
#######################################################
#                                                     #
#                        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  205 ( 1624),  selected  205 , name one
# Molecule2: number of CA atoms  205 ( 1624),  selected  205 , 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       1_A - 132_A       4.14    85.63
  LONGEST_CONTINUOUS_SEGMENT:   132       2_A - 133_A       4.95    85.44
  LCS_AVERAGE:     43.87

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   127       1_A - 127_A       2.00    86.42
  LCS_AVERAGE:     39.95

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    44       4_A - 47_A        0.99    85.77
  LONGEST_CONTINUOUS_SEGMENT:    44      50_A - 93_A        1.00    87.02
  LCS_AVERAGE:     12.26

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  205
LCS_GDT     RESIDUE       RESIDUE       SEGMENT_SIZE    GLOBAL DISTANCE TEST COLUMNS: number of residues under the threshold assigned to each residue pair
LCS_GDT   NAME NUMBER   NAME NUMBER    1.0  2.0  5.0    0.5  1.0  1.5  2.0  2.5  3.0  3.5  4.0  4.5  5.0  5.5  6.0  6.5  7.0  7.5  8.0  8.5  9.0  9.5 10.0
LCS_GDT     S     1_A     S     1_A      4  127  132      3    3    4    7   16   22   28   58   68  122  124  124  125  126  126  126  128  128  128  129 
LCS_GDT     M     2_A     M     2_A      4  127  132      3    3    5   14   21   98  109  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     N     3_A     N     3_A      4  127  132      3    6   17   53   78  109  118  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     I     4_A     I     4_A     44  127  132      7   48   98  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     E     5_A     E     5_A     44  127  132     24   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     V     6_A     V     6_A     44  127  132     25   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     A     7_A     A     7_A     44  127  132     11   72  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     R     8_A     R     8_A     44  127  132     12   72  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     A     9_A     A     9_A     44  127  132     27   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     A    10_A     A    10_A     44  127  132     27   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     R    11_A     R    11_A     44  127  132     28   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     L    12_A     L    12_A     44  127  132     21   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     A    13_A     A    13_A     44  127  132     29   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     Q    14_A     Q    14_A     44  127  132     25   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     I    15_A     I    15_A     44  127  132     21   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     F    16_A     F    16_A     44  127  132     21   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     K    17_A     K    17_A     44  127  132     20   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     E    18_A     E    18_A     44  127  132     20   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     I    19_A     I    19_A     44  127  132     28   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     C    20_A     C    20_A     44  127  132     28   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     D    21_A     D    21_A     44  127  132     28   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     G    22_A     G    22_A     44  127  132     29   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     I    23_A     I    23_A     44  127  132     29   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     I    24_A     I    24_A     44  127  132     26   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     S    25_A     S    25_A     44  127  132     25   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     Y    26_A     Y    26_A     44  127  132     26   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     R    27_A     R    27_A     44  127  132     26   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     D    28_A     D    28_A     44  127  132     23   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     S    29_A     S    29_A     44  127  132     15   71  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     S    30_A     S    30_A     44  127  132      7   57   98  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     Q    31_A     Q    31_A     44  127  132      7   73  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     Q    32_A     Q    32_A     44  127  132      6   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     T    33_A     T    33_A     44  127  132      6   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     L    34_A     L    34_A     44  127  132     26   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     A    35_A     A    35_A     44  127  132     18   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     A    36_A     A    36_A     44  127  132     24   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     P    37_A     P    37_A     44  127  132     20   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     L    38_A     L    38_A     44  127  132     20   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     L    39_A     L    39_A     44  127  132     15   71  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     N    40_A     N    40_A     44  127  132     25   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     L    41_A     L    41_A     44  127  132     21   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     P    42_A     P    42_A     44  127  132     28   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     P    43_A     P    43_A     44  127  132      3   38   94  111  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     K    44_A     K    44_A     44  127  132     20   74   99  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     K    45_A     K    45_A     44  127  132     29   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     K    