.042     1.561   79.286   79.286
LGA    V    44_B      V    44_B     1.056     0    0.079   0.085     1.126   83.690   82.721
LGA    G    45_B      G    45_B     0.938     0    0.014   0.014     1.018   88.214   88.214
LGA    F    46_B      F    46_B     0.702     0    0.025   0.068     1.152   90.476   87.186
LGA    D    47_B      D    47_B     0.747     0    0.018   0.089     0.989   90.476   90.476
LGA    Q    48_B      Q    48_B     0.722     0    0.044   0.667     1.597   92.857   87.566
LGA    L    49_B      L    49_B     0.559     0    0.014   0.055     0.713   92.857   94.048
LGA    L    50_B      L    50_B     0.315     0    0.030   0.109     0.439  100.000  100.000
LGA    I    51_B      I    51_B     0.252     0    0.017   0.047     0.324  100.000  100.000
LGA    V    52_B      V    52_B     0.180     0    0.017   0.025     0.242  100.000  100.000
LGA    E    53_B      E    53_B     0.516     2    0.032   0.049     0.775   92.857   71.429
LGA    A    54_B      A    54_B     0.652     0    0.012   0.026     0.800   90.476   90.476
LGA    P    55_B      P    55_B     0.730     0    0.123   0.139     1.043   88.214   89.184
LGA    S    56_B      S    56_B     1.326     1    0.353   0.329     2.215   81.548   65.159
LGA    S    57_B      S    57_B     0.954     0    0.036   0.629     3.774   85.952   76.667
LGA    P    58_B      P    58_B     0.923     2    0.695   0.638     3.264   78.095   56.259
LGA    D    59_B      D    59_B     1.398     0    0.147   1.166     6.022   83.690   61.012
LGA    V    60_B      V    60_B     0.860     0    0.046   1.121     2.840   88.214   80.612
LGA    D    61_B      D    61_B     0.564     0    0.015   0.031     0.613   90.476   91.667
LGA    F    62_B      F    62_B     0.489     0    0.027   0.067     0.532   97.619   99.134
LGA    R    63_B      R    63_B     0.450     0    0.012   0.968     3.939  100.000   82.944
LGA    Y    64_B      Y    64_B     0.344     0    0.022   0.069     0.702  100.000   98.413
LGA    R    65_B      R    65_B     0.442     2    0.038   0.457     1.936  100.000   76.753
LGA    I    66_B      I    66_B     0.519     0    0.010   0.191     0.727   92.857   92.857
LGA    F    67_B      F    67_B     0.652     0    0.033   0.048     0.738   90.476   91.342
LGA    N    68_B      N    68_B     0.708     0    0.045   1.259     3.814   90.476   81.250
LGA    A    69_B      A    69_B     0.876     0    0.051   0.066     1.065   85.952   86.857
LGA    D    70_B      D    70_B     1.097     0    0.041   0.265     1.433   81.429   82.560
LGA    G    71_B      G    71_B     1.290     0    0.079   0.079     1.290   81.429   81.429
LGA    S    72_B      S    72_B     1.242     0    0.033   0.077     1.434   81.429   81.429
LGA    E    73_B      E    73_B     1.227     0    0.283   0.244     2.042   77.262   82.593
LGA    V    74_B      V    74_B     1.370     1    0.061   0.659     5.073   64.286   49.728
LGA    E    75_B      E    75_B     4.885     4    0.585   0.575     5.666   34.048   17.513
LGA    Q    76_B      Q    76_B     6.276     0    0.583   1.243    13.500   27.976   12.751
LGA    C    77_B      C    77_B     4.167     0    0.680   1.034     7.271   35.833   31.746
LGA    G    78_B      G    78_B     2.575     0    0.304   0.304     2.575   60.952   60.952
LGA    N    79_B      N    79_B     1.335     0    0.189   0.224     1.485   81.429   83.690
LGA    G    80_B      G    80_B     0.535     0    0.110   0.110     0.895   95.238   95.238
LGA    A    81_B      A    81_B     0.391     0    0.061   0.078     0.634  100.000   98.095
LGA    R    82_B      R    82_B     0.204     0    0.031   0.086     0.301  100.000  100.000
LGA    C    83_B      C    83_B     0.132     0    0.021   0.033     0.164  100.000  100.000
LGA    F    84_B      F    84_B     0.107     0    0.053   0.069     0.448  100.000  100.000
