
#######################################################
#                                                     #
#                        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  222 ( 1696),  selected  222 , name one
# Molecule2: number of CA atoms  222 ( 1696),  selected  222 , 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:   150      55_A - 204_A       4.97    48.61
  LONGEST_CONTINUOUS_SEGMENT:   150      56_A - 205_A       4.91    48.82
  LCS_AVERAGE:     50.38

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   126      72_A - 197_A       1.92    48.42
  LONGEST_CONTINUOUS_SEGMENT:   126      73_A - 198_A       1.93    48.44
  LCS_AVERAGE:     34.02

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   122      75_A - 196_A       0.79    48.01
  LONGEST_CONTINUOUS_SEGMENT:   122      76_A - 197_A       0.83    48.03
  LCS_AVERAGE:     31.34

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  222
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     G     1_A     G     1_A      4    6   12      4    4    4    5    5    6    7    7    8    9   11   12   12   14   15   15   17   19   21   23 
LCS_GDT     P     2_A     P     2_A      4    6   12      4    4    4    5    5    6    7    7    8    9   11   12   12   14   15   15   17   19   22   23 
LCS_GDT     H     3_A     H     3_A      4    6   12      4    4    4    5    5    6    7    7    8    9   11   12   12   14   15   15   17   19   22   23 
LCS_GDT     M     4_A     M     4_A      4    6   12      4    4    4    5    5    6    7    7    8    9   11   12   12   14   15   15   17   19   22   23 
LCS_GDT     E     5_A     E     5_A      3    6   12      3    3    3    4    5    6    7    7    8    9   11   12   12   14   15   15   17   19   22   23 
LCS_GDT     Q     6_A     Q     6_A      3    6   12      0    3    3    5    5    6    7    7    8    9   11   12   12   14   15   15   17   19   22   23 
LCS_GDT     L     7_A     L     7_A      3    3   12      0    3    3    3    3    5    7    7    8    9   11   12   12   14   15   15   15   19   22   23 
LCS_GDT     E     8_A     E     8_A      3    3   12      0    3    3    3    4    4    4    6    8    9   11   12   12   14   15   15   17   19   22   23 
LCS_GDT     G     9_A     G     9_A      3    3   12      0    3    3    3    4    4    4    6    8    9   11   12   12   14   15   15   17   19   22   23 
LCS_GDT     I    10_A     I    10_A      3    3   12      0    3    3    3    4    4    4    6    7    8   11   12   12   14   15   15   17   19   22   23 
LCS_GDT     M    11_A     M    11_A      3    4   12      3    3    3    3    4    5    5    6    7    8   11   12   12   14   15   15   17   19   22   23 
LCS_GDT     L    12_A     L    12_A      4    4   12      3    4    4    4    4    5    5    6    7    9    9   12   12   14   15   15   17   19   22   23 
LCS_GDT     S    13_A     S    13_A      4    4   11      3    4    4    4    4    5    5    6    7    9    9   10   11   14   15   15   17   19   22   23 
LCS_GDT     P    14_A     P    14_A      4    4   11      3    4    4    4    4    5    5    6    7    9    9   11   11   14   15   15   17   19   22   23 
LCS_GDT     A    15_A     A    15_A      4    4   11      1    4    4    4    4    5    5    6    7    9    9   10   11   14   15   15   17   19   22   23 
LCS_GDT     F    16_A     F    16_A      3    4   11      0    3    3    3    4    4    4    6    6    9    9   10   10   11   12   14   16   18   22   23 
LCS_GDT     Q    17_A     Q    17_A      3    4   11      3    3    3    3    4    4    4    6    6    9    9   10   10   11   12   15   17   19   22   23 
LCS_GDT     E    18_A     E    18_A      3    4   11      3    3    3    3    4    4    4    6    6    9    9   10   10   11   12   15   17   19   22   23 
LCS_GDT     Q    19_A     Q    19_A      3    4   11      3    3    3    3    4    4    4    6    6    9    9   10   10   11   12   15   17   19   22   23 
LCS_GDT     M    20_A     M    20_A      3    3   11      3    3    3    3    3    4    4    6    6    9    9   10   10   11   12   15   17   19   22   23 
LCS_GDT     N    21_A     N    21_A      3    3   11      0    3    3    3    3    4    4    6    7    8    9   10   10   11   12   15   17   19   22   23 
LCS_GDT     A    22_A     A    22_A      3    3   11      1    3    3    3    3    5    5    7    7    8    9   10   10   11   12   14   17   19   22   23 
LCS_GDT     L    23_A     L    23_A      3    4   10      0    3    3    3    4    5    6    7    7    8    9   10   10   11   12   14   17   19   22   23 
LCS_GDT     M    24_A     M    24_A      3    5   10      3    3    3    3    5    5    6    7    7    8    9   10   10   11   12   14   16   18   20   22 
LCS_GDT     L    25_A     L    25_A      4    5   10      3    4    4    4    5    5    6    7    7    8    9   10   10   11   12   14   16   17   17   19 
LCS_GDT     D    26_A     D    26_A      4    5   10      3    4    4    4    5    5    6    7    7    8    9   10   10   11   12   14   16   17   17   20 
LCS_GDT     P    27_A     P    27_A      4    5   10      3    4    4    4    5    5    6    7    7    8    9   10   10   11   12   14   16   17   20   22 
LCS_GDT     R    28_A     R    28_A      4    5   10      3    4    4    4    5    5    6    7    7    8    9   10   10   11   12   14   16   17   20   22 
LCS_GDT     M    29_A     M    29_A      3    4   10      3    3    3    3    4    4    5    5    6    8    8    8    9   11   11   13   13   15   15   16 
LCS_GDT     L    30_A     L    30_A      3    3   10      3    3    3    3    3    3    5    5    6    8    8    8    9   11   11   13   13   15   15   16 
LCS_GDT     D    31_A     D    31_A      3    3   10      1    3    3    3    3    3    4    5    6    8    8    8    9   11   11   13   13   15   15   16 
LCS_GDT     M    32_A     M    32_A      3    3   10      0    3    3    3    3    4    4    5    8    8    8    8    9   11   11   13   13   15   15   16 
LCS_GDT     M    33_A     M    33_A      3    3   10      0    3    3    3    3    4    4    6    8    8    8    8    9   10   11   11   12   14   14   15 
LCS_GDT     I    34_A     I    34_A      3    3   10      0    3    3    3    4    4    5    6    8    8    8    8    9   10   11   11   12   14   14   15 