46_A     K    46_A     44  127  132     14   66  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     N    47_A     N    47_A     44  127  132     22   71  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     A    48_A     A    48_A     18  127  132     17   68  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     D    49_A     D    49_A     18  127  132      6   35   91  112  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     Y    50_A     Y    50_A     44  127  132      6   68  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     Y    51_A     Y    51_A     44  127  132     25   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     E    52_A     E    52_A     44  127  132      6   49   98  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     K    53_A     K    53_A     44  127  132      3   13   67  104  115  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     I    54_A     I    54_A     44  127  132     18   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     S    55_A     S    55_A     44  127  132     11   25   58  100  116  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     D    56_A     D    56_A     44  127  132     10   63   94  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     P    57_A     P    57_A     44  127  132     11   63   96  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     L    58_A     L    58_A     44  127  132     27   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     D    59_A     D    59_A     44  127  132     25   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     L    60_A     L    60_A     44  127  132     29   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     S    61_A     S    61_A     44  127  132     14   73  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     T    62_A     T    62_A     44  127  132     17   73  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     I    63_A     I    63_A     44  127  132     29   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     E    64_A     E    64_A     44  127  132     27   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     K    65_A     K    65_A     44  127  132     19   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     Q    66_A     Q    66_A     44  127  132     29   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     I    67_A     I    67_A     44  127  132     27   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     L    68_A     L    68_A     44  127  132     14   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     I    69_A     I    69_A     44  127  132     20   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     G    70_A     G    70_A     44  127  132     29   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     Y    71_A     Y    71_A     44  127  132     28   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     Y    72_A     Y    72_A     44  127  132     21   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     K    73_A     K    73_A     44  127  132     12   61  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     T    74_A     T    74_A     44  127  132     16   71  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     V    75_A     V    75_A     44  127  132     29   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     E    76_A     E    76_A     44  127  132     12   69  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     A    77_A     A    77_A     44  127  132     27   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     F    78_A     F    78_A     44  127  132     29   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     D    79_A     D    79_A     44  127  132     29   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     A    80_A     A    80_A     44  127  132     29   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     D    81_A     D    81_A     44  127  132     29   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     M    82_A     M    82_A     44  127  132     27   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     L    83_A     L    83_A     44  127  132     28   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     K    84_A     K    84_A     44  127  132     29   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     V    85_A     V    85_A     44  127  132     25   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     F    86_A     F    86_A     44  127  132     29   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     R    87_A     R    87_A     44  127  132     29   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     N    88_A     N    88_A     44  127  132     16   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     A    89_A     A    89_A     44  127  132     22   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     E    90_A     E    90_A     44  127  132     22   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     K    91_A     K    91_A     44  127  132     25   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     Y    92_A     Y    92_A     44  127  132      3   50  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     Y    93_A     Y    93_A     44  127  132     11   71  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     G    94_A     G    94_A     41  127  132      3    7   47  102  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     R    95_A     R    95_A      4  127  132      3    4    4    7   19   26   63   89  122  123  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     K    96_A     K    96_A      4  127  132      3    6   10   21   82  108  116  120  122  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     S    97_A     S    97_A      4  127  132      3    4   22   44   82  107  116  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     P    98_A     P    98_A      4  127  132      3   13   25   36   94  113  117  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     I    99_A     I    99_A     28  127  132      7   61  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     G   100_A     G   100_A     28  127  132      7   63  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     