LGA    A    85_B      A    85_B     0.306     0    0.016   0.015     0.359  100.000  100.000
LGA    R    86_B      R    86_B     0.258     0    0.027   0.673     2.018  100.000   85.238
LGA    F    87_B      F    87_B     0.149     0    0.013   0.047     0.384  100.000  100.000
LGA    V    88_B      V    88_B     0.302     0    0.039   0.055     0.507  100.000   98.639
LGA    Q    89_B      Q    89_B     0.387     0    0.019   0.995     2.446  100.000   92.011
LGA    D    90_B      D    90_B     0.399     0    0.011   0.185     0.786   97.619   96.429
LGA    K    91_B      K    91_B     0.543     0    0.021   0.566     3.024   97.619   85.238
LGA    R    92_B      R    92_B     0.600     0    0.031   1.226     4.173   92.857   77.013
LGA    L    93_B      L    93_B     0.581     0    0.041   0.084     0.596   90.476   95.238
LGA    T    94_B      T    94_B     0.551     0    0.035   0.072     0.701   92.857   91.837
LGA    V    95_B      V    95_B     0.503     0    0.018   0.061     0.557   92.857   95.918
LGA    K    96_B      K    96_B     0.553     0    0.008   0.748     3.179   90.476   85.979
LGA    K    97_B      K    97_B     0.645     1    0.024   0.615     3.023   92.857   73.280
LGA    S    98_B      S    98_B     0.614     0    0.041   0.684     3.169   92.857   85.317
LGA    I    99_B      I    99_B     0.485     0    0.063   0.099     0.653   92.857   96.429
LGA    R   100_B      R   100_B     0.483     0    0.031   1.313     3.371   97.619   84.545
LGA    V   101_B      V   101_B     0.482     0    0.024   0.044     0.550   95.238   97.279
LGA    E   102_B      E   102_B     0.731     4    0.015   0.014     0.850   90.476   50.265
LGA    T   103_B      T   103_B     0.832     0    0.050   0.099     0.995   90.476   90.476
LGA    K   104_B      K   104_B     0.866     2    0.131   0.230     1.654   83.810   67.407
LGA    G   105_B      G   105_B     1.102     0    0.101   0.101     1.503   81.548   81.548
LGA    G   106_B      G   106_B     0.730     0    0.120   0.120     1.324   88.214   88.214
LGA    I   107_B      I   107_B     0.490     0    0.027   0.533     1.450   92.857   90.536
LGA    I   108_B      I   108_B     0.876     0    0.071   1.248     3.183   92.857   82.143
LGA    E   109_B      E   109_B     0.195     0    0.041   0.951     3.310  100.000   80.159
LGA    L   110_B      L   110_B     0.732     0    0.135   0.892     3.372   90.476   78.869
LGA    N   111_B      N   111_B     0.467     0    0.083   1.085     5.024  100.000   78.869
LGA    I   112_B      I   112_B     0.259     0    0.036   0.065     0.374  100.000  100.000
LGA    R   113_B      R   113_B     0.473     0    0.016   0.627     2.516   95.238   86.147
LGA    P   114_B      P   114_B     0.680     0    0.028   0.055     0.773   90.476   90.476
LGA    D   115_B      D   115_B     0.379     0    0.021   0.097     0.587  100.000   98.810
LGA    G   116_B      G   116_B     0.463     0    0.060   0.060     0.463  100.000  100.000
LGA    Q   117_B      Q   117_B     0.226     0    0.036   0.073     0.448  100.000  100.000
LGA    V   118_B      V   118_B     0.116     0    0.015   0.042     0.243  100.000  100.000
LGA    T   119_B      T   119_B     0.222     0    0.000   0.043     0.365  100.000  100.000
LGA    V   120_B      V   120_B     0.435     0    0.021   0.061     0.776  100.000   95.918
LGA    D   121_B      D   121_B     0.329     0    0.017   0.094     0.546   97.619   98.810
LGA    M   122_B      M   122_B     0.324     0    0.015   0.136     0.454  100.000  100.000
LGA    G   123_B      G   123_B     0.234     0    0.031   0.031     0.304  100.000  100.000
LGA    P   124_B      P   124_B     0.174     0    0.046   0.146     0.603  100.000   98.639
LGA    P   125_B      P   125_B     0.283     0    0.062   0.071     0.475  100.000  100.000
