
#######################################################
#                                                     #
#                        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  240 ( 1805),  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:   132       4_A - 135_A       4.52    29.53
  LCS_AVERAGE:     52.56

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   109     135_A - 243_A       1.95    32.94
  LCS_AVERAGE:     40.19

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   106     138_A - 243_A       0.83    33.16
  LCS_AVERAGE:     30.71

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     27  104  132     68  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     V     5_A     V     5_A     27  104  132     15  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     Q     6_A     Q     6_A     27  104  132     14  100  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     L     7_A     L     7_A     27  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     V     8_A     V     8_A     27  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     Q     9_A     Q     9_A     27  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     S    10_A     S    10_A     27  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     G    11_A     G    11_A     27  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     A    12_A     A    12_A     27  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     E    13_A     E    13_A     27  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     V    14_A     V    14_A     27  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     K    15_A     K    15_A     27  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     K    16_A     K    16_A     27  104  132     85  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     P    17_A     P    17_A     27  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     G    18_A     G    18_A     27  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     S    19_A     S    19_A     27  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     S    20_A     S    20_A     27  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     V    21_A     V    21_A     27  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     K    22_A     K    22_A     27  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     V    23_A     V    23_A     27  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     S    24_A     S    24_A     27  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     C    25_A     C    25_A     27  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     K    26_A     K    26_A     27  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     A    27_A     A    27_A     27  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     S    28_A     S    28_A     27  104  132     29  100  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     G    29_A     G    29_A     27  104  132      7   26  105  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     G    30_A     G    30_A     27  104  132      6   36  103  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     T    31_A     T    31_A      5  104  132      3    4   11   58  115  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     F    32_A     F    32_A      4  104  132      3    3    6   14   18   30   53   93  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     N    33_A     N    33_A     72  104  132      5   19   54  104  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     R    34_A     R    34_A     72  104  132     11   84  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     Y    35_A     Y    35_A     72  104  132     44  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     T    36_A     T    36_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     V    37_A     V    37_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     N    38_A     N    38_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     W    39_A     W    39_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     V    40_A     V    40_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     R    41_A     R    41_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     Q    42_A     Q    42_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     A    43_A     A    43_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     P    44_A     P    44_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     G    45_A     G    45_A     72  104  132     45  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     Q    46_A     Q    46_A     72  104  132     85  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     G    47_A     G    47_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     L    48_A     L    48_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     E    49_A     E    49_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     W    50_A     W    50_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     M    51_A     M    51_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     G    52_A     G    52_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     G    53_A     G    53_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     I    54_A     I    54_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     I    55_A     I    55_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     P    56_A     P    56_A     72  104  132     71  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     I    57_A     I    57_A     72  104  132     22  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     F    58_A     F    58_A     72  104  132     50  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     G    59_A     G    59_A     72  104  132      4  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     T    60_A     T    60_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     A    61_A     A    