R   101_A     R   101_A     28  127  132      7   64  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     D   102_A     D   102_A     28  127  132     29   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     V   103_A     V   103_A     28  127  132     19   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     C   104_A     C   104_A     28  127  132      8   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     R   105_A     R   105_A     28  127  132     25   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     L   106_A     L   106_A     28  127  132     25   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     R   107_A     R   107_A     28  127  132     25   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     K   108_A     K   108_A     28  127  132     29   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     A   109_A     A   109_A     28  127  132     29   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     Y   110_A     Y   110_A     28  127  132     29   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     Y   111_A     Y   111_A     28  127  132     29   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     S   112_A     S   112_A     28  127  132     29   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     A   113_A     A   113_A     28  127  132     29   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     R   114_A     R   114_A     28  127  132     29   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     H   115_A     H   115_A     28  127  132     29   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     E   116_A     E   116_A     28  127  132     29   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     A   117_A     A   117_A     28  127  132     29   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     S   118_A     S   118_A     28  127  132     29   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     A   119_A     A   119_A     28  127  132     14   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     Q   120_A     Q   120_A     28  127  132     29   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     I   121_A     I   121_A     28  127  132     26   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     D   122_A     D   122_A     28  127  132     15   63  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     E   123_A     E   123_A     28  127  132     17   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     I   124_A     I   124_A     28  127  132     26   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     V   125_A     V   125_A     28  127  132     26   74  100  113  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     G   126_A     G   126_A     28  127  132      4   31   93  111  117  119  119  121  123  124  124  125  125  126  127  127  128  128  128  129 
LCS_GDT     E   127_A     E   127_A      4  127  132      3    4    4   10   19   37   54   91  110  119  122  122  125  126  127  127  128  128  128  129 
LCS_GDT     T   128_A     T   128_A      4  126  132      3    4    8   11   19   38   60   96  111  120  122  122  125  126  127  127  128  128  128  129 
LCS_GDT     A   129_A     A   129_A      5    6  132      3    4    5    6    6    9    9   11   15   33   35   45   64  104  121  123  124  127  128  129 
LCS_GDT     S   130_A     S   130_A      5    6  132      3    4    5    6    6    8    9   10   13   16   25   27   33   38   59   81  116  121  124  125 
LCS_GDT     E   131_A     E   131_A      5    6  132      3    4    5    6    6    9    9   10   11   12   13   17   20   25   30   31   34   41   54   70 
LCS_GDT     A   132_A     A   132_A      5    6  132      3    4    5    6    6    9    9   10   11   12   13   16   17   18   19   26   29   31   34   37 
LCS_GDT     D   133_A     D   133_A      5    6  132      3    4    5    6    6    9    9   10   11   12   13   16   17   18   18   20   23   25   29   34 
LCS_GDT     S   134_A     S   134_A      4    6   15      3    4    5    6    6    9    9   10   11   12   13   16   17   18   18   20   23   25   28   34 
LCS_GDT     S   135_A     S   135_A      4    6   15      4    4    5    6    6    9    9   10   11   12   13   16   17   18   18   20   23   23   27   28 
LCS_GDT     E   136_A     E   136_A      4    6   15      4    4    5    6    6    7    9   10   11   12   13   16   17   18   18   20   23   23   24   27 
LCS_GDT     T   137_A     T   137_A      4    6   15      4    4    4    6    6    6    8    9   10   11   13   13   17   18   18   20   21   23   24   25 
LCS_GDT     S   138_A     S   138_A      4    6   14      4    4    4    6    6    6    7    9   10   10   11   13   15   15   17   20   21   23   24   25 
LCS_GDT     V   139_A     V   139_A      4    5   12      4    4    4    4    4    5    7    9   10   10   10   10   10   11   11   11   14   14   17   18 
LCS_GDT     S   140_A     S   140_A      4    5   12      4    4    4    4    6    6    7    9   10   10   10   10   10   11   12   12   13   13   14   14 
LCS_GDT     E   141_A     E   141_A      4    5   12      4    4    4    4    4    5    6    9   10   10   10   10   10   11   12   13   13   13   14   14 
LCS_GDT     K   142_A     K   142_A      4    5   12      3    4    4    5    6    6    7    9   10   10   10   10   10   11   12   13   13   13   14   14 
LCS_GDT     E   143_A     E   143_A      4    5   12      3    4    4    5    6    6    7    9   10   10   10   10   10   11   12   13   13   13   14   14 
LCS_GDT     S   144_A     S   144_A      4    5   12      3    4    4    5    6    6    8    9   10   10   10   10   10   11   12   13   13   13   14   14 
LCS_GDT     G   145_A     G   145_A      4    7   12      3    4    4    5    7    7    8    9   10   10   10   10   10   11   12   13   13   13   14   14 
LCS_GDT     H   146_A     H   146_A      3    7   12      3    3    4    5    7    7    8    9   10   10   10   10   10   11   12   13   13   13   14   14 
LCS_GDT     E   147_A     E   147_A      4    7   12      3    3    4    5    7    7    8    8    8    8    9    9   10   11   12   13   13   13   14   14 