LCS_GDT     D    35_A     D    35_A      3    5   10      0    3    3    3    5    5    5    6    8    8    8    8    9   10   11   11   12   14   14   15 
LCS_GDT     Q    36_A     Q    36_A      3    5   12      3    3    4    4    5    5    5    6    8    8    8    9   11   12   12   13   13   15   15   15 
LCS_GDT     N    37_A     N    37_A      3    5   14      3    3    4    4    5    5    5    6    8   10   10   10   11   12   12   14   14   15   17   17 
LCS_GDT     P    38_A     P    38_A      3    5   14      3    3    4    4    5    5    8   10   10   10   11   12   13   13   13   16   16   16   17   17 
LCS_GDT     Q    39_A     Q    39_A      3    5   14      3    3    4    4    5    6    8   10   10   10   11   12   13   13   15   16   16   16   17   18 
LCS_GDT     L    40_A     L    40_A      3    4   14      3    3    3    3    6    6    8   10   10   10   11   12   13   13   15   16   16   16   17   18 
LCS_GDT     R    41_A     R    41_A      3    7   14      3    3    5    6    6    7    8   10   10   10   11   12   13   13   15   16   16   17   17   18 
LCS_GDT     N    42_A     N    42_A      3    7   14      0    3    3    4    6    7    7   10   10   10   11   12   13   14   15   16   17   18   19   20 
LCS_GDT     M    43_A     M    43_A      4    7   14      3    4    5    6    6    7    8   10   10   10   11   12   13   14   15   16   17   18   19   20 
LCS_GDT     G    44_A     G    44_A      4    7   14      3    4    5    6    6    7    8   10   10   10   11   12   13   14   15   16   17   18   19   20 
LCS_GDT     P    45_A     P    45_A      4    7   14      3    4    5    6    6    7    8   10   10   10   11   12   13   13   15   16   16   17   19   20 
LCS_GDT     E    46_A     E    46_A      4    7   14      3    4    5    6    6    7    8   10   10   10   11   12   13   14   15   16   17   18   19   20 
LCS_GDT     A    47_A     A    47_A      4    7   14      1    4    4    6    6    7    7   10   10   10   11   12   13   14   15   16   17   18   19   20 
LCS_GDT     R    48_A     R    48_A      3    3   14      0    3    3    3    3    4    7    7    9   10   11   12   13   14   15   16   17   18   19   20 
LCS_GDT     Q    49_A     Q    49_A      3    4   14      0    3    3    3    4    5    7    7    9   10   11   12   13   14   15   16   17   18   19   26 
LCS_GDT     M    50_A     M    50_A      3    4   14      3    3    3    3    4    4    5    6    8   10   10   12   13   14   15   16   17   18   19   29 
LCS_GDT     L    51_A     L    51_A      3    4   14      3    3    3    3    4    4    5    6    7   10   10   12   13   14   15   16   17   18   19   20 
LCS_GDT     R    52_A     R    52_A      3    4  146      3    3    3    3    4    4    5    6    8   10   10   12   13   14   15   19   24   26   32   45 
LCS_GDT     P    53_A     P    53_A      3    3  148      3    3    3    3    4    4    5    6    7    9   10   12   13   17   20   28   50   70   97  121 
LCS_GDT     M    54_A     M    54_A      3    3  149      3    3    3    3    4    4    5    6    7    9   10   12   13   15   19   22   24   29   34   40 
LCS_GDT     F    55_A     F    55_A      3    3  150      3    3    3    3    4    4    5    7    9    9   10   12   15   17   22   26   30   34   43  104 
LCS_GDT     R    56_A     R    56_A      3    4  150      0    3    3    3    3    5    6    7    9   13   17   20   59   68   78   84   91  133  136  139 
LCS_GDT     E    57_A     E    57_A      3    4  150      1    3    3    3    4    5    5    7    9   10   37   45   59   68  110  128  131  133  136  139 
LCS_GDT     M    58_A     M    58_A      3    4  150      3    3    3    4    4    5    6    7    9   10   15   20   59   68   78   84  128  133  136  139 
LCS_GDT     M    59_A     M    59_A      3    6  150      3    3    3    5    6    6    7   12   14   19   29  123  123  124  125  126  130  131  136  139 
LCS_GDT     S    60_A     S    60_A      3    6  150      3   41  116  122  122  122  123  123  126  127  128  129  130  133  134  135  135  136  137  139 
LCS_GDT     N    61_A     N    61_A      3    6  150      3    3    4    5    6   68   79  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     P    62_A     P    62_A      3    6  150      3    3    4    5    6    6    6    9   13   21   23  129  129  133  134  135  135  136  138  139 
LCS_GDT     E    63_A     E    63_A      3    6  150      3    3    4    5    7   10   56  109  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     S    64_A     S    64_A      3    6  150      3    3    4    5   41  118  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     M    65_A     M    65_A      3    4  150      3    3   98  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     R    66_A     R    66_A      3    4  150      3    4    6   49   92  115  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     S    67_A     S    67_A      3    3  150      3    4    9   20   41   61   87  110  120  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     M    68_A     M    68_A      3    3  150      3    4    4    6   13   14   50   84  105  125  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     M    69_A     M    69_A      3    4  150      3    3    8   20   39   53   78  100  120  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     N    70_A     N    70_A      4    4  150      4    4    5   10   13   20   28   40   50   79  103  119  128  132  134  135  135  136  138  139 
LCS_GDT     M    71_A     M    71_A      4    4  150      4    4    4    4    5    7    8   10   14   19   20   24   28   61   65   69   74  110  125  135 
LCS_GDT     G    72_A     G    72_A      4  126  150      4    4    4    4    5    6    7   13   14   18   34   51  108  131  134  135  135  136  137  139 
