
#######################################################
#                                                     #
#                        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  256 ( 1915),  selected  240 , name one
# Molecule2: number of CA atoms  240 ( 1805),  selected  240 , 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:   131       4_A - 134_A       4.72    28.05
  LCS_AVERAGE:     52.88

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   127       4_A - 130_A       1.95    29.44
  LCS_AVERAGE:     50.37

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   102       4_A - 105_A       0.97    29.33
  LCS_AVERAGE:     27.59

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  240
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     E     4_A     E     4_A    102  127  131      8   35   87  108  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     V     5_A     V     5_A    102  127  131      9   64  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     Q     6_A     Q     6_A    102  127  131     26   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     L     7_A     L     7_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     V     8_A     V     8_A    102  127  131     49   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     Q     9_A     Q     9_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     S    10_A     S    10_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     G    11_A     G    11_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     A    12_A     A    12_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     E    13_A     E    13_A    102  127  131     49   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     V    14_A     V    14_A    102  127  131     38   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     K    15_A     K    15_A    102  127  131     29   86  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     K    16_A     K    16_A    102  127  131     29   85  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     P    17_A     P    17_A    102  127  131     25   86  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  129  131 
LCS_GDT     G    18_A     G    18_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  129  131 
LCS_GDT     S    19_A     S    19_A    102  127  131     20   86  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     S    20_A     S    20_A    102  127  131     22   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     V    21_A     V    21_A    102  127  131     46   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     K    22_A     K    22_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     V    23_A     V    23_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     S    24_A     S    24_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     C    25_A     C    25_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     K    26_A     K    26_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     A    27_A     A    27_A    102  127  131     49   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     S    28_A     S    28_A    102  127  131     12   86  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     G    29_A     G    29_A    102  127  131     11   64  101  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     G    30_A     G    30_A    102  127  131     11   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     T    31_A     T    31_A    102  127  131      3   23   65  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     F    32_A     F    32_A    102  127  131      3   12   45  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     N    33_A     N    33_A    102  127  131      4   18   29  109  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     R    34_A     R    34_A    102  127  131      6   86  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     Y    35_A     Y    35_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     T    36_A     T    36_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     V    37_A     V    37_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     N    38_A     N    38_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     W    39_A     W    39_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     V    40_A     V    40_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     R    41_A     R    41_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     Q    42_A     Q    42_A    102  127  131     22   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     A    43_A     A    43_A    102  127  131     38   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  131 
LCS_GDT     P    44_A     P    44_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  131 
LCS_GDT     G    45_A     G    45_A    102  127  131      9   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     Q    46_A     Q    46_A    102  127  131     49   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     G    47_A     G    47_A    102  127  131     13   57   98  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     L    48_A     L    48_A    102  127  131     36   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     E    49_A     E    49_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     W    50_A     W    50_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     M    51_A     M    51_A    102  127  131     47   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     G    52_A     G    52_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     G    53_A     G    53_A    102  127  131      9   86  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     I    54_A     I    54_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     I    55_A     I    55_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     P    56_A     P    56_A    102  127  131     20   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     I    57_A     I    57_A    102  127  131     15   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     F    58_A     F    58_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     G    59_A     G    59_A    102  127  131     40   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     T    60_A     T    60_A    102  127  131     31   86  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     