LCS_GDT     K   148_A     K   148_A      4    7   12      3    3    4    5    7    7    8    8    8    8    9   10   10   11   12   13   13   13   14   14 
LCS_GDT     D   149_A     D   149_A      4    9   12      3    3    4    5    7    8    9    9    9   10   10   10   10   11   12   13   13   13   14   14 
LCS_GDT     D   150_A     D   150_A      7    9   12      5    5    7    8    8    8    9    9    9   10   10   10   10   11   12   13   13   13   14   14 
LCS_GDT     D   151_A     D   151_A      7    9   12      5    5    7    8    8    8    9    9    9   10   10   10   10   11   12   13   13   13   14   14 
LCS_GDT     V   152_A     V   152_A      7    9   12      5    5    7    8    8    8    9    9    9   10   10   10   10   11   12   13   13   13   14   14 
LCS_GDT     I   153_A     I   153_A      7    9   12      5    5    7    8    8    8    9    9    9   10   10   10   10   11   11   13   13   13   14   14 
LCS_GDT     R   154_A     R   154_A      7    9   12      5    5    7    8    8    8    9    9    9   10   10   10   10   11   11   12   13   13   14   14 
LCS_GDT     C   155_A     C   155_A      7    9   12      3    5    7    8    8    8    9    9    9   10   10   10   10   11   11   12   13   13   14   14 
LCS_GDT     I   156_A     I   156_A      7    9   12      3    5    7    8    8    8    9    9    9   10   10   10   10   11   11   11   12   12   13   14 
LCS_GDT     C   157_A     C   157_A      7    9   12      0    4    6    8    8    8    9    9    9   10   10   10   10   11   11   12   13   13   14   14 
LCS_GDT     G   158_A     G   158_A      4    5   12      0    4    4    4    5    6    7    7    9   10   10   10   10   11   11   11   12   12   12   13 
LCS_GDT     L   159_A     L   159_A      4    5   12      3    4    4    4    5    6    7    7    8    8    9   10   10   11   11   11   12   12   12   13 
LCS_GDT     Y   160_A     Y   160_A      4    6   10      3    4    4    5    5    6    7    7    8    8    8    8    9    9   10   10   11   12   12   13 
LCS_GDT     K   161_A     K   161_A      4    6   11      3    4    4    5    5    6    7    7    8    8    8    8    9   11   11   11   12   12   12   13 
LCS_GDT     D   162_A     D   162_A      4    6   11      3    4    4    5    5    6    7    7    8    8    8    9   10   11   11   11   12   12   12   13 
LCS_GDT     E   163_A     E   163_A      4    6   11      3    4    4    5    5    7    9    9    9    9    9   10   10   11   11   11   12   12   12   13 
LCS_GDT     G   164_A     G   164_A      7    9   11      3    4    7    8    8    8    9    9    9    9    9   10   10   11   11   11   12   12   12   13 
LCS_GDT     L   165_A     L   165_A      7    9   11      3    5    7    8    8    8    9    9    9    9    9   10   10   11   11   11   12   12   12   13 
LCS_GDT     M   166_A     M   166_A      7    9   11      3    5    6    8    8    8    9    9    9    9    9   10   10   11   11   11   12   12   12   13 
LCS_GDT     I   167_A     I   167_A      7    9   11      3    5    7    8    8    8    9    9    9    9    9   10   10   11   11   11   12   12   12   13 
LCS_GDT     Q   168_A     Q   168_A      7    9   11      3    5    7    8    8    8    9    9    9    9    9   10   10   11   11   11   12   12   12   13 
LCS_GDT     C   169_A     C   169_A      7    9   11      3    5    7    8    8    8    9    9    9    9    9   10   10   11   11   11   12   12   12   13 
LCS_GDT     D   170_A     D   170_A      7    9   11      3    5    7    8    8    8    9    9    9    9    9   10   10   11   11   11   12   12   12   13 
LCS_GDT     K   171_A     K   171_A      7    9   11      3    4    7    8    8    8    9    9    9   10   10   10   10   11   11   11   12   12   12   13 
LCS_GDT     C   172_A     C   172_A      3    9   11      3    3    3    4    4    7    9    9    9   10   10   10   10   10   11   11   11   12   12   13 
LCS_GDT     M   173_A     M   173_A      5    7   11      4    5    5    6    7    7    8    8    9   10   10   10   10   10   11   11   11   12   12   13 
LCS_GDT     V   174_A     V   174_A      5    7   11      4    5    6    6    7    7    8    8    9   10   10   10   10   10   11   11   11   12   12   13 
LCS_GDT     W   175_A     W   175_A      5    7   11      4    5    6    6    7    7    8    8    9   10   10   10   10   10   11   11   11   12   12   13 
LCS_GDT     Q   176_A     Q   176_A      5    7   11      4    5    6    6    7    7    8    8    9   10   10   10   10   10   11   11   11   12   12   13 
LCS_GDT     H   177_A     H   177_A      5    7   11      4    5    6    6    7    7    8    8    9   10   10   10   10   10   11   11   11   12   12   13 
LCS_GDT     C   178_A     C   178_A      5    7   11      3    4    6    6    7    7    8    8    9   10   10   10   10   10   11   11   11   12   12   13 
LCS_GDT     D   179_A     D   179_A      4    7   11      3    4    6    6    7    7    8    8    9   10   10   10   10   10   11   11   11   12   12   13 
LCS_GDT     C   180_A     C   180_A      4    5   11      3    3    4    4    5    7    8    8    9   10   10   10   10   10   11   11   11   12   12   13 
LCS_GDT     M   181_A     M   181_A      4    6   11      3    3    4    4    5    7    7    7    9    9    9   10   10   10   11   11   11   12   12   13 
LCS_GDT     G   182_A     G   182_A      4    6   11      3    4    4    4    5    7    7    7    9    9    9   10   10   10   11   11   11   12   12   13 
LCS_GDT     V   183_A     V   183_A      4    6   11      3    4    4    4    5    7    7    7    9    9    9   10   10   10   11   11   11   12   12   13 
LCS_GDT     N   184_A     N   184_A      4    6   12      3    4    4    4    5    7    7    7    9    9    9   10   10   11   12   12   12   12   13   13 
LCS_GDT     T   185_A     T   185_A      4    6   12      3    4    4    5    5    7    7    7    9    9    9   10   11   11   12   12   12   12   13   13 
LCS_GDT     D   186_A     D   186_A      4    6   12      3    4    4    5    5    7    8    9    9    9   10   10   11   11   12   12   12   12   13   13 
LCS_GDT     V   187_A     V   187_A      4    6   12      3    4    4    5    5    7    8    9    9    9   10   10   11   11   12   12   12   12   13   13 