LCS_GDT     R    73_A     R    73_A      4  126  150      4    4    6   10   21   37   65   92  120  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     A    74_A     A    74_A      4  126  150      3    4    7    8    9   12   16   29   42  116  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     W    75_A     W    75_A    122  126  150      3    4    7   16   33   73   99  122  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     G    76_A     G    76_A    122  126  150     73  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     S    77_A     S    77_A    122  126  150     60  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     K    78_A     K    78_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     K    79_A     K    79_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     I    80_A     I    80_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     L    81_A     L    81_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     I    82_A     I    82_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     V    83_A     V    83_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     E    84_A     E    84_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     S    85_A     S    85_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     D    86_A     D    86_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     T    87_A     T    87_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     A    88_A     A    88_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     L    89_A     L    89_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     S    90_A     S    90_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     A    91_A     A    91_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     T    92_A     T    92_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     L    93_A     L    93_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     R    94_A     R    94_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     S    95_A     S    95_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     A    96_A     A    96_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     L    97_A     L    97_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     E    98_A     E    98_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     G    99_A     G    99_A    122  126  150     89  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     R   100_A     R   100_A    122  126  150     42  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     G   101_A     G   101_A    122  126  150     58  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     F   102_A     F   102_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     T   103_A     T   103_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     V   104_A     V   104_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     D   105_A     D   105_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     E   106_A     E   106_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     T   107_A     T   107_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     T   108_A     T   108_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     D   109_A     D   109_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     G   110_A     G   110_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     K   111_A     K   111_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     G   112_A     G   112_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     S   113_A     S   113_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     V   114_A     V   114_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     E   115_A     E   115_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     Q   116_A     Q   116_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     I   117_A     I   117_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     R   118_A     R   118_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     R   119_A     R   119_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     D   120_A     D   120_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     R   121_A     R   121_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     P   122_A     P   122_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     D   123_A     D   123_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     L   124_A     L   124_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     V   125_A     V   125_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     V   126_A     V   126_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     L   127_A     L   127_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     A   128_A     A   128_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     V   129_A     V   129_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     D   130_A     D   130_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     L   131_A     L   131_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     S   132_A     S   132_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     A   133_A     A   133_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     G   134_A     G   134_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     Q   135_A     Q   135_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     N   136_A     N   136_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     G   137_A     G   137_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     Y   138_A     Y   138_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     L   139_A     L   139_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     I   140_A     I   140_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     C   141_A     C   141_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     G   142_A     G   142_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     K   143_A     K   143_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     L   144_A     L   144_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     K   145_A     K   145_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     K   146_A     K   146_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     D   147_A     D   147_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     D   148_A     D   148_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     D   149_A     D   149_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     L   150_A     L   150_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     K   151_A     K   151_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     N   152_A     N   152_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     