A    61_A     A    61_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     N    62_A     N    62_A    102  127  131     47   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     Y    63_A     Y    63_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     A    64_A     A    64_A    102  127  131     46   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     Q    65_A     Q    65_A    102  127  131     25   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     R    66_A     R    66_A    102  127  131     20   86  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     F    67_A     F    67_A    102  127  131     20   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     Q    68_A     Q    68_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     G    69_A     G    69_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     R    70_A     R    70_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     L    71_A     L    71_A    102  127  131     35   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     T    72_A     T    72_A    102  127  131     35   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     I    73_A     I    73_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     T    74_A     T    74_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     A    75_A     A    75_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     D    76_A     D    76_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     E    77_A     E    77_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     S    78_A     S    78_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     T    79_A     T    79_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     S    80_A     S    80_A    102  127  131     28   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     T    81_A     T    81_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     A    82_A     A    82_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     Y    83_A     Y    83_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     M    84_A     M    84_A    102  127  131     49   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     E    85_A     E    85_A    102  127  131     42   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     L    86_A     L    86_A    102  127  131     35   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     S    87_A     S    87_A    102  127  131     26   86  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     S    88_A     S    88_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  129  131 
LCS_GDT     L    89_A     L    89_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  129  131 
LCS_GDT     R    90_A     R    90_A    102  127  131     20   85  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  129  131 
LCS_GDT     S    91_A     S    91_A    102  127  131      4   12   94  109  115  118  120  122  123  124  125  126  126  126  127  127  127  128  129  131 
LCS_GDT     D    92_A     D    92_A    102  127  131     14   77  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  129  131 
LCS_GDT     D    93_A     D    93_A    102  127  131     49   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  129  131 
LCS_GDT     T    94_A     T    94_A    102  127  131     49   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  129  131 
LCS_GDT     A    95_A     A    95_A    102  127  131     48   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  129  131 
LCS_GDT     V    96_A     V    96_A    102  127  131     48   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  129  131 
LCS_GDT     Y    97_A     Y    97_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     F    98_A     F    98_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     C    99_A     C    99_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     A   100_A     A   100_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     R   101_A     R   101_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     E   102_A     E   102_A    102  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     N   103_A     N   103_A    102  127  131     13   69  102  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     L   104_A     L   104_A    102  127  131     13   78  102  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     D   105_A     D   105_A    102  127  131     11   57   98  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     N   106_A     N   106_A     74  127  131      3   14   32   74   95  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     S   107_A     S   107_A      4  127  131      4    4    6   34  111  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     G   108_A     G   108_A      4  127  131      4    4    6   30   45  113  118  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     T   109_A     T   109_A      4  127  131      4    4    6    6    8   12   32   82   89  119  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     Y   110_A     Y   110_A      4  127  131      4    4    6    6   45   68   92  107  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     Y   111_A     Y   111_A      3  127  131      1    3    4    5   97  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     Y   112_A     Y   112_A      3  127  131      0   29   71  107  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     F   113_A     F   113_A      3  127  131      3    3   34   99  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     S   114_A     S   114_A      8  127  131      4    6   44   90  113  117  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     G   115_A     G   115_A     14  127  131      8   71  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     W   116_A     W   116_A     14  127  131      6   76  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     F   117_A     F   117_A     14  127  131      8   82  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     D   118_A     D   118_A     14  127  131      8   79  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     P   119_A     P   119_A     14  127  131     47   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     W   120_A     W   120_A     14  127  131     49   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     G   121_A     G   121_A     14  127  131     25   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     Q   122_A     Q   122_A     14  127  131     36   86  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     G   123_A     G   123_A     14  127  131     46   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     T   124_A     T   124_A     14  127  131     48   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  128  128 