LCS_GDT     E   188_A     E   188_A      4    7   12      3    4    4    5    6    7    7    9    9    9   10   10   11   11   13   15   18   18   18   18 
LCS_GDT     H   189_A     H   189_A      6    7   12      3    4    6    6    6    7    8    9    9    9   10   10   11   11   13   15   18   18   18   18 
LCS_GDT     Y   190_A     Y   190_A      6    7   12      3    4    6    6    6    7    8    9    9    9   10   10   11   11   13   15   18   18   18   18 
LCS_GDT     L   191_A     L   191_A      6    7   12      3    4    6    6    6    7    8    9    9    9   10   10   11   11   13   15   18   18   18   18 
LCS_GDT     C   192_A     C   192_A      6    7   14      3    4    6    6    6    7    8    9    9    9   10   10   11   12   13   15   18   18   18   18 
LCS_GDT     E   193_A     E   193_A      6    7   14      3    4    6    6    6    7    8    9    9    9   10   10   13   13   13   15   18   18   18   18 
LCS_GDT     Q   194_A     Q   194_A      6    7   14      3    4    6    6    6    9   10   11   12   12   12   12   13   13   13   15   18   18   18   18 
LCS_GDT     C   195_A     C   195_A      5    7   14      4    4    5    6    7    9   10   11   12   12   12   12   13   13   13   15   18   18   18   18 
LCS_GDT     D   196_A     D   196_A      5    7   14      4    4    5    6    7    9   10   11   12   12   12   12   13   13   13   15   18   18   18   18 
LCS_GDT     P   197_A     P   197_A      5    7   14      4    4    5    6    7    9   10   11   12   12   12   12   13   13   13   15   18   18   18   18 
LCS_GDT     R   198_A     R   198_A      5    7   14      4    4    5    6    7    9   10   11   12   12   12   12   13   13   13   15   18   18   18   18 
LCS_GDT     P   199_A     P   199_A      5    7   14      3    4    5    6    7    9   10   11   12   12   12   12   13   13   13   15   18   18   18   18 
LCS_GDT     V   200_A     V   200_A      5    7   14      3    4    5    6    6    9   10   11   12   12   12   12   13   13   13   15   18   18   18   18 
LCS_GDT     D   201_A     D   201_A      5    7   14      3    4    5    6    7    9   10   11   12   12   12   12   13   13   13   15   18   18   18   18 
LCS_GDT     R   202_A     R   202_A      5    7   14      3    4    5    6    7    9   10   11   12   12   12   12   13   13   13   15   18   18   18   18 
LCS_GDT     E   203_A     E   203_A      5    7   14      3    4    5    6    6    8   10   11   12   12   12   12   13   13   13   15   18   18   18   18 
LCS_GDT     V   204_A     V   204_A      3    7   14      3    3    3    5    6    7   10   11   12   12   12   12   13   13   13   15   18   18   18   18 
LCS_GDT     P   205_A     P   205_A      3    6   14      3    3    3    4    6    7   10   11   12   12   12   12   13   13   13   15   18   18   18   18 
LCS_AVERAGE  LCS_A:  32.03  (  12.26   39.95   43.87 )

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     29     74    100    113    117    119    119    121    123    124    124    125    125    126    127    127    128    128    128    129 
GDT PERCENT_AT  14.15  36.10  48.78  55.12  57.07  58.05  58.05  59.02  60.00  60.49  60.49  60.98  60.98  61.46  61.95  61.95  62.44  62.44  62.44  62.93
GDT RMS_LOCAL    0.35   0.63   0.87   1.02   1.11   1.17   1.17   1.33   1.49   1.57   1.57   1.66   1.66   1.82   2.01   2.01   2.15   2.15   2.15   2.39
GDT RMS_ALL_AT  86.25  86.13  86.31  86.35  86.33  86.39  86.39  86.56  86.49  86.59  86.59  86.61  86.61  86.53  86.37  86.37  86.30  86.30  86.30  86.19

# Checking swapping
#   possible swapping detected:  E     5_A      E     5_A
#   possible swapping detected:  D    21_A      D    21_A
#   possible swapping detected:  Y    26_A      Y    26_A
#   possible swapping detected:  D    49_A      D    49_A
#   possible swapping detected:  E    52_A      E    52_A
#   possible swapping detected:  D    56_A      D    56_A
#   possible swapping detected:  E    64_A      E    64_A
#   possible swapping detected:  Y    71_A      Y    71_A
#   possible swapping detected:  D    79_A      D    79_A
#   possible swapping detected:  E    90_A      E    90_A
#   possible swapping detected:  D   102_A      D   102_A
#   possible swapping detected:  E   136_A      E   136_A
#   possible swapping detected:  E   141_A      E   141_A
#   possible swapping detected:  E   147_A      E   147_A
#   possible swapping detected:  D   150_A      D   150_A
#   possible swapping detected:  D   151_A      D   151_A
#   possible swapping detected:  D   186_A      D   186_A
#   possible swapping detected:  Y   190_A      Y   190_A
#   possible swapping detected:  E   193_A      E   193_A
#   possible swapping detected:  D   196_A      D   196_A
#   possible swapping detected:  D   201_A      D   201_A
#   possible swapping detected:  E   203_A      E   203_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    S     1_A      S     1_A     9.157     0    0.099   0.709    11.313    1.071    0.794
LGA    M     2_A      M     2_A     5.826     0    0.105   0.718     6.377   22.738   25.119
LGA    N     3_A      N     3_A     5.384     0    0.133   0.385    11.330   35.238   18.571
LGA    I     4_A      I     4_A     2.146     0    0.599   0.994     6.922   66.786   44.405
LGA    E     5_A      E     5_A     1.448     0    0.041   0.907     3.086   77.143   68.783
LGA    V     6_A      V     6_A     1.131     0    0.080   0.142     1.244   83.690   82.721
LGA    A     7_A      A     7_A     1.600     0    0.022   0.036     1.836   77.143   76.286
LGA    R     8_A      R     8_A     1.469     0    0.034   1.013     3.442   81.429   75.541
LGA    A     9_A      A     9_A     0.868     0    0.078   0.093     1.095   88.214   88.667
LGA    A    10_A      A    10_A     0.776     0    0.065   0.064     1.069   92.857   90.571
LGA    R    11_A      R    11_A     0.680     0    0.092   1.421     8.034   95.238   61.732
LGA    L    12_A      L    12_A     0.480     0    0.057   0.299     0.726  100.000   97.619
LGA    A    13_A      A    13_A     0.274     0    0.081   0.101     0.637  100.000   98.095
LGA    Q    14_A      Q    14_A     0.837     0    0.100   1.373     6.700   90.476   65.238
LGA    I    15_A      I    15_A     0.914     0    0.042   1.100     3.930   90.476   74.345