V   153_A     V   153_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     P   154_A     P   154_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     I   155_A     I   155_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     V   156_A     V   156_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     I   157_A     I   157_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     I   158_A     I   158_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     G   159_A     G   159_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     N   160_A     N   160_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     P   161_A     P   161_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     D   162_A     D   162_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     G   163_A     G   163_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     F   164_A     F   164_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     A   165_A     A   165_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     Q   166_A     Q   166_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     H   167_A     H   167_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     R   168_A     R   168_A    122  126  150    105  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     K   169_A     K   169_A    122  126  150     80  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     L   170_A     L   170_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     K   171_A     K   171_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     A   172_A     A   172_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     H   173_A     H   173_A    122  126  150     87  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     A   174_A     A   174_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     D   175_A     D   175_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     E   176_A     E   176_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     Y   177_A     Y   177_A    122  126  150    103  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     V   178_A     V   178_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     A   179_A     A   179_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     K   180_A     K   180_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     P   181_A     P   181_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     V   182_A     V   182_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     D   183_A     D   183_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     A   184_A     A   184_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     D   185_A     D   185_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     Q   186_A     Q   186_A    122  126  150     73  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     L   187_A     L   187_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     V   188_A     V   188_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     E   189_A     E   189_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     R   190_A     R   190_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     A   191_A     A   191_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     G   192_A     G   192_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     A   193_A     A   193_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     L   194_A     L   194_A    122  126  150    106  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     I   195_A     I   195_A    122  126  150     94  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     G   196_A     G   196_A    122  126  150     77  121  121  122  122  122  124  125  127  127  132  132  132  133  134  135  135  136  138  139 
LCS_GDT     F   197_A     F   197_A    122  126  150      3    7   15   27   43   68   95  118  121  122  124  128  131  132  133  135  135  136  138  139 
LCS_GDT     P   198_A     P   198_A      9  126  150      3    8    9   12   19   27   38   51   71   92  110  123  125  126  127  130  131  134  138  139 
LCS_GDT     E   199_A     E   199_A      9  125  150      3    8    9   13   21   32   43   59   76   94  112  123  125  126  126  129  130  133  136  138 
LCS_GDT     G   200_A     G   200_A      9  125  150      3    8    9   10   24   35   51   67   90  112  121  123  125  126  126  129  130  136  138  139 
LCS_GDT     N   201_A     N   201_A      9    9  150      3    8   11   17   24   34   49   67   90  107  121  123  125  126  127  130  131  133  138  139 
LCS_GDT     S   202_A     S   202_A      9    9  150      3    8    9   13   18   21   28   40   49   62   74   89  102  118  126  128  129  130  133  137 
LCS_GDT     M   203_A     M   203_A      9    9  150      3    8    9   10   12   20   24   29   44   56   74   89  101  118  126  128  129  129  133  137 
LCS_GDT     M   204_A     M   204_A      9    9  150      3    8    9    9   10   15   34   47   58   74   90  108  120  125  126  128  129  130  133  137 
LCS_GDT     I   205_A     I   205_A      9   11  150      3    8    9   13   18   21   27   37   45   57   69   83   94  108  120  127  129  130  133  137 
LCS_GDT     A   206_A     A   206_A     10   11  149      3    6   10   12   13   19   23   27   34   39   47   58   67   78   86   94  103  116  126  132 
LCS_GDT     L   207_A     L   207_A     10   11  147      8   11   12   15   18   21   25   35   42   49   56   68   75   86   95  110  119  127  133  137 
LCS_GDT     G   208_A     G   208_A     10   11  139      8   11   12   15   18   21   25   35   42   49   56   68   75   86   95  110  119  127  133  137 
LCS_GDT     V   209_A     V   209_A     10   11  138      8   11   12   15   18   21   25   35   42   49   56   68   75   84   95  110  119  127  133  137 
LCS_GDT     A   210_A     A   210_A     10   11  138      8   11   12   15   18   21   25   35   42   49   56   68   75   86   95  110  119  127  133  137 
LCS_GDT     C   211_A     C   211_A     10   11   41      8   11   12   15   18   21   25   35   42   48   56   68   75   86   95  110  119  127  133  137 
LCS_GDT     A   212_A     A   212_A     10   11   41      8   11   12   15   18   21   25   35   42   49   56   68   75   86   95  110  119  127  133  137 