LCS_GDT     L   125_A     L   125_A     14  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  129  131 
LCS_GDT     V   126_A     V   126_A     14  127  131     50   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  129  131 
LCS_GDT     T   127_A     T   127_A     14  127  131     49   87  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  129  131 
LCS_GDT     V   128_A     V   128_A     14  127  131     22   86  104  111  115  118  120  122  123  124  125  126  126  126  127  127  127  128  129  131 
LCS_GDT     S   129_A     S   129_A      8  127  131      4   21   45   83  111  117  120  122  123  124  125  126  126  126  127  127  127  128  129  131 
LCS_GDT     S   130_A     S   130_A      4  127  131      4    4    4    9   17   27   50   87   98  108  116  121  124  126  127  127  127  128  129  131 
LCS_GDT     Q   131_A     Q   131_A      4  114  131      3    3    4    5    6   15   37   85  102  108  111  114  117  117  120  122  125  128  129  131 
LCS_GDT     S   132_A     S   132_A      4  114  131      3    3    4   22   77   98  101  108  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     A   133_A     A   133_A      6  114  131      3    5    7   27   61   97  101  107  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     L   134_A     L   134_A     23  114  131     13   29   80   94   99  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     T   135_A     T   135_A     23  114  122     13   74   91   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     Q   136_A     Q   136_A     23  114  122     26   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     P   137_A     P   137_A     23  114  122     46   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     R   138_A     R   138_A     23  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     S   139_A     S   139_A     23  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     V   140_A     V   140_A     23  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     S   141_A     S   141_A     23  114  122     29   73   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     G   142_A     G   142_A     23  114  122     28   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     S   143_A     S   143_A     23  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     P   144_A     P   144_A     23  114  122     50   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     G   145_A     G   145_A     23  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     Q   146_A     Q   146_A     23  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     S   147_A     S   147_A     23  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     V   148_A     V   148_A     23  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     T   149_A     T   149_A     23  114  122     48   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     I   150_A     I   150_A     23  114  122     48   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     S   151_A     S   151_A     23  114  122     35   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     C   152_A     C   152_A     23  114  122     44   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     T   153_A     T   153_A     23  114  122     44   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     G   154_A     G   154_A     23  114  122     46   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     T   155_A     T   155_A     23  114  122      3   28   83   95   99  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     S   156_A     S   156_A     23  114  122      3   22   81   94   99  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     S   157_A     S   157_A      4  114  122      3    4   16   68   93  100  107  110  110  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     D   158_A     D   158_A      4  114  122      6   67   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     I   159_A     I   159_A      4  114  122     44   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     G   160_A     G   160_A      4  114  122      3    7   35   87  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     G   161_A     G   161_A     63  114  122      3    5   23   82   99  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     Y   162_A     Y   162_A     63  114  122      3    3   74   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     N   163_A     N   163_A     63  114  122      0   22   55   82   98  102  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     F   164_A     F   164_A     65  114  122     25   79   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     V   165_A     V   165_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     S   166_A     S   166_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     W   167_A     W   167_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     Y   168_A     Y   168_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     Q   169_A     Q   169_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     Q   170_A     Q   170_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     H   171_A     H   171_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     P   172_A     P   172_A     65  114  122     29   74   92   96  102  104  107  110  111  112  113  114  117  117  120  125  127  128  129  131 
LCS_GDT     G   173_A     G   173_A     65  114  122      5   75   92   96  102  104  107  110  111  112  113  114  117  117  120  122  124  128  129  131 