61_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     N    62_A     N    62_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     Y    63_A     Y    63_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     A    64_A     A    64_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     Q    65_A     Q    65_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     R    66_A     R    66_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     F    67_A     F    67_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     Q    68_A     Q    68_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     G    69_A     G    69_A     72  104  132     84  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     R    70_A     R    70_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     L    71_A     L    71_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     T    72_A     T    72_A     72  104  132     85  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     I    73_A     I    73_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     T    74_A     T    74_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     A    75_A     A    75_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     D    76_A     D    76_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     E    77_A     E    77_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     S    78_A     S    78_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     T    79_A     T    79_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     S    80_A     S    80_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     T    81_A     T    81_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     A    82_A     A    82_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     Y    83_A     Y    83_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     M    84_A     M    84_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     E    85_A     E    85_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     L    86_A     L    86_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     S    87_A     S    87_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     S    88_A     S    88_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     L    89_A     L    89_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     R    90_A     R    90_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     S    91_A     S    91_A     72  104  132      4   86  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     D    92_A     D    92_A     72  104  132     16   99  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     D    93_A     D    93_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     T    94_A     T    94_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     A    95_A     A    95_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     V    96_A     V    96_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     Y    97_A     Y    97_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     F    98_A     F    98_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     C    99_A     C    99_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     A   100_A     A   100_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     R   101_A     R   101_A     72  104  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     E   102_A     E   102_A     72  104  132     39  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     N   103_A     N   103_A     72  104  132     38  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     L   104_A     L   104_A     72  104  132      3   40  101  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     D   105_A     D   105_A     72  104  132      6   13   29   59   94  112  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     N   106_A     N   106_A      6  104  132      6    8   12   15   44   65   93  113  119  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     S   107_A     S   107_A      6  104  132      3    8   10   13   19   30   56   85  103  119  122  124  125  125  126  127  127  128  129  129 
LCS_GDT     G   108_A     G   108_A      4   11  132      3    4    7   10   16   19   25   30   44   62   72  100  120  124  126  127  127  128  129  129 
LCS_GDT     T   109_A     T   109_A      4   11  132      3    6    7    8   13   16   19   26   44   54   89  100  121  124  126  127  127  128  129  129 
LCS_GDT     Y   110_A     Y   110_A      6   15  132      6    8   12   13   18   26   40   57   80  106  122  124  125  125  126  127  127  128  129  129 
LCS_GDT     Y   111_A     Y   111_A      7   16  132      6    8   12   17   30   51   82  113  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     Y   112_A     Y   112_A      9   19  132      6    8   23   49   77  111  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     F   113_A     F   113_A     17   19  132      6   13   82  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     S   114_A     S   114_A     17   19  132     19   93  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     G   115_A     G   115_A     17   19  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     W   116_A     W   116_A     17   19  132      4  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     F   117_A     F   117_A     17   19  132     85  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     D   118_A     D   118_A     17   19  132     76  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     P   119_A     P   119_A     17   19  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     W   120_A     W   120_A     17   19  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     G   121_A     G   121_A     17   19  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     Q   122_A     Q   122_A     17   19  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     G   123_A     G   123_A     17   19  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     T   124_A     T   124_A     17   19  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     L   125_A     L   125_A     17   19  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     V   126_A     V   126_A     17   19  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     T   127_A     T   127_A     17   19  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     V   128_A     V   128_A     17   19  132     86  101  110  114  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     S   129_A     S   129_A     17   19  132      4   53  109  113  116  117  119  119  121  122  123  124  125  125  126  127  127  128  129  129 
