
#######################################################
#                                                     #
#                        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  175 ( 1482),  selected  173 , name one
# Molecule2: number of CA atoms  173 ( 1441),  selected  173 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:B  -ch2:A  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   173       3_A - 175_A       3.59     3.59
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   134       3_A - 136_A       1.96     4.21
  LONGEST_CONTINUOUS_SEGMENT:   134       4_A - 137_A       1.96     4.20
  LONGEST_CONTINUOUS_SEGMENT:   134       5_A - 138_A       2.00     4.24
  LCS_AVERAGE:     63.12

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    38      61_A - 98_A        0.99     4.19
  LONGEST_CONTINUOUS_SEGMENT:    38      62_A - 99_A        0.98     4.22
  LONGEST_CONTINUOUS_SEGMENT:    38      63_A - 100_A       0.97     4.27
  LCS_AVERAGE:     11.61

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  173
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     3_B     G     3_A      3  134  173      0    3    4   10   17   24   75  100  136  151  156  159  163  166  168  169  171  172  172  173 
LCS_GDT     R     4_B     R     4_A     18  134  173      5   37   55   90  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     H     5_B     H     5_A     18  134  173      4   31   75  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     S     6_B     S     6_A     18  134  173      8   37   76  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     V     7_B     V     7_A     18  134  173      8   33   75  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     V     8_B     V     8_A     18  134  173     14   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     R     9_B     R     9_A     18  134  173     14   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     V    10_B     V    10_A     18  134  173     14   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     E    11_B     E    11_A     18  134  173     14   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     G    12_B     G    12_A     18  134  173     14   40   73   95  115  127  132  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     D    13_B     D    13_A     18  134  173      8   36   64   92  112  127  132  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     R    14_B     R    14_A     18  134  173     14   42   73  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     A    15_B     A    15_A     18  134  173      9   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     I    16_B     I    16_A     18  134  173     10   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     K    17_B     K    17_A     18  134  173      8   39   78  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     Q    18_B     Q    18_A     18  134  173     14   39   78  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     F    19_B     F    19_A     18  134  173      6   37   59   99  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     F    20_B     F    20_A     18  134  173      3    7   65   99  116  126  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     P    21_B     P    21_A     18  134  173      3   46   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     A    22_B     A    22_A     17  134  173      4   20   46   79  103  122  132  139  145  152  156  159  162  166  168  169  171  172  172  173 
LCS_GDT     Y    23_B     Y    23_A     17  134  173      3   15   19   49   89  121  132  140  150  153  156  159  163  166  168  169  171  172  172  173 
LCS_GDT     R    24_B     R    24_A     17  134  173      8   35   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     Y    25_B     Y    25_A     17  134  173      7   19   65  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     N    26_B     N    26_A     17  134  173      8   15   39   95  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     F    27_B     F    27_A     17  134  173      8   37   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     W    28_B     W    28_A     17  134  173      8   36   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     K    29_B     K    29_A     17  134  173      8   15   46  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     E    30_B     E    30_A     17  134  173      8   27   62   99  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     A    31_B     A    31_A     17  134  173      9   45   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     G    32_B     G    32_A     17  134  173      9   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     F    33_B     F    33_A     17  134  173     11   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     L    34_B     L    34_A     17  134  173     10   45   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     S    35_B     S    35_A     17  134  173     10   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     L    36_B     L    36_A     17  134  173     12   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     L    37_B     L    37_A     17  134  173      8   26   76  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     Q    38_B     Q    38_A     17  134  173      7   16   58   91  114  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     E    39_B     E    39_A     17  134  173     12   38   71   91  112  126  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     F    40_B     F    40_A      9  134  173      5   13   47   88  112  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     D    41_B     D    41_A      9  134  173      3   10   47   88  112  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     F    42_B     F    42_A      9  134  173      3   13   28   63  105  124  132  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     V    43_B     V    43_A     10  134  173     10   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     P    44_B     P    44_A     10  134  173     13   46   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     R    45_B     R    45_A     10  134  173     10   46   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     L    46_B     L    46_A     10  134  173     14   46   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     Y    47_B     Y    47_A     10  134  173      7   32   65   97  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     S    48_B     S    48_A     10  134  173     13   37   66   99  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     I    49_B     I    49_A     10  134  173     13   37   66   99  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     N    50_B     N    50_A     10  134  173      8   37   73  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     P    51_B     P    51_A     10  134  173      5    7   16   40   65  106  128  135  145  148  155  158  161  166  168  169  171  172  172  173 
LCS_GDT     E    52_B     E    52_A     10  134  173      7   37   58   91  113  126  132  140  150  153  156  159  163  166  168  169  171  172  172  173 
LCS_GDT     K    53_B     K    53_A      9  134  173      5    6    9   43   73   99  127  140  150  153  156  159  163  166  168  169  171  172  172  173 