LCS_GDT     I   213_A     I   213_A     10   11   41      8   11   12   15   18   21   25   35   42   49   56   68   75   86   95  110  119  127  133  137 
LCS_GDT     A   214_A     A   214_A     10   11   41      8   11   12   15   18   21   25   35   42   49   56   68   75   86   95  110  119  127  133  137 
LCS_GDT     L   215_A     L   215_A     10   11   41      8   11   12   15   18   21   25   35   42   49   56   68   75   86   95  110  119  127  133  137 
LCS_GDT     A   216_A     A   216_A      4   11   41      3    3    4    4    8   12   19   26   34   36   42   51   55   66   74   83   93  104  109  117 
LCS_GDT     I   217_A     I   217_A      4    5   40      3    3    4    4    5    5    6    9   10   24   32   37   41   48   53   61   67   76   81   91 
LCS_GDT     A   218_A     A   218_A      4    5   37      1    3    4    4    5    8   16   18   24   29   34   38   45   50   55   62   71   80   83   92 
LCS_GDT     A   219_A     A   219_A      3    4   37      3    3    3    3    4    5    6   14   19   24   29   37   41   45   51   56   63   71   78   82 
LCS_GDT     V   220_A     V   220_A      3    4   35      3    3    3    3    4    5    6    7    8   12   15   17   24   32   34   40   43   45   49   54 
LCS_GDT     Y   221_A     Y   221_A      3    4   13      3    3    3    3    4    4    5    7    8   10   11   12   13   13   16   21   21   21   22   25 
LCS_GDT     F   222_A     F   222_A      3    4   13      3    3    3    3    4    4    4    4    4    9   11   13   14   15   18   21   21   22   24   25 
LCS_AVERAGE  LCS_A:  38.58  (  31.34   34.02   50.38 )

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    106    121    121    122    122    122    124    125    127    127    132    132    132    133    134    135    135    136    138    139 
GDT PERCENT_AT  47.75  54.50  54.50  54.95  54.95  54.95  55.86  56.31  57.21  57.21  59.46  59.46  59.46  59.91  60.36  60.81  60.81  61.26  62.16  62.61
GDT RMS_LOCAL    0.27   0.38   0.38   0.44   0.44   0.44   1.07   1.17   1.43   1.43   2.22   2.22   2.22   2.27   2.33   2.42   2.42   2.57   3.07   3.18
GDT RMS_ALL_AT  47.92  47.96  47.96  47.92  47.92  47.92  48.28  48.34  48.46  48.46  48.93  48.93  48.93  48.82  48.81  48.83  48.83  48.88  49.16  49.19

# Checking swapping
#   possible swapping detected:  E     5_A      E     5_A
#   possible swapping detected:  E     8_A      E     8_A
#   possible swapping detected:  E    18_A      E    18_A
#   possible swapping detected:  D    31_A      D    31_A
#   possible swapping detected:  D    35_A      D    35_A
#   possible swapping detected:  F    55_A      F    55_A
#   possible swapping detected:  E    57_A      E    57_A
#   possible swapping detected:  E    84_A      E    84_A
#   possible swapping detected:  F   102_A      F   102_A
#   possible swapping detected:  D   105_A      D   105_A
#   possible swapping detected:  E   115_A      E   115_A
#   possible swapping detected:  D   148_A      D   148_A
#   possible swapping detected:  D   149_A      D   149_A
#   possible swapping detected:  D   162_A      D   162_A
#   possible swapping detected:  Y   177_A      Y   177_A
#   possible swapping detected:  D   183_A      D   183_A
#   possible swapping detected:  D   185_A      D   185_A
#   possible swapping detected:  E   199_A      E   199_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    G     1_A      G     1_A   136.505     0    0.115   0.115   138.051    0.000    0.000
LGA    P     2_A      P     2_A   136.280     0    0.065   0.072   136.280    0.000    0.000
LGA    H     3_A      H     3_A   135.634     0    0.244   1.258   140.044    0.000    0.000
LGA    M     4_A      M     4_A   129.981     0    0.649   0.861   131.822    0.000    0.000
LGA    E     5_A      E     5_A   130.532     0    0.613   0.953   135.424    0.000    0.000
LGA    Q     6_A      Q     6_A   130.449     0    0.609   1.453   135.955    0.000    0.000
LGA    L     7_A      L     7_A   129.507     0    0.648   1.269   133.182    0.000    0.000
LGA    E     8_A      E     8_A   127.455     0    0.636   1.538   130.178    0.000    0.000
LGA    G     9_A      G     9_A   125.436     0    0.565   0.565   126.544    0.000    0.000
LGA    I    10_A      I    10_A   125.070     0    0.601   1.055   130.444    0.000    0.000
LGA    M    11_A      M    11_A   120.218     0    0.662   0.736   122.508    0.000    0.000
LGA    L    12_A      L    12_A   115.628     0    0.691   0.808   117.376    0.000    0.000
LGA    S    13_A      S    13_A   118.190     0    0.049   0.612   120.268    0.000    0.000
LGA    P    14_A      P    14_A   114.401     0    0.608   0.680   117.699    0.000    0.000
LGA    A    15_A      A    15_A   114.712     0    0.647   0.626   114.989    0.000    0.000
LGA    F    16_A      F    16_A   113.164     0    0.600   0.812   113.791    0.000    0.000
LGA    Q    17_A      Q    17_A   106.093     0    0.619   1.014   108.803    0.000    0.000
LGA    E    18_A      E    18_A   105.289     0    0.640   0.793   106.377    0.000    0.000
LGA    Q    19_A      Q    19_A   109.382     0    0.616   0.700   117.743    0.000    0.000
LGA    M    20_A      M    20_A   104.580     0    0.621   1.337   106.114    0.000    0.000
LGA    N    21_A      N    21_A   102.736     0    0.598   0.830   103.456    0.000    0.000
LGA    A    22_A      A    22_A   104.887     0    0.631   0.615   105.486    0.000    0.000
LGA    L    23_A      L    23_A   107.567     0    0.633   1.346   112.800    0.000    0.000
LGA    M    24_A      M    24_A   102.953     0    0.647   1.028   104.092    0.000    0.000
LGA    L    25_A      L    25_A   100.823     0    0.605   1.082   102.919    0.000    0.000
LGA    D    26_A      D    26_A   100.710     0    0.037   0.973   102.811    0.000    0.000
LGA    P    27_A      P    27_A    98.317     0    0.693   0.549   100.043    0.000    0.000
LGA    R    28_A      R    28_A    98.523     0    0.613   1.133    99.996    0.000    0.000
LGA    M    29_A      M    29_A    97.256     0    0.585   1.255    99.977    0.000    0.000
LGA    L    30_A      L    30_A    92.993     0    0.634   0.624    93.983    0.000    0.000
LGA    D    31_A      D    31_A    90.337     0    0.627   1.124    91.371    0.000    0.000