LCS_GDT     S   130_A     S   130_A      6   19  132      3    6   17   47   77  112  118  119  120  121  123  123  125  125  125  127  127  128  129  129 
LCS_GDT     Q   131_A     Q   131_A      6    8  132      3    6    6   10   19   40   54   69   94  112  119  123  124  125  125  126  127  128  129  129 
LCS_GDT     S   132_A     S   132_A      6    8  132      3    6    6    6    7    9    9   15   27   34   57   95  104  122  122  126  126  127  129  129 
LCS_GDT     A   133_A     A   133_A      6   11  132      4    6    6    8   11   11   14   20   27   31   36   42   62   68   84   93  112  118  121  128 
LCS_GDT     L   134_A     L   134_A      6   11  132      4    6    6    8   11   11   12   15   17   19   26   37   44   61   70   76   88  100  111  117 
LCS_GDT     T   135_A     T   135_A      5  109  132      4    5    6    8   11   16   22   36   47   54   66   85   89  105  109  110  113  116  119  123 
LCS_GDT     Q   136_A     Q   136_A      5  109  119      4    5    6    8   11   16   22   26   38   50   60   76   89  103  109  111  113  117  119  123 
LCS_GDT     P   137_A     P   137_A     89  109  119      3    5    6   16   34   60   86  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     R   138_A     R   138_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     S   139_A     S   139_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     V   140_A     V   140_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     S   141_A     S   141_A    106  109  119     15   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     G   142_A     G   142_A    106  109  119     19   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     S   143_A     S   143_A    106  109  119     27   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     P   144_A     P   144_A    106  109  119     52   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     G   145_A     G   145_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     Q   146_A     Q   146_A    106  109  119     47   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     S   147_A     S   147_A    106  109  119     39   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     V   148_A     V   148_A    106  109  119     47   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     T   149_A     T   149_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     I   150_A     I   150_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     S   151_A     S   151_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     C   152_A     C   152_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     T   153_A     T   153_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     G   154_A     G   154_A    106  109  119     66   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     T   155_A     T   155_A    106  109  119     66   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     S   156_A     S   156_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     S   157_A     S   157_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     D   158_A     D   158_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     I   159_A     I   159_A    106  109  119     65   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     G   160_A     G   160_A    106  109  119     54   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     G   161_A     G   161_A    106  109  119     50   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     Y   162_A     Y   162_A    106  109  119     52   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     N   163_A     N   163_A    106  109  119     70   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     F   164_A     F   164_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     V   165_A     V   165_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     S   166_A     S   166_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     W   167_A     W   167_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     Y   168_A     Y   168_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     Q   169_A     Q   169_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     Q   170_A     Q   170_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     H   171_A     H   171_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     P   172_A     P   172_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  117  119  125  127  128  128 
LCS_GDT     G   173_A     G   173_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  122 