LCS_GDT     K   174_A     K   174_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     A   175_A     A   175_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     P   176_A     P   176_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     K   177_A     K   177_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     L   178_A     L   178_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     M   179_A     M   179_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     I   180_A     I   180_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     Y   181_A     Y   181_A     65  114  122     44   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     D   182_A     D   182_A     65  114  122      4   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     A   183_A     A   183_A     65  114  122      4   35   89   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     T   184_A     T   184_A     65  114  122     24   76   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     K   185_A     K   185_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     R   186_A     R   186_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     P   187_A     P   187_A     65  114  122     48   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     S   188_A     S   188_A     65  114  122     30   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     G   189_A     G   189_A     65  114  122     43   79   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     V   190_A     V   190_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     P   191_A     P   191_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     D   192_A     D   192_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     R   193_A     R   193_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     F   194_A     F   194_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     S   195_A     S   195_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     G   196_A     G   196_A     65  114  122     23   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     S   197_A     S   197_A     65  114  122     48   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     K   198_A     K   198_A     65  114  122     46   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     S   199_A     S   199_A     65  114  122     44   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     G   200_A     G   200_A     65  114  122     44   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     N   201_A     N   201_A     65  114  122     44   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     T   202_A     T   202_A     65  114  122     46   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     A   203_A     A   203_A     65  114  122     48   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     S   204_A     S   204_A     65  114  122     48   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     L   205_A     L   205_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     T   206_A     T   206_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     I   207_A     I   207_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     S   208_A     S   208_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     G   209_A     G   209_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     L   210_A     L   210_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     Q   211_A     Q   211_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     A   212_A     A   212_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     E   213_A     E   213_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     D   214_A     D   214_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     E   215_A     E   215_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     A   216_A     A   216_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     D   217_A     D   217_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     Y   218_A     Y   218_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     Y   219_A     Y   219_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     C   220_A     C   220_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     C   221_A     C   221_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     S   222_A     S   222_A     65  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     Y   223_A     Y   223_A     65  114  122     38   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     A   224_A     A   224_A     65  114  122      4   23   67   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     G   225_A     G   225_A     65  114  122      4   22   36   80  101  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     D   226_A     D   226_A     65  114  122     12   63   85   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     Y   227_A     Y   227_A     65  114  122      3    3    4   94  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     T   228_A     T   228_A     65  114  122      3    3   87   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     P   229_A     P   229_A      3  114  122      3   18   59   94   99  104  107  110  111  112  113  114  117  117  120  121  124  126  129  131 
LCS_GDT     G   230_A     G   230_A     14  114  122      4   47   76   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     V   231_A     V   231_A     14  114  122     36   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     V   232_A     V   232_A     14  114  122     38   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     F   233_A     F   233_A     14  114  122     38   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     G   234_A     G   234_A     14  114  122     33   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     G   235_A     G   235_A     14  114  122     20   79   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     G   236_A     G   236_A     14  114  122     31   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     T   237_A     T   237_A     14  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     K   238_A     K   238_A     14  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     L   239_A     L   239_A     14  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     T   240_A     T   240_A     14  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     V   241_A     V   241_A     14  114  122     51   82   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     L   242_A     L   242_A     14  114  122     16   75   92   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_GDT     G   243_A     G   243_A     14  114  122      4    5   81   96  102  104  107  110  111  112  113  114  117  117  120  122  125  128  129  131 
LCS_AVERAGE  LCS_A:  43.61  (  27.59   50.37   52.88 )