LCS_GDT     L    54_B     L    54_A     18  134  173      6   36   77  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     E    55_B     E    55_A     18  134  173      8   37   77  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     I    56_B     I    56_A     18  134  173      8   37   77  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     E    57_B     E    57_A     18  134  173     10   46   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     M    58_B     M    58_A     18  134  173     10   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     E    59_B     E    59_A     18  134  173     14   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     F    60_B     F    60_A     18  134  173     14   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     I    61_B     I    61_A     38  134  173     12   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     E    62_B     E    62_A     38  134  173     14   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     G    63_B     G    63_A     38  134  173     13   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     R    64_B     R    64_A     38  134  173     14   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     P    65_B     P    65_A     38  134  173     14   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     I    66_B     I    66_A     38  134  173     16   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     K    67_B     K    67_A     38  134  173     16   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     D    68_B     D    68_A     38  134  173     16   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     V    69_B     V    69_A     38  134  173     15   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     I    70_B     I    70_A     38  134  173     16   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     N    71_B     N    71_A     38  134  173      5   35   70  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     E    72_B     E    72_A     38  134  173      8   37   72  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     L    73_B     L    73_A     38  134  173     16   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     N    74_B     N    74_A     38  134  173     15   42   78  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     S    75_B     S    75_A     38  134  173      8   35   71   99  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     E    76_B     E    76_A     38  134  173      7   38   70   99  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     T    77_B     T    77_A     38  134  173     15   43   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     I    78_B     I    78_A     38  134  173     14   45   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     G    79_B     G    79_A     38  134  173     14   38   74   99  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     R    80_B     R    80_A     38  134  173     15   45   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     I    81_B     I    81_A     38  134  173     13   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     L    82_B     L    82_A     38  134  173     14   41   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     D    83_B     D    83_A     38  134  173     14   44   78  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     I    84_B     I    84_A     38  134  173     16   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     C    85_B     C    85_A     38  134  173     14   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     R    86_B     R    86_A     38  134  173     15   45   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     K    87_B     K    87_A     38  134  173     15   45   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     L    88_B     L    88_A     38  134  173     16   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     D    89_B     D    89_A     38  134  173     16   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     V    90_B     V    90_A     38  134  173     16   45   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     L    91_B     L    91_A     38  134  173     16   45   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     G    92_B     G    92_A     38  134  173     16   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     I    93_B     I    93_A     38  134  173     10   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     Q    94_B     Q    94_A     38  134  173     16   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     K    95_B     K    95_A     38  134  173     14   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     E    96_B     E    96_A     38  134  173     15   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     E    97_B     E    97_A     38  134  173      7   39   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     M    98_B     M    98_A     38  134  173      8   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     N    99_B     N    99_A     38  134  173     10   42   76  100  120  127  133  140  150  153  156  159  163  166  168  169  171  172  172  173 
LCS_GDT     H   100_B     H   100_A     38  134  173      5   42   73  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     P   101_B     P   101_A      5  134  173      3    5   10   25   73   93  114  137  144  153  156  159  163  166  168  169  171  172  172  173 
LCS_GDT     D   102_B     D   102_A     21  134  173      3   22   71   98  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     R   103_B     R   103_A     21  134  173      7   42   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     H   104_B     H   104_A     21  134  173      9   42   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     I   105_B     I   105_A     21  134  173     14   42   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     I   106_B     I   106_A     21  134  173     14   42   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     I   107_B     I   107_A     21  134  173     12   46   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     S   108_B     S   108_A     21  134  173      7   30   78  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     D   109_B     D   109_A     21  134  173      4   42   78  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     R   110_B     R   110_A     21  134  173      7   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     I   111_B     I   111_A     21  134  173     11   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     V   112_B     V   112_A     21  134  173     14   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     F   113_B     F   113_A     21  134  173     14   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     I   114_B     I   114_A     21  134  173     12   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     D   115_B     D   115_A     21  134  173     11   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     F   116_B     F   116_A     21  134  173     16   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     E   117_B     E   117_A     21  134  173     14   45   77  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     R   118_B     R   118_A     21  134  173     12   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     G   119_B     G   119_A     21  134  173     16   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     V   120_B     V   120_A     21  134  173     16   