LGA    F    16_A      F    16_A     0.592     0    0.027   0.151     0.965   92.857   94.805
LGA    K    17_A      K    17_A     0.720     0    0.034   0.541     1.100   90.476   88.466
LGA    E    18_A      E    18_A     0.886     0    0.067   0.761     3.259   90.476   77.460
LGA    I    19_A      I    19_A     0.699     0    0.033   0.173     1.270   90.476   89.345
LGA    C    20_A      C    20_A     0.675     0    0.068   0.737     2.719   90.476   84.921
LGA    D    21_A      D    21_A     0.795     0    0.048   0.879     3.522   90.476   76.310
LGA    G    22_A      G    22_A     0.604     0    0.084   0.084     0.667   90.476   90.476
LGA    I    23_A      I    23_A     0.540     0    0.052   1.322     3.502   95.238   79.583
LGA    I    24_A      I    24_A     0.701     0    0.038   0.109     1.107   90.476   88.214
LGA    S    25_A      S    25_A     0.694     0    0.284   0.618     3.965   88.214   79.603
LGA    Y    26_A      Y    26_A     0.547     0    0.026   0.155     0.564   92.857   94.444
LGA    R    27_A      R    27_A     0.933     0    0.056   0.173     1.644   85.952   82.294
LGA    D    28_A      D    28_A     1.300     0    0.034   0.859     3.431   77.143   71.250
LGA    S    29_A      S    29_A     1.997     0    0.042   0.644     3.954   68.810   63.889
LGA    S    30_A      S    30_A     2.292     0    0.063   0.668     3.366   68.810   65.000
LGA    Q    31_A      Q    31_A     1.648     0    0.105   1.120     5.537   77.143   63.862
LGA    Q    32_A      Q    32_A     1.226     0    0.093   1.403     6.086   81.429   60.741
LGA    T    33_A      T    33_A     1.157     0    0.023   0.845     1.981   85.952   81.565
LGA    L    34_A      L    34_A     0.462     0    0.034   0.139     0.737   97.619   98.810
LGA    A    35_A      A    35_A     0.857     0    0.118   0.110     1.330   90.476   88.667
LGA    A    36_A      A    36_A     0.787     0    0.030   0.046     0.873   90.476   90.476
LGA    P    37_A      P    37_A     0.810     0    0.057   0.172     1.209   88.214   87.891
LGA    L    38_A      L    38_A     0.898     0    0.032   1.086     3.317   90.476   81.071
LGA    L    39_A      L    39_A     1.119     0    0.174   1.393     2.765   88.214   80.833
LGA    N    40_A      N    40_A     1.117     0    0.098   1.308     6.017   88.214   62.262
LGA    L    41_A      L    41_A     1.111     0    0.041   0.293     2.304   79.286   75.060
LGA    P    42_A      P    42_A     1.189     0    0.097   0.263     1.837   77.143   84.218
LGA    P    43_A      P    43_A     2.400     0    0.145   0.322     3.885   72.976   63.197
LGA    K    44_A      K    44_A     1.612     0    0.033   1.030     4.783   79.405   64.339
LGA    K    45_A      K    45_A     1.058     0    0.055   0.909     2.524   88.333   81.005
LGA    K    46_A      K    46_A     1.603     0    0.304   0.972     2.231   79.286   76.825
LGA    N    47_A      N    47_A     1.403     0    0.015   0.158     2.263   81.429   78.274
LGA    A    48_A      A    48_A     1.454     0    0.048   0.072     1.691   77.143   76.286
LGA    D    49_A      D    49_A     2.138     0    0.099   1.198     6.000   68.810   56.845
LGA    Y    50_A      Y    50_A     1.332     0    0.037   0.497     4.570   83.810   63.571
LGA    Y    51_A      Y    51_A     0.398     0    0.112   0.487     3.080   86.190   76.389
LGA    E    52_A      E    52_A     1.786     0    0.107   0.869     5.008   69.048   57.196
LGA    K    53_A      K    53_A     2.867     0    0.066   1.384     7.650   59.167   47.460
LGA    I    54_A      I    54_A     0.852     0    0.200   0.584     2.317   81.548   79.464
LGA    S    55_A      S    55_A     2.998     0    0.260   0.627     4.084   60.952   55.159
LGA    D    56_A      D    56_A     2.001     0    0.111   0.416     2.307   70.952   71.964
LGA    P    57_A      P    57_A     1.962     0    0.635   0.652     4.431   61.905   62.041
LGA    L    58_A      L    58_A     0.780     0    0.095   1.238     2.857   86.071   76.607
LGA    D    59_A      D    59_A     0.751     0    0.193   0.758     2.481   92.857   85.060
LGA    L    60_A      L    60_A     0.180     0    0.036   0.128     1.483  100.000   92.976
LGA    S    61_A      S    61_A     1.269     0    0.067   0.639     1.941   83.690   84.603
LGA    T    62_A      T    62_A     1.380     0    0.023   0.960     3.720   85.952   76.122
LGA    I    63_A      I    63_A     0.514     0    0.032   0.085     1.205   95.238   89.464
LGA    E    64_A      E    64_A     0.568     0    0.097   0.546     1.434   92.857   90.529
LGA    K    65_A      K    65_A     1.060     0    0.092   1.140     3.294   90.595   78.413
LGA    Q    66_A      Q    66_A     0.604     0    0.085   0.395     1.514   90.476   86.508
LGA    I    67_A      I    67_A     0.594     0    0.055   1.249     2.892   92.857   80.119
LGA    L    68_A      L    68_A     0.963     0    0.028   1.136     3.238   90.476   79.881
LGA    I    69_A      I    69_A     0.941     0    0.167   1.303     4.168   90.476   82.738
LGA    G    70_A      G    70_A     0.663     0    0.104   0.104     0.871   90.476   90.476
LGA    Y    71_A      Y    71_A     0.582     0    0.025   0.236     1.087   90.476   87.460
LGA    Y    72_A      Y    72_A     1.122     0    0.592   0.458     3.043   75.833   79.643
LGA    K    73_A      K    73_A     1.822     0    0.131   0.712     3.897   70.833   65.079
LGA    T    74_A      T    74_A     1.374     0    0.059   0.185     2.319   85.952   79.184
LGA    V    75_A      V    75_A     0.564     0    0.048   1.128     2.578   90.476   82.041
LGA    E    76_A      E    76_A     1.372     0    0.116   0.950     4.607   88.214   68.148
LGA    A    77_A      A    77_A     0.888     0    0.046   0.049     1.213   90.476   88.667
LGA    F    78_A      F    78_A     0.334     0    0.039   0.294     1.501   97.619   90.736
LGA    D    79_A      D    79_A     0.255     0    0.052   0.716     1.568  100.000   94.286
LGA    A    80_A      A    80_A     0.481     0    0.043   0.061     0.662   97.619   96.190
LGA    D    81_A      D    81_A     0.730     0    0.030   0.581     2.231   90.476   85.000
LGA    M    82_A      M    82_A     0.730     0    0.051   0.667     1.844   90.476   86.012