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     51     87    104    111    115    118    120    122    123    124    125    126    126    126    127    127    127    128    129    131 
GDT PERCENT_AT  21.25  36.25  43.33  46.25  47.92  49.17  50.00  50.83  51.25  51.67  52.08  52.50  52.50  52.50  52.92  52.92  52.92  53.33  53.75  54.58
GDT RMS_LOCAL    0.31   0.55   0.72   0.86   0.95   1.05   1.13   1.25   1.31   1.42   1.52   1.69   1.69   1.69   1.95   1.95   1.95   4.41   4.37   4.54
GDT RMS_ALL_AT  32.73  29.31  29.12  29.20  29.19  29.31  29.29  29.37  29.29  29.41  29.47  29.61  29.61  29.61  29.44  29.44  29.44  28.47  28.71  28.59

# Checking swapping
#   possible swapping detected:  E    13_A      E    13_A
#   possible swapping detected:  F    32_A      F    32_A
#   possible swapping detected:  Y    35_A      Y    35_A
#   possible swapping detected:  F    58_A      F    58_A
#   possible swapping detected:  Y    63_A      Y    63_A
#   possible swapping detected:  F    67_A      F    67_A
#   possible swapping detected:  E    77_A      E    77_A
#   possible swapping detected:  F    98_A      F    98_A
#   possible swapping detected:  E   102_A      E   102_A
#   possible swapping detected:  D   105_A      D   105_A
#   possible swapping detected:  Y   110_A      Y   110_A
#   possible swapping detected:  Y   111_A      Y   111_A
#   possible swapping detected:  F   113_A      F   113_A
#   possible swapping detected:  D   158_A      D   158_A
#   possible swapping detected:  F   164_A      F   164_A
#   possible swapping detected:  Y   168_A      Y   168_A
#   possible swapping detected:  D   182_A      D   182_A
#   possible swapping detected:  D   192_A      D   192_A
#   possible swapping detected:  E   213_A      E   213_A
#   possible swapping detected:  D   214_A      D   214_A
#   possible swapping detected:  D   217_A      D   217_A
#   possible swapping detected:  Y   218_A      Y   218_A
#   possible swapping detected:  D   226_A      D   226_A
#   possible swapping detected:  Y   227_A      Y   227_A
#   possible swapping detected:  F   233_A      F   233_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    E     4_A      E     4_A     2.753     0    0.193   0.276     3.650   55.595   60.952
LGA    V     5_A      V     5_A     1.820     0    0.012   0.070     2.399   75.119   74.218
LGA    Q     6_A      Q     6_A     0.923     0    0.018   0.373     2.102   85.952   79.683
LGA    L     7_A      L     7_A     0.386     0    0.044   0.050     0.478  100.000  100.000
LGA    V     8_A      V     8_A     0.456     0    0.043   0.087     0.757  100.000   97.279
LGA    Q     9_A      Q     9_A     0.263     0    0.058   0.213     1.324  100.000   93.704
LGA    S    10_A      S    10_A     0.271     0    0.037   0.119     0.632  100.000   98.413
LGA    G    11_A      G    11_A     0.276     0    0.015   0.015     0.378  100.000  100.000
LGA    A    12_A      A    12_A     0.446     0    0.064   0.077     0.542  100.000   98.095
LGA    E    13_A      E    13_A     0.483     0    0.022   0.382     2.583  100.000   88.148
LGA    V    14_A      V    14_A     0.809     0    0.055   0.156     1.514   90.476   86.667
LGA    K    15_A      K    15_A     1.128     0    0.062   0.444     1.807   81.429   83.492
LGA    K    16_A      K    16_A     1.444     0    0.031   0.314     2.881   83.690   73.280
LGA    P    17_A      P    17_A     1.152     0    0.033   0.044     1.647   83.690   80.272
LGA    G    18_A      G    18_A     0.508     0    0.070   0.070     0.692   90.476   90.476
LGA    S    19_A      S    19_A     1.062     0    0.068   0.155     1.306   88.214   85.952
LGA    S    20_A      S    20_A     0.964     0    0.048   0.183     1.636   90.476   86.032
LGA    V    21_A      V    21_A     0.606     0    0.035   0.061     0.729   90.476   91.837
LGA    K    22_A      K    22_A     0.525     0    0.075   0.517     3.895   92.857   76.984
LGA    V    23_A      V    23_A     0.444     0    0.070   0.128     1.065  100.000   94.626
LGA    S    24_A      S    24_A     0.382     0    0.050   0.083     0.671   97.619   95.238
LGA    C    25_A      C    25_A     0.352     0    0.087   0.090     0.727   97.619   98.413
LGA    K    26_A      K    26_A     0.102     0    0.011   0.438     1.796  100.000   94.921
LGA    A    27_A      A    27_A     0.459     0    0.034   0.042     0.615   97.619   96.190
LGA    S    28_A      S    28_A     1.335     0    0.617   0.792     4.261   68.452   71.508
LGA    G    29_A      G    29_A     1.681     0    0.218   0.218     1.681   79.286   79.286
LGA    G    30_A      G    30_A     0.824     0    0.192   0.192     1.067   88.214   88.214
LGA    T    31_A      T    31_A     2.025     0    0.025   0.129     3.578   77.381   67.823
LGA    F    32_A      F    32_A     2.096     0    0.036   1.336     3.644   70.952   68.398
LGA    N    33_A      N    33_A     2.225     0    0.020   1.041     4.617   66.786   56.964
LGA    R    34_A      R    34_A     1.514     0    0.112   1.701     8.798   75.119   51.602
LGA    Y    35_A      Y    35_A     0.610     0    0.117   0.178     2.589   90.595   79.008
LGA    T    36_A      T    36_A     0.457     0    0.100   1.188     2.716   97.619   86.395
LGA    V    37_A      V    37_A     0.400     0    0.028   0.095     0.580  100.000   97.279
LGA    N    38_A      N    38_A     0.437     0    0.049   0.425     1.149   97.619   94.167
LGA    W    39_A      W    39_A     0.558     0    0.023   0.058     0.610   90.476   90.476
LGA    V    40_A      V    40_A     0.557     0    0.020   0.029     0.616   95.238   93.197
LGA    R    41_A      R    41_A     0.437     0    0.092   0.562     1.438   95.238   90.606
LGA    Q    42_A      Q    42_A     1.155     0    0.050   0.117     1.876   85.952   80.582
LGA    A    43_A      A    43_A     0.884     0    0.054   0.063     1.242   88.214   86.857
LGA    P    44_A      P    44_A     0.483     0    0.050   0.326     1.052   95.238   91.905
LGA    G    45_A      G    45_A     0.747     0    0.110   0.110     0.747   95.238   95.238
LGA    Q    46_A      Q    46_A     0.402     0    0.459   0.524     1.864   90.833   86.667
LGA    G    47_A      G    47_A     2.008     0    0.052   0.052     2.008   75.119   75.119
LGA    L    48_A      L    48_A     1.029     0    0.043   0.115     1.430   83.690   83.690