LGA    R   126_B      R   126_B     0.214     0    0.023   0.313     2.042  100.000   89.307
LGA    L   127_B      L   127_B     0.300     0    0.054   0.063     0.399  100.000  100.000
LGA    A   128_B      A   128_B     0.387     0    0.020   0.028     0.556  100.000   98.095
LGA    P   129_B      P   129_B     0.678     0    0.022   0.176     1.004   92.857   91.905
LGA    A   130_B      A   130_B     1.578     0    0.053   0.068     1.955   75.000   74.571
LGA    E   131_B      E   131_B     1.328     0    0.022   0.284     3.020   81.429   73.280
LGA    I   132_B      I   132_B     0.573     0    0.193   0.298     1.698   86.071   86.012
LGA    P   133_B      P   133_B     0.654     0    0.385   0.590     2.424   88.214   82.993
LGA    F   134_B      F   134_B     0.688     0    0.052   0.057     0.891   90.476   90.476
LGA    Q   135_B      Q   135_B     0.699     0    0.084   0.161     0.944   90.476   90.476
LGA    A   136_B      A   136_B     0.948     0    0.049   0.064     1.415   85.952   86.857
LGA    E   137_B      E   137_B     1.740     3    0.050   0.764     2.410   77.143   48.677
LGA    R   138_B      R   138_B     0.822     3    0.030   0.561     2.156   88.214   64.372
LGA    E   139_B      E   139_B     0.510     0    0.011   0.091     0.892   95.238   93.651
LGA    A   140_B      A   140_B     0.202     0    0.019   0.019     0.275  100.000  100.000
LGA    L   141_B      L   141_B     0.261     0    0.041   0.150     0.891  100.000   97.619
LGA    S   142_B      S   142_B     0.224     0    0.049   0.675     2.297  100.000   94.127
LGA    Y   143_B      Y   143_B     0.224     0    0.039   0.089     0.906  100.000   96.825
LGA    E   144_B      E   144_B     0.158     0    0.016   0.500     2.108  100.000   95.026
LGA    I   145_B      I   145_B     0.165     0    0.035   1.182     2.583  100.000   86.845
LGA    E   146_B      E   146_B     0.246     3    0.029   0.672     2.377  100.000   62.751
LGA    V   147_B      V   147_B     0.568     0    0.072   0.137     0.816   92.857   93.197
LGA    N   148_B      N   148_B     0.861     0    0.029   0.354     2.562   88.214   80.714
LGA    G   149_B      G   149_B     1.101     0    0.067   0.067     1.300   83.690   83.690
LGA    Q   150_B      Q   150_B     1.112     0    0.035   0.717     3.885   85.952   75.450
LGA    R   151_B      R   151_B     0.494     0    0.024   1.319     4.069   95.238   72.381
LGA    V   152_B      V   152_B     0.353     0    0.043   1.093     2.957  100.000   88.639
LGA    E   153_B      E   153_B     0.267     3    0.030   0.597     1.892  100.000   63.651
LGA    L   154_B      L   154_B     0.404     0    0.052   1.293     2.553  100.000   87.857
LGA    A   155_B      A   155_B     0.336     0    0.088   0.103     0.607   97.619   98.095
LGA    A   156_B      A   156_B     0.271     0    0.027   0.035     0.408  100.000  100.000
LGA    V   157_B      V   157_B     0.279     0    0.010   0.083     0.436  100.000  100.000
LGA    S   158_B      S   158_B     0.284     0    0.022   0.057     0.318  100.000  100.000
LGA    M   159_B      M   159_B     0.372     0    0.084   0.120     0.635   97.619   98.810
LGA    G   160_B      G   160_B     0.314     0    0.120   0.120     0.484  100.000  100.000
LGA    N   161_B      N   161_B     0.477     0    0.078   0.075     0.666   95.238   95.238
LGA    P   162_B      P   162_B     0.316     0    0.011   0.117     0.393  100.000  100.000
LGA    H   163_B      H   163_B     0.322     0    0.022   0.061     0.459  100.000  100.000
LGA    G   164_B      G   164_B     0.326     0    0.065   0.065     0.513   97.619   97.619
LGA    V   165_B      V   165_B     0.361     0    0.040   0.050     0.427  100.000  100.000
LGA    L   166_B      L   166_B     0.227     0    0.046   1.330     3.172  100.000   85.952