LCS_GDT     K   174_A     K   174_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     A   175_A     A   175_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     P   176_A     P   176_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     K   177_A     K   177_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     L   178_A     L   178_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     M   179_A     M   179_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     I   180_A     I   180_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     Y   181_A     Y   181_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     D   182_A     D   182_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     A   183_A     A   183_A    106  109  119     70   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     T   184_A     T   184_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     K   185_A     K   185_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     R   186_A     R   186_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     P   187_A     P   187_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     S   188_A     S   188_A    106  109  119     47   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     G   189_A     G   189_A    106  109  119     47   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     V   190_A     V   190_A    106  109  119     42   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     P   191_A     P   191_A    106  109  119     33   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     D   192_A     D   192_A    106  109  119     33   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     R   193_A     R   193_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     F   194_A     F   194_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     S   195_A     S   195_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     G   196_A     G   196_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     S   197_A     S   197_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     K   198_A     K   198_A    106  109  119     54   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     S   199_A     S   199_A    106  109  119     47   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     G   200_A     G   200_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     N   201_A     N   201_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     T   202_A     T   202_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     A   203_A     A   203_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     S   204_A     S   204_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     L   205_A     L   205_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     T   206_A     T   206_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     I   207_A     I   207_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     S   208_A     S   208_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     G   209_A     G   209_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     L   210_A     L   210_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     Q   211_A     Q   211_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     A   212_A     A   212_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     E   213_A     E   213_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     D   214_A     D   214_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     E   215_A     E   215_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     A   216_A     A   216_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     D   217_A     D   217_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     Y   218_A     Y   218_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     Y   219_A     Y   219_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     C   220_A     C   220_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     C   221_A     C   221_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     S   222_A     S   222_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     Y   223_A     Y   223_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     A   224_A     A   224_A    106  109  119      9   95  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     G   225_A     G   225_A    106  109  119      1   95  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     D   226_A     D   226_A    106  109  119      2    5    7   80  104  105  105  107  107  108  110  111  113  114  115  115  116  120  121  123 
LCS_GDT     Y   227_A     Y   227_A    106  109  119      0   12   86  101  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     T   228_A     T   228_A    106  109  119      3    3    6   27   43   87  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     P   229_A     P   229_A    106  109  119      3   96  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     G   230_A     G   230_A    106  109  119      3   76  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     V   231_A     V   231_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     V   232_A     V   232_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     F   233_A     F   233_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     G   234_A     G   234_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     G   235_A     G   235_A    106  109  119     70   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     G   236_A     G   236_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     T   237_A     T   237_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     K   238_A     K   238_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     L   239_A     L   239_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     T   240_A     T   240_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     V   241_A     V   241_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     L   242_A     L   242_A    106  109  119     71   97  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_GDT     G   243_A     G   243_A    106  109  119     19   79  103  103  104  105  105  107  107  108  110  111  113  114  115  115  117  120  121  123 
LCS_AVERAGE  LCS_A:  41.15  (  30.71   40.19   52.56 )

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     86    101    110    114    116    117    119    119    121    122    123    124    125    125    126    127    127    128    129    129 
GDT PERCENT_AT  35.83  42.08  45.83  47.50  48.33  48.75  49.58  49.58  50.42  50.83  51.25  51.67  52.08  52.08  52.50  52.92  52.92  53.33  53.75  53.75