LGA    E    49_A      E    49_A     0.555     0    0.029   0.143     0.971   95.238   93.651
LGA    W    50_A      W    50_A     0.500     0    0.022   0.133     0.698   95.238   95.918
LGA    M    51_A      M    51_A     0.576     0    0.041   0.187     0.959   90.476   90.476
LGA    G    52_A      G    52_A     0.359     0    0.056   0.056     0.560   97.619   97.619
LGA    G    53_A      G    53_A     1.169     0    0.048   0.048     1.169   88.214   88.214
LGA    I    54_A      I    54_A     0.530     0    0.047   0.132     0.868   92.857   91.667
LGA    I    55_A      I    55_A     0.122     0    0.039   0.452     2.355   97.619   92.024
LGA    P    56_A      P    56_A     0.891     0    0.687   0.711     3.521   78.810   85.170
LGA    I    57_A      I    57_A     0.827     0    0.044   1.046     2.926   85.952   77.857
LGA    F    58_A      F    58_A     0.470     0    0.103   0.770     3.220   97.619   83.939
LGA    G    59_A      G    59_A     0.547     0    0.182   0.182     1.379   90.595   90.595
LGA    T    60_A      T    60_A     0.941     0    0.012   0.064     1.535   92.857   85.510
LGA    A    61_A      A    61_A     0.391     0    0.007   0.018     0.667   95.238   94.286
LGA    N    62_A      N    62_A     0.542     0    0.016   1.113     3.634   95.238   83.571
LGA    Y    63_A      Y    63_A     0.235     0    0.042   0.383     1.125  100.000   94.563
LGA    A    64_A      A    64_A     0.627     0    0.051   0.052     0.718   90.476   90.476
LGA    Q    65_A      Q    65_A     0.760     0    0.059   0.807     2.759   90.476   80.952
LGA    R    66_A      R    66_A     1.170     0    0.030   1.479     6.530   83.690   65.281
LGA    F    67_A      F    67_A     0.776     0    0.047   0.179     0.868   90.476   90.476
LGA    Q    68_A      Q    68_A     0.334     0    0.026   0.364     1.790  100.000   93.810
LGA    G    69_A      G    69_A     0.383     0    0.052   0.052     0.418  100.000  100.000
LGA    R    70_A      R    70_A     0.365     0    0.129   0.268     1.246   92.976   95.714
LGA    L    71_A      L    71_A     1.006     0    0.069   0.950     3.682   88.214   73.988
LGA    T    72_A      T    72_A     0.973     0    0.067   1.084     2.661   90.476   81.905
LGA    I    73_A      I    73_A     0.541     0    0.022   0.144     0.788   92.857   91.667
LGA    T    74_A      T    74_A     0.367     0    0.061   1.234     2.998   97.619   87.483
LGA    A    75_A      A    75_A     0.362     0    0.036   0.037     0.422  100.000  100.000
LGA    D    76_A      D    76_A     0.213     0    0.070   0.439     1.421  100.000   97.679
LGA    E    77_A      E    77_A     0.331     0    0.020   1.188     5.377   97.619   71.217
LGA    S    78_A      S    78_A     0.529     0    0.182   0.196     1.331   90.595   89.048
LGA    T    79_A      T    79_A     0.687     0    0.034   1.021     2.809   92.857   82.313
LGA    S    80_A      S    80_A     0.788     0    0.058   0.186     2.146   90.476   84.683
LGA    T    81_A      T    81_A     0.324     0    0.080   0.968     2.535   97.619   88.639
LGA    A    82_A      A    82_A     0.298     0    0.020   0.030     0.464  100.000  100.000
LGA    Y    83_A      Y    83_A     0.277     0    0.043   0.095     0.573   97.619   98.413
LGA    M    84_A      M    84_A     0.639     0    0.027   0.593     2.286   95.238   87.440
LGA    E    85_A      E    85_A     0.698     0    0.017   0.521     2.085   90.476   85.608
LGA    L    86_A      L    86_A     1.024     0    0.051   1.055     4.509   83.690   73.155
LGA    S    87_A      S    87_A     1.163     0    0.377   0.619     3.442   71.429   73.492
LGA    S    88_A      S    88_A     0.366     0    0.113   0.806     2.693   97.619   89.683
LGA    L    89_A      L    89_A     0.446     0    0.008   0.079     0.643   95.238   96.429
LGA    R    90_A      R    90_A     1.212     0    0.055   1.201     5.803   85.952   61.645
LGA    S    91_A      S    91_A     2.451     0    0.698   0.633     4.345   55.952   53.968
LGA    D    92_A      D    92_A     1.674     0    0.063   0.739     2.071   77.143   77.202
LGA    D    93_A      D    93_A     0.589     0    0.052   0.146     0.911   95.238   94.048
LGA    T    94_A      T    94_A     0.700     0    0.049   0.064     1.112   90.476   89.184
LGA    A    95_A      A    95_A     0.680     0    0.042   0.070     0.788   90.476   90.476
LGA    V    96_A      V    96_A     0.729     0    0.014   0.034     1.094   90.476   89.184
LGA    Y    97_A      Y    97_A     0.477     0    0.049   0.068     0.566   97.619   99.206
LGA    F    98_A      F    98_A     0.641     0    0.038   0.137     0.914   92.857   91.342
LGA    C    99_A      C    99_A     0.469     0    0.059   0.074     0.552   97.619   96.825
LGA    A   100_A      A   100_A     0.570     0    0.057   0.076     0.769   90.476   90.476
LGA    R   101_A      R   101_A     0.349     0    0.017   0.901     3.753  100.000   90.563
LGA    E   102_A      E   102_A     0.232     0    0.055   0.954     3.435   92.976   80.370
LGA    N   103_A      N   103_A     1.686     0    0.328   0.954     3.146   72.976   66.071
LGA    L   104_A      L   104_A     1.564     0    0.032   0.854     4.481   72.857   68.452
LGA    D   105_A      D   105_A     2.560     0    0.043   1.019     4.498   57.262   58.631
LGA    N   106_A      N   106_A     4.558     0    0.206   1.244     9.021   47.381   30.952
LGA    S   107_A      S   107_A     3.393     0    0.484   0.670     5.142   40.714   37.619
LGA    G   108_A      G   108_A     6.192     0    0.458   0.458     8.939   16.071   16.071
LGA    T   109_A      T   109_A     9.073     0    0.244   0.952    12.511    3.452    1.973
LGA    Y   110_A      Y   110_A     6.410     0    0.549   1.431    12.753   17.262    8.294
LGA    Y   111_A      Y   111_A     3.722     0    0.612   1.454    13.675   43.452   20.794
LGA    Y   112_A      Y   112_A     2.869     0    0.571   1.415    11.408   47.619   27.738
LGA    F   113_A      F   113_A     2.842     0    0.678   1.059    11.941   71.310   29.784
LGA    S   114_A      S   114_A     3.480     0    0.083   0.186     6.345   49.762   39.603
LGA    G   115_A      G   115_A     2.031     0    0.081   0.081     2.298   68.810   68.810
LGA    W   116_A      W   116_A     1.965     0    0.094   1.137     7.391   72.857   43.810
LGA    F   117_A      F   117_A     1.462     0    0.113   0.366     2.545   71.071   82.684