LGA    R   167_B      R   167_B     0.439     0    0.018   0.070     0.773  100.000   94.805
LGA    V   168_B      V   168_B     0.342     0    0.023   0.036     0.419  100.000  100.000
LGA    E   169_B      E   169_B     0.191     3    0.038   0.811     2.627  100.000   61.905
LGA    N   170_B      N   170_B     0.088     0    0.106   0.181     0.763   97.619   95.238
LGA    V   171_B      V   171_B     0.418     0    0.022   1.371     2.622   95.238   84.762
LGA    D   172_B      D   172_B     0.684     0    0.051   0.089     0.820   90.476   90.476
LGA    S   173_B      S   173_B     0.758     0    0.031   0.053     0.794   90.476   90.476
LGA    A   174_B      A   174_B     0.440     0    0.035   0.036     0.552   92.857   94.286
LGA    P   175_B      P   175_B     0.680     0    0.036   0.060     0.697   90.476   90.476
LGA    V   176_B      V   176_B     0.635     0    0.023   0.050     0.700   90.476   90.476
LGA    H   177_B      H   177_B     0.865     0    0.033   0.373     1.499   90.476   87.762
LGA    S   178_B      S   178_B     0.895     0    0.062   0.065     1.145   88.214   88.968
LGA    L   179_B      L   179_B     0.601     0    0.035   0.135     0.648   90.476   92.857
LGA    G   180_B      G   180_B     0.600     0    0.028   0.028     0.622   95.238   95.238
LGA    P   181_B      P   181_B     0.414     0    0.043   0.168     0.664  100.000   97.279
LGA    Q   182_B      Q   182_B     0.659     0    0.020   0.062     1.030   90.476   89.471
LGA    L   183_B      L   183_B     0.440     0    0.045   0.087     0.504   97.619   98.810
LGA    E   184_B      E   184_B     0.369     0    0.027   0.203     0.698  100.000   98.942
LGA    V   185_B      V   185_B     0.512     0    0.022   0.065     0.683   92.857   93.197
LGA    H   186_B      H   186_B     0.668     0    0.028   0.192     1.006   90.476   89.571
LGA    P   187_B      P   187_B     0.908     0    0.015   0.039     0.924   90.476   90.476
LGA    R   188_B      R   188_B     0.864     0    0.052   1.027     3.005   90.476   81.905
LGA    F   189_B      F   189_B     0.610     0    0.020   0.093     0.955   95.238   92.208
LGA    P   190_B      P   190_B     0.278     0    0.032   0.161     0.683  100.000   98.639
LGA    K   191_B      K   191_B     0.407     1    0.020   0.743     3.220  100.000   76.455
LGA    K   192_B      K   192_B     0.343     0    0.071   0.246     0.627  100.000   98.942
LGA    A   193_B      A   193_B     0.367     0    0.041   0.058     0.539   97.619   98.095
LGA    N   194_B      N   194_B     0.313     0    0.014   0.102     0.518  100.000   98.810
LGA    I   195_B      I   195_B     0.339     0    0.026   0.044     0.418  100.000  100.000
LGA    G   196_B      G   196_B     0.249     0    0.066   0.066     0.392  100.000  100.000
LGA    F   197_B      F   197_B     0.325     0    0.040   0.046     0.584  100.000   96.537
LGA    L   198_B      L   198_B     0.135     0    0.061   0.061     0.222  100.000  100.000
LGA    Q   199_B      Q   199_B     0.227     0    0.014   0.273     1.028  100.000   97.937
LGA    V   200_B      V   200_B     0.078     0    0.009   0.043     0.253  100.000  100.000
LGA    L   201_B      L   201_B     0.432     0    0.041   0.078     0.802   97.619   94.048
LGA    D   202_B      D   202_B     0.602     0    0.050   0.062     0.764   95.238   94.048
LGA    P   203_B      P   203_B     0.604     0    0.017   0.031     0.837   92.857   91.837
LGA    H   204_B      H   204_B     0.357     0    0.049   0.063     0.794  100.000   97.143
LGA    H   205_B      H   205_B     0.344     0    0.026   0.068     0.663  100.000   95.238
LGA    A   206_B      A   206_B     0.216     0    0.049   0.057     0.293  100.000  100.000
LGA    R   207_B      R   207_B     0.272     0    0.018   0.152     0.714  100.000   96.537