GDT RMS_LOCAL    0.28   0.40   0.55   0.74   0.83   0.90   1.19   1.19   1.50   1.69   1.77   2.16   2.22   2.22   2.72   2.77   2.77   2.94   3.16   3.16
GDT RMS_ALL_AT  30.14  30.15  30.13  30.18  30.18  30.18  30.29  30.29  30.34  30.42  30.32  30.63  30.53  30.53  30.96  30.87  30.87  30.69  30.50  30.50

# Checking swapping
#   possible swapping detected:  F    67_A      F    67_A
#   possible swapping detected:  E    85_A      E    85_A
#   possible swapping detected:  Y   111_A      Y   111_A
#   possible swapping detected:  Y   162_A      Y   162_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:  E   215_A      E   215_A
#   possible swapping detected:  D   217_A      D   217_A
#   possible swapping detected:  Y   223_A      Y   223_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     1.445     0    0.627   0.609     7.722   70.357   47.354
LGA    V     5_A      V     5_A     1.476     0    0.022   0.051     1.790   81.429   77.755
LGA    Q     6_A      Q     6_A     1.522     0    0.131   1.122     3.726   75.000   63.704
LGA    L     7_A      L     7_A     0.747     0    0.054   0.048     1.038   90.476   89.345
LGA    V     8_A      V     8_A     0.414     0    0.010   0.060     0.580   97.619   97.279
LGA    Q     9_A      Q     9_A     0.282     0    0.036   0.069     0.568  100.000   96.825
LGA    S    10_A      S    10_A     0.200     0    0.074   0.084     0.393  100.000  100.000
LGA    G    11_A      G    11_A     0.058     0    0.040   0.040     0.147  100.000  100.000
LGA    A    12_A      A    12_A     0.144     0    0.081   0.085     0.265  100.000  100.000
LGA    E    13_A      E    13_A     0.295     0    0.054   0.214     0.828  100.000   95.767
LGA    V    14_A      V    14_A     0.092     0    0.079   0.189     0.576  100.000   98.639
LGA    K    15_A      K    15_A     0.567     0    0.021   0.487     1.062   90.476   89.471
LGA    K    16_A      K    16_A     0.727     0    0.031   0.318     1.304   90.476   87.460
LGA    P    17_A      P    17_A     0.467     0    0.036   0.128     0.798   97.619   95.918
LGA    G    18_A      G    18_A     0.357     0    0.055   0.055     0.427  100.000  100.000
LGA    S    19_A      S    19_A     0.724     0    0.028   0.106     0.824   92.857   92.063
LGA    S    20_A      S    20_A     0.624     0    0.045   0.166     0.982   90.476   90.476
LGA    V    21_A      V    21_A     0.427     0    0.014   0.027     0.575   97.619   98.639
LGA    K    22_A      K    22_A     0.415     0    0.053   0.530     1.884   97.619   93.810
LGA    V    23_A      V    23_A     0.404     0    0.008   0.069     0.474  100.000  100.000
LGA    S    24_A      S    24_A     0.415     0    0.043   0.057     0.669   97.619   96.825
LGA    C    25_A      C    25_A     0.455     0    0.058   0.049     0.674   97.619   95.238
LGA    K    26_A      K    26_A     0.412     0    0.045   0.910     3.872  100.000   89.577
LGA    A    27_A      A    27_A     0.828     0    0.058   0.075     0.996   90.476   90.476
LGA    S    28_A      S    28_A     1.525     0    0.607   0.558     4.019   66.071   68.333
LGA    G    29_A      G    29_A     2.096     0    0.689   0.689     4.601   58.690   58.690
LGA    G    30_A      G    30_A     1.921     0    0.013   0.013     2.239   72.976   72.976
LGA    T    31_A      T    31_A     3.729     0    0.591   1.336     6.873   40.476   32.585
LGA    F    32_A      F    32_A     6.541     0    0.612   0.626    13.027   21.786    8.182
LGA    N    33_A      N    33_A     3.310     0    0.094   1.130     4.971   58.214   53.571
LGA    R    34_A      R    34_A     1.509     0    0.317   1.197     3.474   75.119   61.732
LGA    Y    35_A      Y    35_A     1.102     0    0.040   1.370     7.322   85.952   59.286
LGA    T    36_A      T    36_A     0.671     0    0.036   0.219     1.569   90.476   87.959
LGA    V    37_A      V    37_A     0.485     0    0.030   0.120     0.587   92.857   95.918
LGA    N    38_A      N    38_A     0.543     0    0.031   0.148     1.251   95.238   89.464
LGA    W    39_A      W    39_A     0.466     0    0.012   0.058     0.515   97.619   98.639
LGA    V    40_A      V    40_A     0.417     0    0.023   0.040     0.486  100.000  100.000
LGA    R    41_A      R    41_A     0.200     0    0.033   0.136     0.440  100.000  100.000
LGA    Q    42_A      Q    42_A     0.242     0    0.026   0.140     0.532  100.000   98.942
LGA    A    43_A      A    43_A     0.263     0    0.046   0.101     0.464  100.000  100.000
LGA    P    44_A      P    44_A     0.139     0    0.050   0.085     0.679   95.238   97.279
LGA    G    45_A      G    45_A     1.020     0    0.016   0.016     1.360   83.690   83.690
LGA    Q    46_A      Q    46_A     0.624     0    0.039   0.205     1.023   92.857   90.529
LGA    G    47_A      G    47_A     0.333     0    0.047   0.047     0.333  100.000  100.000
LGA    L    48_A      L    48_A     0.364     0    0.067   0.107     0.637   97.619   97.619
LGA    E    49_A      E    49_A     0.595     0    0.011   0.160     1.081   90.476   89.471
LGA    W    50_A      W    50_A     0.605     0    0.023   0.090     0.656   90.476   90.476
LGA    M    51_A      M    51_A     0.558     0    0.051   0.128     0.769   90.476   91.667
LGA    G    52_A      G    52_A     0.495     0    0.000   0.000     0.621   92.857   92.857
LGA    G    53_A      G    53_A     0.693     0    0.021   0.021     0.693   92.857   92.857
LGA    I    54_A      I    54_A     0.552     0    0.014   0.074     1.227   90.476   89.345
LGA    I    55_A      I    55_A     0.431     0    0.039   0.156     0.822   95.238   92.857
LGA    P    56_A      P    56_A     0.638     0    0.027   0.036     0.862   90.476   91.837
LGA    I    57_A      I    57_A     1.000     0    0.158   1.417     3.882   88.214   75.060
LGA    F    58_A      F    58_A     1.426     0    0.015   0.426     2.365   81.429   74.545
LGA    G    59_A      G    59_A     0.970     0    0.156   0.156     1.423   88.214   88.214
LGA    T    60_A      T    60_A     0.270     0    0.062   1.080     2.391  100.000   89.932