LGA    D   118_A      D   118_A     1.473     0    0.454   0.913     3.871   69.762   60.893
LGA    P   119_A      P   119_A     0.526     0    0.146   0.211     1.780   88.214   82.857
LGA    W   120_A      W   120_A     0.433     0    0.055   0.058     0.869   95.238   93.197
LGA    G   121_A      G   121_A     0.832     0    0.073   0.073     0.832   92.857   92.857
LGA    Q   122_A      Q   122_A     1.363     0    0.653   0.915     4.428   68.452   66.878
LGA    G   123_A      G   123_A     1.045     0    0.103   0.103     1.045   88.214   88.214
LGA    T   124_A      T   124_A     0.772     0    0.039   0.063     0.893   90.476   90.476
LGA    L   125_A      L   125_A     0.541     0    0.057   0.189     0.770   95.238   95.238
LGA    V   126_A      V   126_A     0.279     0    0.013   0.033     0.502   97.619   98.639
LGA    T   127_A      T   127_A     0.633     0    0.050   0.171     0.903   92.857   91.837
LGA    V   128_A      V   128_A     1.297     0    0.533   0.649     1.712   81.548   82.925
LGA    S   129_A      S   129_A     4.735     0    0.725   0.837     8.994   20.357   21.508
LGA    S   130_A      S   130_A    11.150     0    0.094   0.730    13.310    0.714    0.476
LGA    Q   131_A      Q   131_A    17.961     0    0.088   0.743    22.008    0.000    0.000
LGA    S   132_A      S   132_A    21.467     0    0.063   0.733    25.320    0.000    0.000
LGA    A   133_A      A   133_A    28.276     0    0.611   0.596    31.033    0.000    0.000
LGA    L   134_A      L   134_A    32.996     0    0.071   1.380    38.548    0.000    0.000
LGA    T   135_A      T   135_A    34.082     0    0.077   0.064    37.472    0.000    0.000
LGA    Q   136_A      Q   136_A    34.503     0    0.036   0.286    34.503    0.000    0.000
LGA    P   137_A      P   137_A    34.793     0    0.030   0.306    37.898    0.000    0.000
LGA    R   138_A      R   138_A    28.604     0    0.069   0.827    31.162    0.000    0.000
LGA    S   139_A      S   139_A    29.925     0    0.065   0.543    34.493    0.000    0.000
LGA    V   140_A      V   140_A    34.848     0    0.032   0.106    37.467    0.000    0.000
LGA    S   141_A      S   141_A    35.293     0    0.084   0.700    39.695    0.000    0.000
LGA    G   142_A      G   142_A    38.380     0    0.023   0.023    38.380    0.000    0.000
LGA    S   143_A      S   143_A    38.115     0    0.030   0.040    40.202    0.000    0.000
LGA    P   144_A      P   144_A    36.818     0    0.082   0.121    40.829    0.000    0.000
LGA    G   145_A      G   145_A    43.383     0    0.049   0.049    47.372    0.000    0.000
LGA    Q   146_A      Q   146_A    46.206     0    0.024   0.892    48.608    0.000    0.000
LGA    S   147_A      S   147_A    47.754     0    0.038   0.714    51.017    0.000    0.000
LGA    V   148_A      V   148_A    44.501     0    0.028   1.132    45.503    0.000    0.000
LGA    T   149_A      T   149_A    46.098     0    0.037   0.078    50.654    0.000    0.000
LGA    I   150_A      I   150_A    41.401     0    0.051   0.070    43.805    0.000    0.000
LGA    S   151_A      S   151_A    44.217     0    0.026   0.731    46.725    0.000    0.000
LGA    C   152_A      C   152_A    41.795     0    0.109   0.652    45.638    0.000    0.000
LGA    T   153_A      T   153_A    44.245     0    0.046   0.097    46.680    0.000    0.000
LGA    G   154_A      G   154_A    44.089     0    0.072   0.072    45.923    0.000    0.000
LGA    T   155_A      T   155_A    45.981     0    0.670   0.651    47.957    0.000    0.000
LGA    S   156_A      S   156_A    51.706     0    0.218   0.618    54.124    0.000    0.000
LGA    S   157_A      S   157_A    52.516     0    0.161   0.685    53.073    0.000    0.000
LGA    D   158_A      D   158_A    49.435     0    0.482   0.797    50.579    0.000    0.000
LGA    I   159_A      I   159_A    51.432     0    0.134   0.755    55.712    0.000    0.000
LGA    G   160_A      G   160_A    58.499     0    0.613   0.613    60.802    0.000    0.000
LGA    G   161_A      G   161_A    62.001     0    0.573   0.573    63.523    0.000    0.000
LGA    Y   162_A      Y   162_A    61.549     0    0.673   1.052    61.549    0.000    0.000
LGA    N   163_A      N   163_A    58.303     0    0.674   1.223    59.480    0.000    0.000
LGA    F   164_A      F   164_A    54.547     0    0.343   0.354    62.100    0.000    0.000
LGA    V   165_A      V   165_A    49.682     0    0.085   0.117    52.018    0.000    0.000
LGA    S   166_A      S   166_A    45.676     0    0.037   0.058    46.639    0.000    0.000
LGA    W   167_A      W   167_A    40.353     0    0.021   0.049    45.486    0.000    0.000
LGA    Y   168_A      Y   168_A    34.587     0    0.081   1.229    41.306    0.000    0.000
LGA    Q   169_A      Q   169_A    29.779     0    0.020   0.730    31.813    0.000    0.000
LGA    Q   170_A      Q   170_A    23.351     0    0.043   0.234    25.291    0.000    0.000
LGA    H   171_A      H   171_A    18.548     0    0.066   0.214    24.664    0.000    0.000
LGA    P   172_A      P   172_A    11.935     0    0.654   0.615    13.937    0.000    0.068
LGA    G   173_A      G   173_A    15.640     0    0.031   0.031    19.809    0.000    0.000
LGA    K   174_A      K   174_A    21.609     0    0.059   0.752    23.548    0.000    0.000
LGA    A   175_A      A   175_A    26.225     0    0.042   0.041    28.783    0.000    0.000
LGA    P   176_A      P   176_A    28.441     0    0.014   0.321    32.417    0.000    0.000
LGA    K   177_A      K   177_A    34.354     0    0.067   1.183    37.226    0.000    0.000
LGA    L   178_A      L   178_A    40.253     0    0.013   0.800    46.536    0.000    0.000
LGA    M   179_A      M   179_A    42.251     0    0.015   0.233    46.606    0.000    0.000
LGA    I   180_A      I   180_A    47.993     0    0.025   0.623    50.912    0.000    0.000
LGA    Y   181_A      Y   181_A    51.843     0    0.368   1.460    57.541    0.000    0.000
LGA    D   182_A      D   182_A    56.565     0    0.178   1.083    61.199    0.000    0.000
LGA    A   183_A      A   183_A    54.904     0    0.043   0.044    56.519    0.000    0.000
LGA    T   184_A      T   184_A    58.745     0    0.061   0.102    63.073    0.000    0.000
LGA    K   185_A      K   185_A    58.847     0    0.294   0.930    67.886    0.000    0.000