LGA    L   208_B      L   208_B     0.254     0    0.046   0.079     0.357  100.000  100.000
LGA    R   209_B      R   209_B     0.466     0    0.041   0.086     0.664  100.000   93.939
LGA    V   210_B      V   210_B     0.403     0    0.029   0.055     0.490  100.000  100.000
LGA    W   211_B      W   211_B     0.404     0    0.011   0.116     0.724  100.000   95.918
LGA    E   212_B      E   212_B     0.493     0    0.019   0.626     2.360   95.238   81.164
LGA    R   213_B      R   213_B     0.528     0    0.062   0.184     0.843   92.857   92.208
LGA    G   214_B      G   214_B     0.713     0    0.037   0.037     0.713   90.476   90.476
LGA    V   215_B      V   215_B     0.568     0    0.020   0.047     0.694   90.476   90.476
LGA    G   216_B      G   216_B     0.617     0    0.016   0.016     0.660   90.476   90.476
LGA    E   217_B      E   217_B     0.663     0    0.028   0.080     1.039   90.476   89.471
LGA    T   218_B      T   218_B     0.618     0    0.017   0.125     0.635   90.476   91.837
LGA    Q   219_B      Q   219_B     0.671     0    0.015   1.026     3.286   90.476   83.968
LGA    A   220_B      A   220_B     0.613     0    0.043   0.046     0.817   90.476   90.476
LGA    C   221_B      C   221_B     0.567     0    0.040   0.037     0.617   95.238   93.651
LGA    G   222_B      G   222_B     0.416     0    0.015   0.015     0.486  100.000  100.000
LGA    T   223_B      T   223_B     0.333     0    0.026   0.082     0.354  100.000  100.000
LGA    G   224_B      G   224_B     0.359     0    0.039   0.039     0.362  100.000  100.000
LGA    A   225_B      A   225_B     0.245     0    0.025   0.033     0.303  100.000  100.000
LGA    C   226_B      C   226_B     0.172     0    0.030   0.073     0.489  100.000  100.000
LGA    A   227_B      A   227_B     0.191     0    0.015   0.024     0.212  100.000  100.000
LGA    A   228_B      A   228_B     0.249     0    0.019   0.026     0.280  100.000  100.000
LGA    A   229_B      A   229_B     0.275     0    0.042   0.045     0.297  100.000  100.000
LGA    V   230_B      V   230_B     0.234     0    0.029   0.046     0.346  100.000  100.000
LGA    A   231_B      A   231_B     0.330     0    0.051   0.056     0.459  100.000  100.000
LGA    G   232_B      G   232_B     0.355     0    0.015   0.015     0.404  100.000  100.000
LGA    I   233_B      I   233_B     0.416     0    0.022   0.050     0.509   97.619   98.810
LGA    R   234_B      R   234_B     0.417     0    0.026   0.312     2.253  100.000   88.571
LGA    Q   235_B      Q   235_B     0.354     0    0.030   0.813     2.526  100.000   87.143
LGA    G   236_B      G   236_B     0.363     0    0.058   0.058     0.467  100.000  100.000
LGA    W   237_B      W   237_B     0.292     0    0.012   0.063     0.362  100.000  100.000
LGA    L   238_B      L   238_B     0.395     0    0.043   0.094     0.613  100.000   96.429
LGA    Q   239_B      Q   239_B     0.584     0    0.036   0.470     1.678   95.238   90.635
LGA    S   240_B      S   240_B     0.327     0    0.037   0.054     0.427  100.000  100.000
LGA    P   241_B      P   241_B     0.372     0    0.036   0.053     0.405  100.000  100.000
LGA    V   242_B      V   242_B     0.257     0    0.027   0.083     0.328  100.000  100.000
LGA    Q   243_B      Q   243_B     0.286     0    0.025   0.134     1.283  100.000   94.762
LGA    I   244_B      I   244_B     0.277     0    0.032   0.065     0.365  100.000  100.000
LGA    D   245_B      D   245_B     0.373     0    0.031   0.267     0.900  100.000   96.429
LGA    L   246_B      L   246_B     0.351     0    0.030   0.144     0.626  100.000   98.810
LGA    P   247_B      P   247_B     0.441     0    0.015   0.020     0.548   95.238   97.279
LGA    G   248_B      G   248_B     0.586     0    0.075   0.075     0.762   90.476   90.476