LGA    M    32_A      M    32_A    90.510     0    0.580   1.188    93.957    0.000    0.000
LGA    M    33_A      M    33_A    87.947     0    0.597   0.964    88.974    0.000    0.000
LGA    I    34_A      I    34_A    82.651     0    0.613   0.817    84.172    0.000    0.000
LGA    D    35_A      D    35_A    82.072     0    0.684   1.248    82.747    0.000    0.000
LGA    Q    36_A      Q    36_A    81.925     0    0.685   1.368    84.388    0.000    0.000
LGA    N    37_A      N    37_A    78.310     0    0.232   0.726    79.029    0.000    0.000
LGA    P    38_A      P    38_A    78.468     0    0.654   0.700    79.845    0.000    0.000
LGA    Q    39_A      Q    39_A    75.244     0    0.685   1.230    81.609    0.000    0.000
LGA    L    40_A      L    40_A    68.315     0    0.701   1.397    71.077    0.000    0.000
LGA    R    41_A      R    41_A    67.868     0    0.688   1.330    76.886    0.000    0.000
LGA    N    42_A      N    42_A    63.665     0    0.678   1.115    65.593    0.000    0.000
LGA    M    43_A      M    43_A    57.317     0    0.127   0.779    59.552    0.000    0.000
LGA    G    44_A      G    44_A    53.356     0    0.210   0.210    54.633    0.000    0.000
LGA    P    45_A      P    45_A    53.319     0    0.029   0.279    54.208    0.000    0.000
LGA    E    46_A      E    46_A    47.769     0    0.612   0.945    50.161    0.000    0.000
LGA    A    47_A      A    47_A    46.599     0    0.630   0.604    48.468    0.000    0.000
LGA    R    48_A      R    48_A    45.256     0    0.655   1.108    52.487    0.000    0.000
LGA    Q    49_A      Q    49_A    39.199     0    0.668   1.395    41.764    0.000    0.000
LGA    M    50_A      M    50_A    35.195     0    0.740   1.323    36.612    0.000    0.000
LGA    L    51_A      L    51_A    34.145     0    0.611   1.257    37.156    0.000    0.000
LGA    R    52_A      R    52_A    27.793     0    0.606   1.242    30.161    0.000    0.000
LGA    P    53_A      P    53_A    22.821     0    0.648   0.740    25.796    0.000    0.000
LGA    M    54_A      M    54_A    21.967     0    0.608   0.954    24.704    0.000    0.000
LGA    F    55_A      F    55_A    19.466     0    0.631   1.321    20.856    0.000    0.000
LGA    R    56_A      R    56_A    12.774     0    0.621   1.228    14.909    0.000    1.991
LGA    E    57_A      E    57_A    11.565     0    0.616   1.111    13.178    0.000    0.000
LGA    M    58_A      M    58_A    11.226     0    0.629   1.235    14.846    0.000    0.000
LGA    M    59_A      M    59_A    10.022     0    0.615   1.138    15.367    5.952    2.976
LGA    S    60_A      S    60_A     3.724     0    0.632   0.725     6.214   40.238   41.270
LGA    N    61_A      N    61_A     5.284     0    0.251   0.876     7.858   31.786   20.595
LGA    P    62_A      P    62_A     6.845     0    0.455   0.448     8.954   10.357    8.027
LGA    E    63_A      E    63_A     7.115     0    0.638   1.368     8.589   10.476    9.524
LGA    S    64_A      S    64_A     6.442     0    0.579   0.714     6.922   18.452   17.381
LGA    M    65_A      M    65_A     2.604     0    0.614   1.017     8.265   39.762   37.143
LGA    R    66_A      R    66_A     6.307     0    0.638   1.350     8.071   17.976   17.056
LGA    S    67_A      S    67_A    10.471     0    0.623   0.683    12.715    0.357    0.238
LGA    M    68_A      M    68_A    10.548     0    0.618   0.950    15.489    0.476    0.238
LGA    M    69_A      M    69_A    10.325     0    0.582   0.860    12.705    0.000    0.000
LGA    N    70_A      N    70_A    12.941     0    0.615   1.094    13.905    0.000    0.000
LGA    M    71_A      M    71_A    16.502     0    0.608   1.418    22.193    0.000    0.000
LGA    G    72_A      G    72_A    11.283     0    0.451   0.451    13.444    2.143    2.143
LGA    R    73_A      R    73_A     8.950     0    0.628   0.959    16.552    2.262    0.823
LGA    A    74_A      A    74_A     9.703     0    0.434   0.420    11.660    2.857    2.286
LGA    W    75_A      W    75_A     6.779     0    0.632   0.978    10.715   22.976    7.245
LGA    G    76_A      G    76_A     1.032     0    0.659   0.659     2.598   73.214   73.214
LGA    S    77_A      S    77_A     1.701     0    0.054   0.527     2.598   79.286   74.524
LGA    K    78_A      K    78_A     0.862     0    0.064   0.819     4.833   83.690   73.333
LGA    K    79_A      K    79_A     0.875     0    0.051   0.935     5.646   90.476   69.471
LGA    I    80_A      I    80_A     0.780     0    0.028   0.055     0.887   90.476   90.476
LGA    L    81_A      L    81_A     0.564     0    0.026   0.069     0.605   95.238   92.857
LGA    I    82_A      I    82_A     0.321     0    0.037   0.126     0.647   97.619   97.619
LGA    V    83_A      V    83_A     0.277     0    0.029   0.084     0.611  100.000   98.639
LGA    E    84_A      E    84_A     0.322     0    0.039   0.539     1.648   97.619   91.693
LGA    S    85_A      S    85_A     0.597     0    0.049   0.622     1.633   92.857   89.127
LGA    D    86_A      D    86_A     0.595     0    0.034   0.160     0.769   95.238   92.857
LGA    T    87_A      T    87_A     0.522     0    0.030   0.885     1.914   95.238   88.163
LGA    A    88_A      A    88_A     0.515     0    0.038   0.043     0.782   95.238   94.286
LGA    L    89_A      L    89_A     0.339     0    0.029   0.082     0.756  100.000   96.429
LGA    S    90_A      S    90_A     0.054     0    0.024   0.610     2.316  100.000   94.127
LGA    A    91_A      A    91_A     0.220     0    0.037   0.042     0.388  100.000  100.000
LGA    T    92_A      T    92_A     0.179     0    0.036   0.148     0.567  100.000   97.279
LGA    L    93_A      L    93_A     0.449     0    0.032   0.043     0.691   97.619   94.048
LGA    R    94_A      R    94_A     0.542     0    0.026   1.571     6.197   92.857   67.143
LGA    S    95_A      S    95_A     0.605     0    0.059   0.094     0.891   90.476   92.063
LGA    A    96_A      A    96_A     0.686     0    0.030   0.052     0.765   90.476   90.476
LGA    L    97_A      L    97_A     0.759     0    0.021   0.139     0.874   90.476   90.476
LGA    E    98_A      E    98_A     0.856     0    0.034   0.132     1.221   85.952   87.460