LGA    L    83_A      L    83_A     0.509     0    0.073   0.167     1.227   92.857   91.726
LGA    K    84_A      K    84_A     0.396     0    0.044   1.105     2.814   95.238   86.032
LGA    V    85_A      V    85_A     0.832     0    0.034   1.038     2.430   90.476   84.286
LGA    F    86_A      F    86_A     0.695     0    0.025   0.361     0.996   90.476   93.074
LGA    R    87_A      R    87_A     0.643     0    0.066   1.656     5.505   90.476   72.208
LGA    N    88_A      N    88_A     1.005     0    0.058   1.101     3.857   88.214   76.905
LGA    A    89_A      A    89_A     0.756     0    0.073   0.094     0.790   90.476   90.476
LGA    E    90_A      E    90_A     0.804     0    0.062   0.356     1.765   90.476   85.556
LGA    K    91_A      K    91_A     0.717     0    0.115   0.819     4.224   88.214   73.915
LGA    Y    92_A      Y    92_A     1.559     0    0.190   0.356     6.170   81.548   50.714
LGA    Y    93_A      Y    93_A     1.177     0    0.026   0.269     2.268   75.119   86.270
LGA    G    94_A      G    94_A     3.045     0    0.285   0.285     5.645   43.333   43.333
LGA    R    95_A      R    95_A     6.243     0    0.187   1.097    12.709   18.690    8.268
LGA    K    96_A      K    96_A     5.632     0    0.039   0.627     7.326   22.500   21.005
LGA    S    97_A      S    97_A     4.980     0    0.288   0.354     6.723   37.262   29.921
LGA    P    98_A      P    98_A     4.929     0    0.193   0.309     7.473   39.048   27.551
LGA    I    99_A      I    99_A     1.721     0    0.172   1.272     2.625   68.929   72.024
LGA    G   100_A      G   100_A     1.738     0    0.110   0.110     1.738   75.000   75.000
LGA    R   101_A      R   101_A     1.650     0    0.088   1.427     6.153   77.143   56.623
LGA    D   102_A      D   102_A     0.680     0    0.025   1.022     2.541   85.952   80.714
LGA    V   103_A      V   103_A     1.077     0    0.100   1.235     3.577   83.690   76.054
LGA    C   104_A      C   104_A     1.325     0    0.079   0.612     1.614   81.429   80.000
LGA    R   105_A      R   105_A     0.929     0    0.036   0.833     4.096   85.952   77.922
LGA    L   106_A      L   106_A     0.935     0    0.067   0.266     1.005   88.214   90.536
LGA    R   107_A      R   107_A     0.734     0    0.037   0.635     3.325   95.238   79.827
LGA    K   108_A      K   108_A     0.403     0    0.043   1.004     5.991   97.619   73.704
LGA    A   109_A      A   109_A     0.699     0    0.111   0.109     1.122   90.476   88.667
LGA    Y   110_A      Y   110_A     0.514     0    0.044   0.366     1.354   92.857   90.556
LGA    Y   111_A      Y   111_A     0.469     0    0.060   0.186     2.373  100.000   84.841
LGA    S   112_A      S   112_A     0.156     0    0.046   0.670     2.131  100.000   94.127
LGA    A   113_A      A   113_A     0.380     0    0.049   0.052     0.580  100.000   98.095
LGA    R   114_A      R   114_A     0.082     0    0.068   0.804     2.337  100.000   89.221
LGA    H   115_A      H   115_A     0.283     0    0.031   1.090     2.214  100.000   89.238
LGA    E   116_A      E   116_A     0.563     0    0.085   1.044     4.750   95.238   75.079
LGA    A   117_A      A   117_A     0.452     0    0.088   0.087     0.726   95.238   94.286
LGA    S   118_A      S   118_A     0.194     0    0.078   0.079     0.478  100.000  100.000
LGA    A   119_A      A   119_A     1.103     0    0.084   0.100     1.730   88.214   85.143
LGA    Q   120_A      Q   120_A     0.515     0    0.034   1.033     4.539   95.238   74.339
LGA    I   121_A      I   121_A     0.624     0    0.028   0.609     2.426   90.595   87.321
LGA    D   122_A      D   122_A     1.408     0    0.028   0.987     5.196   81.548   67.500
LGA    E   123_A      E   123_A     1.033     0    0.065   0.563     1.952   85.952   82.487
LGA    I   124_A      I   124_A     0.499     0    0.062   0.195     0.963   95.238   92.857
LGA    V   125_A      V   125_A     0.500     0    0.042   0.100     1.562   86.190   88.027
LGA    G   126_A      G   126_A     2.482     0    0.460   0.460     7.053   43.452   43.452
LGA    E   127_A      E   127_A     9.439     0    0.262   0.301    17.189    3.690    1.640
LGA    T   128_A      T   128_A     9.218     0    0.656   0.769     9.636    1.548    7.075
LGA    A   129_A      A   129_A    12.464     0    0.682   0.628    16.744    0.000    0.000
LGA    S   130_A      S   130_A    17.215     0    0.221   0.592    19.133    0.000    0.000
LGA    E   131_A      E   131_A    23.307     0    0.612   0.526    27.174    0.000    0.000
LGA    A   132_A      A   132_A    28.356     0    0.480   0.502    31.449    0.000    0.000
LGA    D   133_A      D   133_A    34.707     0    0.403   1.058    37.515    0.000    0.000
LGA    S   134_A      S   134_A    39.573     0    0.681   0.784    42.387    0.000    0.000
LGA    S   135_A      S   135_A    45.813     0    0.170   0.265    47.334    0.000    0.000
LGA    E   136_A      E   136_A    51.188     0    0.157   1.562    51.996    0.000    0.000
LGA    T   137_A      T   137_A    53.861     0    0.604   0.989    56.743    0.000    0.000
LGA    S   138_A      S   138_A    55.617     0    0.509   0.615    57.043    0.000    0.000
LGA    V   139_A      V   139_A    54.956     0    0.100   0.851    57.499    0.000    0.000
LGA    S   140_A      S   140_A    56.283     0    0.590   0.546    57.341    0.000    0.000
LGA    E   141_A      E   141_A    57.842     0    0.617   1.301    61.472    0.000    0.000
LGA    K   142_A      K   142_A    63.573     0    0.500   0.763    68.525    0.000    0.000
LGA    E   143_A      E   143_A    66.490     0    0.551   1.253    69.380    0.000    0.000
LGA    S   144_A      S   144_A    63.979     0    0.502   0.520    65.332    0.000    0.000
LGA    G   145_A      G   145_A    67.817     0    0.251   0.251    69.179    0.000    0.000
LGA    H   146_A      H   146_A    72.432     0    0.591   1.241    76.951    0.000    0.000
LGA    E   147_A      E   147_A    78.615     0    0.043   1.110    81.745    0.000    0.000
LGA    K   148_A      K   148_A    82.294     0    0.330   1.129    85.833    0.000    0.000
LGA    D   149_A      D   149_A    86.999     0    0.489   0.905    90.666    0.000    0.000