LGA    G   249_B      G   249_B     0.519     0    0.025   0.025     0.526   90.476   90.476
LGA    R   250_B      R   250_B     0.469     0    0.039   0.665     2.836   95.238   79.134
LGA    L   251_B      L   251_B     0.201     0    0.036   0.041     0.325  100.000  100.000
LGA    H   252_B      H   252_B     0.206     0    0.022   1.147     2.456  100.000   90.095
LGA    I   253_B      I   253_B     0.191     0    0.007   0.047     0.302  100.000  100.000
LGA    E   254_B      E   254_B     0.241     0    0.012   0.233     1.447  100.000   92.751
LGA    W   255_B      W   255_B     0.178     0    0.032   0.058     0.232  100.000  100.000
LGA    A   256_B      A   256_B     0.383     0    0.048   0.057     0.597   97.619   96.190
LGA    G   257_B      G   257_B     0.370     0    0.029   0.029     0.386  100.000  100.000
LGA    P   258_B      P   258_B     0.596     0    0.017   0.036     0.727   92.857   91.837
LGA    G   259_B      G   259_B     0.676     0    0.018   0.018     0.676   90.476   90.476
LGA    Q   260_B      Q   260_B     0.385     0    0.034   0.243     0.668  100.000   96.825
LGA    P   261_B      P   261_B     0.234     0    0.028   0.057     0.433  100.000  100.000
LGA    V   262_B      V   262_B     0.181     0    0.032   0.049     0.335  100.000  100.000
LGA    M   263_B      M   263_B     0.158     0    0.041   0.144     0.740  100.000   98.810
LGA    M   264_B      M   264_B     0.154     0    0.079   0.111     0.481  100.000  100.000
LGA    T   265_B      T   265_B     0.131     0    0.023   0.065     0.244  100.000  100.000
LGA    G   266_B      G   266_B     0.076     0    0.032   0.032     0.188  100.000  100.000
LGA    P   267_B      P   267_B     0.109     0    0.045   0.157     0.512  100.000   98.639
LGA    A   268_B      A   268_B     0.176     0    0.055   0.055     0.260  100.000  100.000
LGA    V   269_B      V   269_B     0.230     0    0.036   0.130     0.742  100.000   98.639
LGA    R   270_B      R   270_B     0.354     5    0.019   0.048     0.622  100.000   52.814
LGA    V   271_B      V   271_B     0.499     0    0.043   0.082     0.822   95.238   95.918
LGA    Y   272_B      Y   272_B     0.662     0    0.034   0.112     0.751   90.476   92.063
LGA    E   273_B      E   273_B     0.608     0    0.033   0.168     1.341   90.476   89.471
LGA    G   274_B      G   274_B     0.925     0    0.063   0.063     0.925   90.476   90.476
LGA    Q   275_B      Q   275_B     0.560     0    0.036   0.751     4.238   92.857   75.873
LGA    V   276_B      V   276_B     0.732     0    0.064   1.191     3.048   88.214   80.884
LGA    R   277_B      R   277_B     0.777     0    0.059   1.329     4.032   90.476   77.359
LGA    L   278_B      L   278_B     0.942     0    0.046   1.008     2.953   83.810   74.464

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      278    1112   1112  100.00    2087   2087  100.00               278
SUMMARY(RMSD_GDC):     1.032          0.986                  1.349           93.355   88.639

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  278  278    4.0    275    0.75    96.673    98.334    32.432

LGA_LOCAL      RMSD:   0.748  Number of atoms:  275  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   1.037  Number of assigned atoms:  278 
Std_ASGN_ATOMS RMSD:   1.032  Standard rmsd on all 278 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.696443 * X  +   0.590308 * Y  +   0.408048 * Z  +  29.124596
  Y_new =   0.100540 * X  +   0.482746 * Y  +  -0.869970 * Z  + -15.069921
  Z_new =  -0.710534 * X  +   0.646910 * Y  +   0.276856 * Z  +  36.227119 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  0.143371  0.790257  1.166415   [DEG:    8.2146   45.2784   66.8307 ]
ZXZ:  0.438571  1.290276 -0.832235   [DEG:   25.1283   73.9274  -47.6835 ]
 
# END of job