LGA    A    61_A      A    61_A     0.544     0    0.037   0.038     0.774   97.619   96.190
LGA    N    62_A      N    62_A     0.237     0    0.021   0.106     0.873   97.619   95.238
LGA    Y    63_A      Y    63_A     0.249     0    0.029   0.170     0.890  100.000   97.619
LGA    A    64_A      A    64_A     0.417     0    0.057   0.075     0.451  100.000  100.000
LGA    Q    65_A      Q    65_A     0.754     0    0.091   0.600     3.543   90.476   74.286
LGA    R    66_A      R    66_A     0.208     0    0.104   1.467     7.154  100.000   71.039
LGA    F    67_A      F    67_A     0.351     0    0.023   0.098     0.468  100.000  100.000
LGA    Q    68_A      Q    68_A     0.116     0    0.074   1.294     4.602  100.000   81.534
LGA    G    69_A      G    69_A     0.350     0    0.033   0.033     0.390  100.000  100.000
LGA    R    70_A      R    70_A     0.637     0    0.090   1.174     2.695   92.857   84.242
LGA    L    71_A      L    71_A     0.541     0    0.017   0.311     1.397   90.476   90.536
LGA    T    72_A      T    72_A     0.891     0    0.077   1.027     2.294   90.476   82.993
LGA    I    73_A      I    73_A     0.581     0    0.025   0.130     0.793   90.476   91.667
LGA    T    74_A      T    74_A     0.471     0    0.015   0.200     0.781  100.000   98.639
LGA    A    75_A      A    75_A     0.504     0    0.034   0.057     0.569   92.857   94.286
LGA    D    76_A      D    76_A     0.573     0    0.057   0.322     0.962   90.476   91.667
LGA    E    77_A      E    77_A     0.617     0    0.107   1.078     4.811   90.476   73.915
LGA    S    78_A      S    78_A     0.785     0    0.028   0.070     1.037   90.476   88.968
LGA    T    79_A      T    79_A     0.957     0    0.011   0.997     2.719   90.476   82.041
LGA    S    80_A      S    80_A     0.666     0    0.040   0.672     3.025   90.476   83.730
LGA    T    81_A      T    81_A     0.513     0    0.048   0.068     0.785   97.619   94.558
LGA    A    82_A      A    82_A     0.297     0    0.030   0.043     0.420  100.000  100.000
LGA    Y    83_A      Y    83_A     0.269     0    0.008   0.065     0.859  100.000   96.032
LGA    M    84_A      M    84_A     0.268     0    0.017   0.637     1.935  100.000   95.417
LGA    E    85_A      E    85_A     0.292     0    0.016   0.556     2.814  100.000   88.095
LGA    L    86_A      L    86_A     0.386     0    0.012   0.085     0.645  100.000   96.429
LGA    S    87_A      S    87_A     0.626     0    0.018   0.675     2.038   92.857   87.778
LGA    S    88_A      S    88_A     0.638     0    0.047   0.286     1.289   90.476   88.968
LGA    L    89_A      L    89_A     0.540     0    0.030   0.114     0.662   90.476   92.857
LGA    R    90_A      R    90_A     0.411     0    0.067   1.208     4.406   92.857   69.091
LGA    S    91_A      S    91_A     1.552     0    0.111   0.621     2.464   83.810   77.460
LGA    D    92_A      D    92_A     1.165     0    0.129   0.977     2.085   83.690   80.536
LGA    D    93_A      D    93_A     0.314     0    0.011   0.221     0.748   95.238   97.619
LGA    T    94_A      T    94_A     0.297     0    0.035   0.067     0.635  100.000   98.639
LGA    A    95_A      A    95_A     0.141     0    0.035   0.042     0.295  100.000  100.000
LGA    V    96_A      V    96_A     0.147     0    0.021   0.043     0.363  100.000  100.000
LGA    Y    97_A      Y    97_A     0.323     0    0.026   0.063     0.385  100.000  100.000
LGA    F    98_A      F    98_A     0.419     0    0.040   0.080     0.445  100.000  100.000
LGA    C    99_A      C    99_A     0.527     0    0.023   0.035     0.602   90.476   90.476
LGA    A   100_A      A   100_A     0.557     0    0.052   0.084     0.557   90.476   90.476
LGA    R   101_A      R   101_A     0.594     0    0.053   0.447     2.770   90.476   81.775
LGA    E   102_A      E   102_A     1.203     0    0.076   0.241     1.910   81.429   77.619
LGA    N   103_A      N   103_A     0.899     0    0.040   1.086     3.087   88.214   78.750
LGA    L   104_A      L   104_A     2.337     0    0.049   1.017     4.586   65.595   58.333
LGA    D   105_A      D   105_A     5.925     0    0.047   0.473     8.203   19.881   15.595
LGA    N   106_A      N   106_A     9.139     0    0.192   0.899    10.359    1.548    1.726
LGA    S   107_A      S   107_A    12.212     0    0.681   0.682    13.994    0.000    0.000
LGA    G   108_A      G   108_A    15.484     0    0.391   0.391    16.344    0.000    0.000
LGA    T   109_A      T   109_A    15.604     0    0.140   0.984    17.871    0.000    0.000
LGA    Y   110_A      Y   110_A    11.720     0    0.282   1.387    15.563    0.119    0.079
LGA    Y   111_A      Y   111_A     8.156     0    0.039   0.315     9.624    5.595    4.563
LGA    Y   112_A      Y   112_A     5.686     0    0.080   0.375    10.489   27.262   15.357
LGA    F   113_A      F   113_A     2.483     0    0.102   0.796     3.824   63.095   52.987
LGA    S   114_A      S   114_A     1.128     0    0.039   0.615     2.882   85.952   80.397
LGA    G   115_A      G   115_A     0.783     0    0.247   0.247     0.970   92.857   92.857
LGA    W   116_A      W   116_A     1.582     0    0.094   0.150     1.770   79.286   77.143
LGA    F   117_A      F   117_A     0.911     0    0.027   0.129     1.149   88.214   88.009
LGA    D   118_A      D   118_A     0.988     0    0.540   0.977     6.498   78.095   57.143
LGA    P   119_A      P   119_A     0.493     0    0.132   0.208     1.750   97.619   89.456
LGA    W   120_A      W   120_A     0.481     0    0.044   0.077     0.707  100.000   96.599
LGA    G   121_A      G   121_A     0.465     0    0.020   0.020     0.517   97.619   97.619
LGA    Q   122_A      Q   122_A     0.360     0    0.023   0.121     0.430  100.000  100.000
LGA    G   123_A      G   123_A     0.333     0    0.029   0.029     0.357  100.000  100.000
LGA    T   124_A      T   124_A     0.485     0    0.047   0.084     0.733  100.000   95.918