LGA    G    99_A      G    99_A     1.188     0    0.099   0.099     2.127   77.381   77.381
LGA    R   100_A      R   100_A     1.617     0    0.055   1.172     4.538   75.000   57.835
LGA    G   101_A      G   101_A     1.769     0    0.050   0.050     1.796   72.857   72.857
LGA    F   102_A      F   102_A     1.103     0    0.033   0.110     1.733   83.690   80.736
LGA    T   103_A      T   103_A     1.031     0    0.055   1.002     3.307   85.952   78.299
LGA    V   104_A      V   104_A     0.812     0    0.073   0.091     0.923   90.476   90.476
LGA    D   105_A      D   105_A     0.848     0    0.049   1.121     3.800   90.476   74.226
LGA    E   106_A      E   106_A     0.578     0    0.068   0.728     2.993   90.476   80.053
LGA    T   107_A      T   107_A     0.500     0    0.023   0.054     0.567   92.857   91.837
LGA    T   108_A      T   108_A     0.501     0    0.044   0.189     0.930   95.238   94.558
LGA    D   109_A      D   109_A     0.460     0    0.021   0.347     2.082   97.619   89.702
LGA    G   110_A      G   110_A     0.414     0    0.030   0.030     0.604   95.238   95.238
LGA    K   111_A      K   111_A     0.742     0    0.030   1.454     5.767   90.476   74.709
LGA    G   112_A      G   112_A     0.727     0    0.088   0.088     1.004   88.214   88.214
LGA    S   113_A      S   113_A     0.731     0    0.058   0.630     1.917   90.476   87.540
LGA    V   114_A      V   114_A     0.568     0    0.021   0.933     2.285   90.476   84.286
LGA    E   115_A      E   115_A     0.883     0    0.042   0.661     1.856   90.476   85.556
LGA    Q   116_A      Q   116_A     0.812     0    0.029   0.122     1.067   90.476   88.466
LGA    I   117_A      I   117_A     0.547     0    0.029   0.112     0.652   90.476   92.857
LGA    R   118_A      R   118_A     0.693     0    0.030   1.173     4.200   90.476   75.411
LGA    R   119_A      R   119_A     0.855     0    0.032   1.134     3.022   90.476   80.346
LGA    D   120_A      D   120_A     0.919     0    0.051   1.050     4.206   90.476   75.476
LGA    R   121_A      R   121_A     0.710     0    0.027   0.707     3.407   90.476   78.485
LGA    P   122_A      P   122_A     0.789     0    0.053   0.111     0.830   90.476   90.476
LGA    D   123_A      D   123_A     0.792     0    0.065   0.366     1.635   90.476   89.464
LGA    L   124_A      L   124_A     0.549     0    0.029   0.534     1.448   90.476   88.214
LGA    V   125_A      V   125_A     0.345     0    0.043   0.091     0.373  100.000  100.000
LGA    V   126_A      V   126_A     0.304     0    0.062   0.068     0.435  100.000  100.000
LGA    L   127_A      L   127_A     0.100     0    0.062   0.144     0.710  100.000   98.810
LGA    A   128_A      A   128_A     0.207     0    0.032   0.041     0.336  100.000  100.000
LGA    V   129_A      V   129_A     0.283     0    0.020   0.111     0.501   97.619   98.639
LGA    D   130_A      D   130_A     0.672     0    0.048   0.211     1.261   92.857   89.405
LGA    L   131_A      L   131_A     0.584     0    0.036   0.219     0.880   90.476   90.476
LGA    S   132_A      S   132_A     0.992     0    0.051   0.061     1.125   90.476   87.460
LGA    A   133_A      A   133_A     0.976     0    0.080   0.080     1.130   88.214   88.667
LGA    G   134_A      G   134_A     0.916     0    0.045   0.045     0.958   90.476   90.476
LGA    Q   135_A      Q   135_A     0.522     0    0.053   0.271     1.253   92.857   89.524
LGA    N   136_A      N   136_A     0.432     0    0.019   0.264     0.760  100.000   97.619
LGA    G   137_A      G   137_A     0.363     0    0.025   0.025     0.419  100.000  100.000
LGA    Y   138_A      Y   138_A     0.345     0    0.029   0.151     0.815  100.000   97.619
LGA    L   139_A      L   139_A     0.419     0    0.027   0.146     0.683  100.000   97.619
LGA    I   140_A      I   140_A     0.314     0    0.024   0.612     2.253  100.000   95.595
LGA    C   141_A      C   141_A     0.215     0    0.037   0.047     0.376  100.000  100.000
LGA    G   142_A      G   142_A     0.238     0    0.051   0.051     0.353  100.000  100.000
LGA    K   143_A      K   143_A     0.311     0    0.026   0.303     0.761  100.000   97.884
LGA    L   144_A      L   144_A     0.125     0    0.028   0.168     0.467  100.000  100.000
LGA    K   145_A      K   145_A     0.225     0    0.051   0.557     1.984   97.619   92.804
LGA    K   146_A      K   146_A     0.186     0    0.146   1.176     2.368  100.000   84.180
LGA    D   147_A      D   147_A     0.217     0    0.024   0.179     1.150  100.000   96.488
LGA    D   148_A      D   148_A     0.058     0    0.063   0.384     1.283  100.000   94.167
LGA    D   149_A      D   149_A     0.096     0    0.017   0.464     1.331  100.000   96.488
LGA    L   150_A      L   150_A     0.630     0    0.114   1.162     3.319   97.619   85.655
LGA    K   151_A      K   151_A     0.279     0    0.054   1.025     5.177   95.238   83.069
LGA    N   152_A      N   152_A     0.754     0    0.136   0.485     2.030   95.238   85.179
LGA    V   153_A      V   153_A     0.439     0    0.060   0.091     0.711   97.619   94.558
LGA    P   154_A      P   154_A     0.332     0    0.032   0.255     0.703  100.000   98.639
LGA    I   155_A      I   155_A     0.186     0    0.022   0.385     1.335  100.000   97.679
LGA    V   156_A      V   156_A     0.231     0    0.040   0.072     0.392  100.000  100.000
LGA    I   157_A      I   157_A     0.227     0    0.024   0.178     0.897  100.000   98.810
LGA    I   158_A      I   158_A     0.215     0    0.014   1.103     2.568  100.000   86.845
LGA    G   159_A      G   159_A     0.334     0    0.027   0.027     0.414  100.000  100.000
LGA    N   160_A      N   160_A     0.528     0    0.072   0.468     1.918   92.857   89.464
LGA    P   161_A      P   161_A     0.728     0    0.064   0.107     1.050   88.214   89.184
LGA    D   162_A      D   162_A     1.204     0    0.031   1.377     5.453   83.690   68.690
LGA    G   163_A      G   163_A     0.839     0    0.136   0.136     0.940   90.476   90.476
LGA    F   164_A      F   164_A     0.788     0    0.032   0.420     1.532   90.476   89.784
LGA    A   165_A      A   165_A     0.697     0    0.019   0.036     0.734   90.476   90.476