LGA    D   150_A      D   150_A    92.332     0    0.411   1.087    96.390    0.000    0.000
LGA    D   151_A      D   151_A    95.340     0    0.346   0.897    98.623    0.000    0.000
LGA    V   152_A      V   152_A    93.813     0    0.084   1.021    94.609    0.000    0.000
LGA    I   153_A      I   153_A    95.775     0    0.069   1.403   100.608    0.000    0.000
LGA    R   154_A      R   154_A    93.800     0    0.203   1.465    95.468    0.000    0.000
LGA    C   155_A      C   155_A    96.060     0    0.045   0.068    98.507    0.000    0.000
LGA    I   156_A      I   156_A    95.293     0    0.672   1.038    96.563    0.000    0.000
LGA    C   157_A      C   157_A    97.664     0    0.588   0.744    99.161    0.000    0.000
LGA    G   158_A      G   158_A    99.943     0    0.708   0.708   102.157    0.000    0.000
LGA    L   159_A      L   159_A   106.362     0    0.634   0.984   108.949    0.000    0.000
LGA    Y   160_A      Y   160_A   109.379     0    0.407   1.207   113.840    0.000    0.000
LGA    K   161_A      K   161_A   115.481     0    0.040   0.555   117.119    0.000    0.000
LGA    D   162_A      D   162_A   121.557     0    0.396   0.828   126.484    0.000    0.000
LGA    E   163_A      E   163_A   123.096     0    0.064   1.353   125.576    0.000    0.000
LGA    G   164_A      G   164_A   127.451     0    0.284   0.284   129.168    0.000    0.000
LGA    L   165_A      L   165_A   130.373     0    0.050   1.033   130.784    0.000    0.000
LGA    M   166_A      M   166_A   132.454     0    0.064   0.906   134.725    0.000    0.000
LGA    I   167_A      I   167_A   135.704     0    0.123   1.354   137.034    0.000    0.000
LGA    Q   168_A      Q   168_A   138.791     0    0.058   1.074   140.316    0.000    0.000
LGA    C   169_A      C   169_A   139.201     0    0.179   0.661   141.923    0.000    0.000
LGA    D   170_A      D   170_A   144.512     0    0.664   0.693   148.804    0.000    0.000
LGA    K   171_A      K   171_A   144.529     0    0.630   0.876   146.200    0.000    0.000
LGA    C   172_A      C   172_A   146.780     0    0.662   0.617   148.950    0.000    0.000
LGA    M   173_A      M   173_A   153.092     0    0.606   0.733   154.456    0.000    0.000
LGA    V   174_A      V   174_A   154.370     0    0.047   1.117   155.363    0.000    0.000
LGA    W   175_A      W   175_A   156.882     0    0.063   0.182   160.533    0.000    0.000
LGA    Q   176_A      Q   176_A   157.927     0    0.067   0.214   159.660    0.000    0.000
LGA    H   177_A      H   177_A   160.361     0    0.052   1.132   161.665    0.000    0.000
LGA    C   178_A      C   178_A   164.884     0    0.634   0.604   168.941    0.000    0.000
LGA    D   179_A      D   179_A   164.801     0    0.541   0.966   168.221    0.000    0.000
LGA    C   180_A      C   180_A   163.543     0    0.612   0.554   164.222    0.000    0.000
LGA    M   181_A      M   181_A   167.222     0    0.670   1.254   169.795    0.000    0.000
LGA    G   182_A      G   182_A   171.004     0    0.466   0.466   173.843    0.000    0.000
LGA    V   183_A      V   183_A   177.857     0    0.148   0.923   179.842    0.000    0.000
LGA    N   184_A      N   184_A   183.707     0    0.540   0.829   187.812    0.000    0.000
LGA    T   185_A      T   185_A   189.033     0    0.569   0.567   191.676    0.000    0.000
LGA    D   186_A      D   186_A   193.559     0    0.587   1.436   196.030    0.000    0.000
LGA    V   187_A      V   187_A   193.362     0    0.069   1.001   195.489    0.000    0.000
LGA    E   188_A      E   188_A   199.077     0    0.669   1.147   204.387    0.000    0.000
LGA    H   189_A      H   189_A   198.636     0    0.472   0.457   201.651    0.000    0.000
LGA    Y   190_A      Y   190_A   199.280     0    0.078   1.356   200.395    0.000    0.000
LGA    L   191_A      L   191_A   197.939     0    0.077   0.927   198.136    0.000    0.000
LGA    C   192_A      C   192_A   198.855     0    0.121   0.793   200.227    0.000    0.000
LGA    E   193_A      E   193_A   195.249     0    0.576   1.184   196.777    0.000    0.000
LGA    Q   194_A      Q   194_A   196.785     0    0.557   1.002   199.826    0.000    0.000
LGA    C   195_A      C   195_A   202.665     0    0.579   0.640   205.842    0.000    0.000
LGA    D   196_A      D   196_A   202.619     0    0.065   0.978   203.458    0.000    0.000
LGA    P   197_A      P   197_A   203.467     0    0.166   0.450   203.560    0.000    0.000
LGA    R   198_A      R   198_A   204.879     0    0.182   1.145   204.893    0.000    0.000
LGA    P   199_A      P   199_A   203.911     0    0.149   0.255   204.954    0.000    0.000
LGA    V   200_A      V   200_A   202.664     0    0.084   0.177   204.275    0.000    0.000
LGA    D   201_A      D   201_A   199.444     0    0.297   0.486   200.441    0.000    0.000
LGA    R   202_A      R   202_A   197.062     0    0.271   1.352   204.555    0.000    0.000
LGA    E   203_A      E   203_A   194.285     0    0.431   0.731   195.047    0.000    0.000
LGA    V   204_A      V   204_A   192.924     0    0.150   0.150   196.838    0.000    0.000
LGA    P   205_A      P   205_A   186.782     0    0.534   0.566   189.076    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      205     820    820  100.00    1624   1624  100.00               205
SUMMARY(RMSD_GDC):    64.677         64.761                 65.494           50.882   46.700

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  205  205    4.0    121    1.33    53.049    51.732     8.459

LGA_LOCAL      RMSD:   1.330  Number of atoms:  121  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  86.562  Number of assigned atoms:  205 
Std_ASGN_ATOMS RMSD:  64.677  Standard rmsd on all 205 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.055854 * X  +   0.931748 * Y  +  -0.358784 * Z  +   1.767621
  Y_new =  -0.768285 * X  +   0.269609 * Y  +   0.580560 * Z  + -43.989277
  Z_new =   0.637667 * X  +   0.243222 * Y  +   0.730906 * Z  +  22.100981 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -1.498224 -0.691465  0.321241   [DEG:  -85.8419  -39.6180   18.4058 ]
ZXZ: -2.588045  0.751147  1.206405   [DEG: -148.2841   43.0376   69.1219 ]
 
# END of job