LGA    L   125_A      L   125_A     0.244     0    0.046   0.181     0.658  100.000   97.619
LGA    V   126_A      V   126_A     0.189     0    0.016   0.039     0.258  100.000  100.000
LGA    T   127_A      T   127_A     0.361     0    0.010   0.139     0.462  100.000  100.000
LGA    V   128_A      V   128_A     0.496     0    0.543   0.568     2.084   88.810   88.231
LGA    S   129_A      S   129_A     2.212     0    0.610   0.548     4.925   53.095   60.000
LGA    S   130_A      S   130_A     5.983     0    0.136   0.455     8.208   17.619   22.540
LGA    Q   131_A      Q   131_A    11.085     0    0.325   1.436    15.885    0.357    0.159
LGA    S   132_A      S   132_A    13.578     0    0.094   0.674    16.963    0.000    0.000
LGA    A   133_A      A   133_A    18.847     0    0.601   0.568    22.977    0.000    0.000
LGA    L   134_A      L   134_A    22.203     0    0.196   0.199    22.985    0.000    0.000
LGA    T   135_A      T   135_A    26.414     0    0.075   0.132    30.042    0.000    0.000
LGA    Q   136_A      Q   136_A    27.409     0    0.073   1.160    29.092    0.000    0.000
LGA    P   137_A      P   137_A    30.217     0    0.026   0.078    30.565    0.000    0.000
LGA    R   138_A      R   138_A    30.995     0    0.612   1.387    34.912    0.000    0.000
LGA    S   139_A      S   139_A    32.091     0    0.050   0.094    36.797    0.000    0.000
LGA    V   140_A      V   140_A    36.621     0    0.067   0.997    40.291    0.000    0.000
LGA    S   141_A      S   141_A    35.998     0    0.056   0.128    40.251    0.000    0.000
LGA    G   142_A      G   142_A    39.026     0    0.083   0.083    39.026    0.000    0.000
LGA    S   143_A      S   143_A    38.799     0    0.050   0.144    41.156    0.000    0.000
LGA    P   144_A      P   144_A    37.544     0    0.120   0.172    41.581    0.000    0.000
LGA    G   145_A      G   145_A    43.906     0    0.142   0.142    48.270    0.000    0.000
LGA    Q   146_A      Q   146_A    47.971     0    0.022   1.016    50.377    0.000    0.000
LGA    S   147_A      S   147_A    49.847     0    0.047   0.579    53.019    0.000    0.000
LGA    V   148_A      V   148_A    46.757     0    0.016   0.076    47.518    0.000    0.000
LGA    T   149_A      T   149_A    48.565     0    0.025   0.158    53.130    0.000    0.000
LGA    I   150_A      I   150_A    43.868     0    0.018   0.039    46.098    0.000    0.000
LGA    S   151_A      S   151_A    47.137     0    0.085   0.662    49.230    0.000    0.000
LGA    C   152_A      C   152_A    45.027     0    0.035   0.079    48.860    0.000    0.000
LGA    T   153_A      T   153_A    47.893     0    0.043   0.101    50.575    0.000    0.000
LGA    G   154_A      G   154_A    47.635     0    0.030   0.030    50.786    0.000    0.000
LGA    T   155_A      T   155_A    51.843     0    0.048   0.134    54.304    0.000    0.000
LGA    S   156_A      S   156_A    58.217     0    0.061   0.151    60.280    0.000    0.000
LGA    S   157_A      S   157_A    55.035     0    0.112   0.237    55.410    0.000    0.000
LGA    D   158_A      D   158_A    51.817     0    0.081   0.227    55.273    0.000    0.000
LGA    I   159_A      I   159_A    54.151     0    0.049   0.290    58.800    0.000    0.000
LGA    G   160_A      G   160_A    60.323     0    0.082   0.082    64.469    0.000    0.000
LGA    G   161_A      G   161_A    62.489     0    0.172   0.172    65.220    0.000    0.000
LGA    Y   162_A      Y   162_A    62.748     0    0.082   1.112    67.224    0.000    0.000
LGA    N   163_A      N   163_A    62.399     0    0.020   0.863    67.003    0.000    0.000
LGA    F   164_A      F   164_A    56.626     0    0.087   0.456    63.646    0.000    0.000
LGA    V   165_A      V   165_A    51.635     0    0.031   0.143    53.879    0.000    0.000
LGA    S   166_A      S   166_A    47.084     0    0.039   0.079    48.152    0.000    0.000
LGA    W   167_A      W   167_A    41.700     0    0.036   0.119    47.459    0.000    0.000
LGA    Y   168_A      Y   168_A    35.556     0    0.046   1.245    41.993    0.000    0.000
LGA    Q   169_A      Q   169_A    30.709     0    0.018   0.055    32.777    0.000    0.000
LGA    Q   170_A      Q   170_A    23.768     0    0.028   0.186    25.991    0.000    0.000
LGA    H   171_A      H   171_A    18.802     0    0.022   0.094    24.779    0.000    0.000
LGA    P   172_A      P   172_A    12.114     0    0.044   0.064    14.202    0.000    0.068
LGA    G   173_A      G   173_A    14.349     0    0.039   0.039    18.761    0.000    0.000
LGA    K   174_A      K   174_A    20.971     0    0.037   0.367    22.486    0.000    0.000
LGA    A   175_A      A   175_A    25.992     0    0.030   0.036    28.580    0.000    0.000
LGA    P   176_A      P   176_A    28.800     0    0.095   0.101    32.686    0.000    0.000
LGA    K   177_A      K   177_A    34.470     0    0.040   0.647    37.836    0.000    0.000
LGA    L   178_A      L   178_A    40.737     0    0.066   0.197    47.676    0.000    0.000
LGA    M   179_A      M   179_A    43.396     0    0.006   0.597    47.821    0.000    0.000
LGA    I   180_A      I   180_A    49.151     0    0.014   0.076    51.888    0.000    0.000
LGA    Y   181_A      Y   181_A    53.124     0    0.030   0.292    61.226    0.000    0.000
LGA    D   182_A      D   182_A    59.229     0    0.037   1.108    65.048    0.000    0.000
LGA    A   183_A      A   183_A    57.750     0    0.068   0.078    59.956    0.000    0.000
LGA    T   184_A      T   184_A    59.867     0    0.041   1.212    64.334    0.000    0.000
LGA    K   185_A      K   185_A    59.905     0    0.027   0.097    68.538    0.000    0.000
LGA    R   186_A      R   186_A    55.055     0    0.046   0.813    58.474    0.000    0.000
LGA    P   187_A      P   187_A    53.703     0    0.080   0.311    53.912    0.000    0.000
LGA    S   188_A      S   188_A    55.398     0    0.083   0.516    58.840    0.000    0.000