LGA    R   186_A      R   186_A    53.961     0    0.071   0.768    58.876    0.000    0.000
LGA    P   187_A      P   187_A    53.152     0    0.063   0.277    53.321    0.000    0.000
LGA    S   188_A      S   188_A    54.884     0    0.665   0.832    57.009    0.000    0.000
LGA    G   189_A      G   189_A    48.852     0    0.023   0.023    51.239    0.000    0.000
LGA    V   190_A      V   190_A    46.485     0    0.038   0.053    50.115    0.000    0.000
LGA    P   191_A      P   191_A    47.433     0    0.039   0.084    49.122    0.000    0.000
LGA    D   192_A      D   192_A    53.091     0    0.082   1.194    56.825    0.000    0.000
LGA    R   193_A      R   193_A    48.862     0    0.062   1.233    49.793    0.000    0.000
LGA    F   194_A      F   194_A    47.354     0    0.077   0.087    51.287    0.000    0.000
LGA    S   195_A      S   195_A    52.682     0    0.085   0.111    54.957    0.000    0.000
LGA    G   196_A      G   196_A    53.284     0    0.115   0.115    57.898    0.000    0.000
LGA    S   197_A      S   197_A    57.804     0    0.048   0.083    59.377    0.000    0.000
LGA    K   198_A      K   198_A    58.327     0    0.030   0.732    62.723    0.000    0.000
LGA    S   199_A      S   199_A    61.758     0    0.033   0.074    64.839    0.000    0.000
LGA    G   200_A      G   200_A    60.890     0    0.001   0.001    61.873    0.000    0.000
LGA    N   201_A      N   201_A    53.676     0    0.006   1.025    56.388    0.000    0.000
LGA    T   202_A      T   202_A    51.818     0    0.050   0.133    54.545    0.000    0.000
LGA    A   203_A      A   203_A    50.519     0    0.017   0.026    50.519    0.000    0.000
LGA    S   204_A      S   204_A    49.307     0    0.044   0.105    51.511    0.000    0.000
LGA    L   205_A      L   205_A    46.070     0    0.012   0.143    46.775    0.000    0.000
LGA    T   206_A      T   206_A    48.079     0    0.019   0.025    51.878    0.000    0.000
LGA    I   207_A      I   207_A    44.515     0    0.074   0.129    45.674    0.000    0.000
LGA    S   208_A      S   208_A    48.343     0    0.248   0.859    52.711    0.000    0.000
LGA    G   209_A      G   209_A    44.988     0    0.017   0.017    46.350    0.000    0.000
LGA    L   210_A      L   210_A    38.432     0    0.026   1.312    41.092    0.000    0.000
LGA    Q   211_A      Q   211_A    32.919     0    0.022   0.703    38.326    0.000    0.000
LGA    A   212_A      A   212_A    25.780     0    0.008   0.010    28.348    0.000    0.000
LGA    E   213_A      E   213_A    25.331     0    0.031   0.916    31.839    0.000    0.000
LGA    D   214_A      D   214_A    28.984     0    0.021   1.075    34.574    0.000    0.000
LGA    E   215_A      E   215_A    23.414     0    0.060   0.987    25.090    0.000    0.000
LGA    A   216_A      A   216_A    21.750     0    0.072   0.109    23.524    0.000    0.000
LGA    D   217_A      D   217_A    22.210     0    0.034   0.859    25.076    0.000    0.000
LGA    Y   218_A      Y   218_A    28.946     0    0.042   1.214    31.740    0.000    0.000
LGA    Y   219_A      Y   219_A    30.708     0    0.021   0.113    34.802    0.000    0.000
LGA    C   220_A      C   220_A    36.955     0    0.077   0.632    39.567    0.000    0.000
LGA    C   221_A      C   221_A    39.140     0    0.067   0.093    43.785    0.000    0.000
LGA    S   222_A      S   222_A    44.476     0    0.018   0.588    45.246    0.000    0.000
LGA    Y   223_A      Y   223_A    48.287     0    0.064   1.181    52.671    0.000    0.000
LGA    A   224_A      A   224_A    47.327     0    0.147   0.142    49.667    0.000    0.000
LGA    G   225_A      G   225_A    54.408     0    0.228   0.228    54.581    0.000    0.000
LGA    D   226_A      D   226_A    56.631     0    0.297   1.197    62.385    0.000    0.000
LGA    Y   227_A      Y   227_A    51.795     0    0.652   0.572    60.710    0.000    0.000
LGA    T   228_A      T   228_A    45.874     0    0.596   0.622    48.225    0.000    0.000
LGA    P   229_A      P   229_A    42.991     0    0.668   0.621    43.944    0.000    0.000
LGA    G   230_A      G   230_A    43.297     0    0.336   0.336    44.380    0.000    0.000
LGA    V   231_A      V   231_A    40.505     0    0.113   1.068    41.668    0.000    0.000
LGA    V   232_A      V   232_A    35.779     0    0.120   1.066    38.021    0.000    0.000
LGA    F   233_A      F   233_A    32.042     0    0.037   0.188    34.037    0.000    0.000
LGA    G   234_A      G   234_A    30.524     0    0.040   0.040    31.416    0.000    0.000
LGA    G   235_A      G   235_A    25.005     0    0.676   0.676    27.290    0.000    0.000
LGA    G   236_A      G   236_A    24.529     0    0.048   0.048    25.307    0.000    0.000
LGA    T   237_A      T   237_A    27.417     0    0.028   0.042    31.492    0.000    0.000
LGA    K   238_A      K   238_A    23.935     0    0.032   1.100    27.386    0.000    0.000
LGA    L   239_A      L   239_A    27.751     0    0.016   0.066    32.870    0.000    0.000
LGA    T   240_A      T   240_A    26.302     0    0.012   0.251    30.488    0.000    0.000
LGA    V   241_A      V   241_A    28.705     0    0.063   0.119    29.803    0.000    0.000
LGA    L   242_A      L   242_A    30.737     0    0.234   1.048    33.442    0.000    0.000
LGA    G   243_A      G   243_A    29.201     0    0.490   0.490    31.854    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      240     960    960  100.00    1805   1805  100.00               240
SUMMARY(RMSD_GDC):    16.229         16.208                 16.764           44.631   42.193

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  256  240    4.0    122    1.25    46.562    48.747     9.066

LGA_LOCAL      RMSD:   1.246  Number of atoms:  122  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  29.370  Number of assigned atoms:  240 
Std_ASGN_ATOMS RMSD:  16.229  Standard rmsd on all 240 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.593171 * X  +  -0.439048 * Y  +  -0.674823 * Z  +  43.074734
  Y_new =   0.133363 * X  +   0.880215 * Y  +  -0.455452 * Z  + -63.062119
  Z_new =   0.793954 * X  +   0.180164 * Y  +   0.580670 * Z  +  60.278179 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  0.221153 -0.917285  0.300852   [DEG:   12.6712  -52.5566   17.2375 ]
ZXZ: -0.977101  0.951245  1.347655   [DEG:  -55.9838   54.5023   77.2149 ]
 
# END of job