LGA    Q   166_A      Q   166_A     0.624     0    0.043   1.080     5.837   90.476   69.471
LGA    H   167_A      H   167_A     0.729     0    0.014   1.115     5.854   90.476   66.429
LGA    R   168_A      R   168_A     0.750     0    0.037   0.953     4.133   90.476   80.043
LGA    K   169_A      K   169_A     0.490     0    0.134   0.654     3.001  100.000   88.201
LGA    L   170_A      L   170_A     0.398     0    0.043   0.789     2.500   97.619   89.940
LGA    K   171_A      K   171_A     0.464     0    0.061   0.777     4.863   95.238   73.862
LGA    A   172_A      A   172_A     0.246     0    0.104   0.103     0.418  100.000  100.000
LGA    H   173_A      H   173_A     0.498     0    0.042   0.356     0.838  100.000   95.238
LGA    A   174_A      A   174_A     0.377     0    0.018   0.039     0.481  100.000  100.000
LGA    D   175_A      D   175_A     0.329     0    0.056   0.259     0.759  100.000   98.810
LGA    E   176_A      E   176_A     0.737     0    0.011   0.373     1.351   90.476   88.466
LGA    Y   177_A      Y   177_A     0.956     0    0.031   0.291     2.414   88.214   77.381
LGA    V   178_A      V   178_A     0.708     0    0.031   0.081     0.942   92.857   91.837
LGA    A   179_A      A   179_A     0.497     0    0.023   0.033     0.564   97.619   98.095
LGA    K   180_A      K   180_A     0.454     0    0.068   0.326     0.728   95.238   93.651
LGA    P   181_A      P   181_A     0.296     0    0.057   0.415     1.369  100.000   97.347
LGA    V   182_A      V   182_A     0.176     0    0.038   1.192     2.657  100.000   88.844
LGA    D   183_A      D   183_A     0.410     0    0.114   0.573     3.059   95.238   81.369
LGA    A   184_A      A   184_A     0.499     0    0.051   0.061     0.528  100.000   98.095
LGA    D   185_A      D   185_A     0.216     0    0.049   0.399     1.113   97.619   95.298
LGA    Q   186_A      Q   186_A     0.626     0    0.040   1.273     4.698   90.476   78.201
LGA    L   187_A      L   187_A     0.723     0    0.039   1.096     2.643   90.476   84.107
LGA    V   188_A      V   188_A     0.709     0    0.039   0.176     1.122   90.476   89.184
LGA    E   189_A      E   189_A     0.699     0    0.059   0.892     4.471   90.476   74.815
LGA    R   190_A      R   190_A     0.720     0    0.040   1.375     6.311   90.476   69.351
LGA    A   191_A      A   191_A     0.760     0    0.031   0.040     0.836   90.476   90.476
LGA    G   192_A      G   192_A     1.004     0    0.089   0.089     1.401   83.690   83.690
LGA    A   193_A      A   193_A     0.977     0    0.052   0.073     0.977   90.476   90.476
LGA    L   194_A      L   194_A     0.857     0    0.037   0.200     0.945   90.476   90.476
LGA    I   195_A      I   195_A     1.245     0    0.675   1.345     3.872   72.024   70.655
LGA    G   196_A      G   196_A     0.873     0    0.584   0.584     5.391   65.000   65.000
LGA    F   197_A      F   197_A     8.037     0    0.651   1.160     9.893    7.976    9.264
LGA    P   198_A      P   198_A    11.953     0    0.171   0.526    12.955    0.000    0.000
LGA    E   199_A      E   199_A    12.653     0    0.656   1.201    12.910    0.000    0.000
LGA    G   200_A      G   200_A    12.172     0    0.193   0.193    12.890    0.000    0.000
LGA    N   201_A      N   201_A    12.268     0    0.628   0.932    13.871    0.000    0.000
LGA    S   202_A      S   202_A    16.299     0    0.039   0.709    17.667    0.000    0.000
LGA    M   203_A      M   203_A    16.869     0    0.114   0.818    18.022    0.000    0.000
LGA    M   204_A      M   204_A    15.938     0    0.578   1.367    16.440    0.000    0.000
LGA    I   205_A      I   205_A    18.145     0    0.576   0.792    21.439    0.000    0.000
LGA    A   206_A      A   206_A    23.387     0    0.590   0.580    25.852    0.000    0.000
LGA    L   207_A      L   207_A    22.425     0    0.082   1.038    23.400    0.000    0.000
LGA    G   208_A      G   208_A    23.239     0    0.037   0.037    24.420    0.000    0.000
LGA    V   209_A      V   209_A    24.277     0    0.041   1.014    25.674    0.000    0.000
LGA    A   210_A      A   210_A    25.414     0    0.049   0.055    26.783    0.000    0.000
LGA    C   211_A      C   211_A    26.316     0    0.028   0.066    27.460    0.000    0.000
LGA    A   212_A      A   212_A    26.739     0    0.023   0.031    27.975    0.000    0.000
LGA    I   213_A      I   213_A    27.658     0    0.066   0.643    28.707    0.000    0.000
LGA    A   214_A      A   214_A    28.996     0    0.067   0.086    30.138    0.000    0.000
LGA    L   215_A      L   215_A    29.499     0    0.241   1.249    31.519    0.000    0.000
LGA    A   216_A      A   216_A    31.464     0    0.045   0.045    35.317    0.000    0.000
LGA    I   217_A      I   217_A    37.004     0    0.586   0.737    40.309    0.000    0.000
LGA    A   218_A      A   218_A    38.404     0    0.623   0.615    40.303    0.000    0.000
LGA    A   219_A      A   219_A    38.484     0    0.630   0.597    40.019    0.000    0.000
LGA    V   220_A      V   220_A    43.824     0    0.720   0.800    47.393    0.000    0.000
LGA    Y   221_A      Y   221_A    49.383     0    0.686   1.492    53.111    0.000    0.000
LGA    F   222_A      F   222_A    52.856     0    0.513   0.770    54.029    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      222     888    888  100.00    1696   1696  100.00               222
SUMMARY(RMSD_GDC):    43.312         43.213                 43.680           51.749   48.954

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  222  222    4.0    125    1.17    56.644    50.972     9.840

LGA_LOCAL      RMSD:   1.170  Number of atoms:  125  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  48.335  Number of assigned atoms:  222 
Std_ASGN_ATOMS RMSD:  43.312  Standard rmsd on all 222 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.143200 * X  +  -0.908571 * Y  +  -0.392418 * Z  +  58.824219
  Y_new =   0.611816 * X  +  -0.230397 * Y  +   0.756702 * Z  +  22.833523
  Z_new =  -0.777930 * X  +  -0.348448 * Y  +   0.522886 * Z  +  24.270527 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  1.340878  0.891364 -0.587814   [DEG:   76.8266   51.0714  -33.6793 ]
ZXZ: -2.663184  1.020564 -1.991917   [DEG: -152.5892   58.4740 -114.1284 ]
 
# END of job