LGA    G   189_A      G   189_A    49.710     0    0.017   0.017    52.205    0.000    0.000
LGA    V   190_A      V   190_A    47.078     0    0.018   0.133    50.557    0.000    0.000
LGA    P   191_A      P   191_A    47.584     0    0.085   0.137    49.477    0.000    0.000
LGA    D   192_A      D   192_A    53.591     0    0.051   0.880    56.232    0.000    0.000
LGA    R   193_A      R   193_A    49.496     0    0.050   0.176    50.493    0.000    0.000
LGA    F   194_A      F   194_A    48.196     0    0.032   0.207    52.334    0.000    0.000
LGA    S   195_A      S   195_A    54.102     0    0.015   0.061    56.473    0.000    0.000
LGA    G   196_A      G   196_A    55.103     0    0.015   0.015    59.766    0.000    0.000
LGA    S   197_A      S   197_A    59.984     0    0.021   0.081    61.523    0.000    0.000
LGA    K   198_A      K   198_A    60.735     0    0.062   0.716    65.377    0.000    0.000
LGA    S   199_A      S   199_A    64.968     0    0.042   0.046    68.262    0.000    0.000
LGA    G   200_A      G   200_A    64.909     0    0.046   0.046    65.624    0.000    0.000
LGA    N   201_A      N   201_A    57.775     0    0.042   0.049    60.480    0.000    0.000
LGA    T   202_A      T   202_A    55.150     0    0.042   0.079    57.594    0.000    0.000
LGA    A   203_A      A   203_A    53.214     0    0.004   0.000    53.245    0.000    0.000
LGA    S   204_A      S   204_A    51.811     0    0.021   0.066    54.597    0.000    0.000
LGA    L   205_A      L   205_A    48.001     0    0.027   0.099    48.847    0.000    0.000
LGA    T   206_A      T   206_A    49.919     0    0.026   0.042    54.213    0.000    0.000
LGA    I   207_A      I   207_A    45.611     0    0.015   0.134    47.008    0.000    0.000
LGA    S   208_A      S   208_A    49.214     0    0.036   0.675    53.110    0.000    0.000
LGA    G   209_A      G   209_A    45.891     0    0.047   0.047    47.569    0.000    0.000
LGA    L   210_A      L   210_A    39.515     0    0.051   0.163    42.186    0.000    0.000
LGA    Q   211_A      Q   211_A    33.239     0    0.006   0.414    38.792    0.000    0.000
LGA    A   212_A      A   212_A    26.056     0    0.028   0.031    28.596    0.000    0.000
LGA    E   213_A      E   213_A    25.111     0    0.014   0.390    31.997    0.000    0.000
LGA    D   214_A      D   214_A    29.631     0    0.021   1.097    35.294    0.000    0.000
LGA    E   215_A      E   215_A    24.289     0    0.072   1.067    25.915    0.000    0.000
LGA    A   216_A      A   216_A    22.610     0    0.051   0.082    24.734    0.000    0.000
LGA    D   217_A      D   217_A    23.469     0    0.018   1.075    26.167    0.000    0.000
LGA    Y   218_A      Y   218_A    30.309     0    0.019   1.258    32.781    0.000    0.000
LGA    Y   219_A      Y   219_A    32.171     0    0.058   0.141    36.096    0.000    0.000
LGA    C   220_A      C   220_A    38.861     0    0.020   0.111    40.680    0.000    0.000
LGA    C   221_A      C   221_A    40.619     0    0.080   0.133    45.201    0.000    0.000
LGA    S   222_A      S   222_A    46.359     0    0.017   0.103    49.920    0.000    0.000
LGA    Y   223_A      Y   223_A    49.619     0    0.094   1.347    55.990    0.000    0.000
LGA    A   224_A      A   224_A    48.453     0    0.535   0.546    50.546    0.000    0.000
LGA    G   225_A      G   225_A    54.392     0    0.585   0.585    54.392    0.000    0.000
LGA    D   226_A      D   226_A    53.602     0    0.573   1.158    54.109    0.000    0.000
LGA    Y   227_A      Y   227_A    52.809     0    0.596   1.211    63.987    0.000    0.000
LGA    T   228_A      T   228_A    48.861     0    0.253   1.060    49.592    0.000    0.000
LGA    P   229_A      P   229_A    49.049     0    0.047   0.090    52.218    0.000    0.000
LGA    G   230_A      G   230_A    43.618     0    0.057   0.057    45.814    0.000    0.000
LGA    V   231_A      V   231_A    41.420     0    0.100   1.244    41.808    0.000    0.000
LGA    V   232_A      V   232_A    37.196     0    0.024   0.035    40.855    0.000    0.000
LGA    F   233_A      F   233_A    33.642     0    0.015   0.064    34.376    0.000    0.000
LGA    G   234_A      G   234_A    33.311     0    0.024   0.024    33.785    0.000    0.000
LGA    G   235_A      G   235_A    27.536     0    0.047   0.047    30.086    0.000    0.000
LGA    G   236_A      G   236_A    27.279     0    0.055   0.055    28.310    0.000    0.000
LGA    T   237_A      T   237_A    29.715     0    0.036   0.068    34.160    0.000    0.000
LGA    K   238_A      K   238_A    25.496     0    0.021   0.361    28.994    0.000    0.000
LGA    L   239_A      L   239_A    29.127     0    0.062   0.194    34.288    0.000    0.000
LGA    T   240_A      T   240_A    27.275     0    0.028   0.211    31.405    0.000    0.000
LGA    V   241_A      V   241_A    29.262     0    0.055   0.099    30.221    0.000    0.000
LGA    L   242_A      L   242_A    31.238     0    0.039   1.123    34.236    0.000    0.000
LGA    G   243_A      G   243_A    28.673     0    0.492   0.492    28.946    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):    17.381         17.335                 17.866           44.999   43.145

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  240  240    4.0    119    1.19    48.021    46.677     9.243

LGA_LOCAL      RMSD:   1.187  Number of atoms:  119  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  30.287  Number of assigned atoms:  240 
Std_ASGN_ATOMS RMSD:  17.381  Standard rmsd on all 240 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.332142 * X  +  -0.291923 * Y  +  -0.896918 * Z  +  27.129339
  Y_new =   0.931527 * X  +  -0.047801 * Y  +   0.360516 * Z  + -89.003067
  Z_new =  -0.148117 * X  +  -0.955247 * Y  +   0.256057 * Z  +  74.461639 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  1.228292  0.148664 -1.308900   [DEG:   70.3760    8.5178  -74.9944 ]
ZXZ: -1.952983  1.311855 -2.987762   [DEG: -111.8977   75.1638 -171.1861 ]
 
# END of job