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     I   121_B     I   121_A     21  134  173     16   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     K   122_B     K   122_A     21  134  173     12   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     C   123_B     C   123_A     14  134  173      3    8   22   80  106  121  132  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     R   124_B     R   124_A      3  134  173      2    9   41   98  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     P   125_B     P   125_A      3  134  173      3   11   18   37   78  113  132  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     S   126_B     S   126_A     11  134  173      8   35   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     N   127_B     N   127_A     11  134  173      8   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     L   128_B     L   128_A     11  134  173     15   47   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     T   129_B     T   129_A     11  134  173     14   45   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     Q   130_B     Q   130_A     11  134  173     14   45   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     F   131_B     F   131_A     11  134  173     11   45   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     A   132_B     A   132_A     11  134  173      8   35   71   99  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     V   133_B     V   133_A     11  134  173      7   37   71   98  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     Y   134_B     Y   134_A     11  134  173     15   45   79  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     L   135_B     L   135_A     11  134  173      7   38   78  100  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     N   136_B     N   136_A     11  134  173      8   15   57   87  113  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     S   137_B     S   137_A      5  134  173      3   15   27   52   72  106  116  125  142  146  155  158  160  165  168  169  171  172  172  173 
LCS_GDT     R   138_B     R   138_A      4  134  173      3   13   31   61   86  101  120  131  139  147  152  156  160  161  165  168  171  172  172  173 
LCS_GDT     L   139_B     L   139_A      3   87  173      3   15   43   73   91  106  118  130  140  145  149  153  157  160  163  168  171  172  172  173 
LCS_GDT     R   140_B     R   140_A      4    5  173      3    3    4    6    9   21   32   43   56  135  144  152  155  160  167  168  171  172  172  173 
LCS_GDT     L   141_B     L   141_A      4    5  173      3    3    4    5   16   21   24   30   36   56   65   71  148  152  161  166  171  172  172  173 
LCS_GDT     M   142_B     M   142_A      4    5  173      3    3    4    6    9   13   16   30   49   66   93  124  159  164  167  169  171  172  172  173 
LCS_GDT     K   143_B     K   143_A      4   16  173      3    3    4    5    9   27   30   53   90  113  138  159  162  166  168  169  171  172  172  173 
LCS_GDT     N   144_B     N   144_A      4   16  173      3    4    6   31   45   59   72   93  124  145  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     E   145_B     E   145_A     13   16  173      3    7   18   37   52   62   85  106  139  149  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     E   146_B     E   146_A     13   16  173      3   16   25   41   55   86  110  133  147  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     L   147_B     L   147_A     13   16  173      5   16   25   48   81  111  132  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     K   148_B     K   148_A     13   16  173      5   13   24   50   87  113  132  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     K   149_B     K   149_A     13   16  173      8   12   25   45   81  111  124  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     L   150_B     L   150_A     13   16  173      8   16   25   53   82  114  132  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     L   151_B     L   151_A     13   16  173      8   16   32   65  103  125  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     R   152_B     R   152_A     13   16  173      8   16   32   67  103  125  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     E   153_B     E   153_A     13   16  173      8   16   35   73  108  125  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     Y   154_B     Y   154_A     13   16  173      8   16   53   93  119  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     K   155_B     K   155_A     13   16  173      8   16   52   95  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     K   156_B     K   156_A     13   16  173      8   17   53   95  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     G   157_B     G   157_A     13   16  173      7   24   61   98  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     F   158_B     F   158_A     13   18  173      4   17   53   98  120  127  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     D   159_B     D   159_A     16   18  173      3    5   14   35   78   93  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     D   160_B     D   160_A     16   18  173     11   14   16   35   56   93  121  139  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     E   161_B     E   161_A     16   18  173     11   14   25   35   78  122  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     S   162_B     S   162_A     16   18  173     11   14   15   16   25   64   91  124  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     Y   163_B     Y   163_A     16   18  173     11   14   15   16   32   64   91  124  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     R   164_B     R   164_A     16   18  173     11   14   15   43   83  122  133  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     E   165_B     E   165_A     16   18  173     11   14   15   25   55   88  118  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     L   166_B     L   166_A     16   18  173     11   14   15   16   25   39   56  100  139  149  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     R   167_B     R   167_A     16   18  173      9   14   15   16   25   59  112  140  150  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     T   168_B     T   168_A     16   18  173     11   14   15   16   41   72  105  133  147  153  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     Q   169_B     Q   169_A     16   18  173     11   14   15   16   25   37   49   81  123  149  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     I   170_B     I   170_A     16   18  173     11   14   15   16   25   33   49   76  111  149  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     L   171_B     L   171_A     16   18  173     11   14   15   16   25   37   64  103  139  149  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     Q   172_B     Q   172_A     16   18  173      8   14   15   16   25   37   49   85  124  149  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     Y   173_B     Y   173_A     16   18  173      4   14   15   16   25   37   49   65  116  145  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     M   174_B     M   174_A     16   18  173      4   13   15   16   25   37   79  105  139  149  157  159  163  166  168  169  171  172  172  173 
LCS_GDT     K   175_B     K   175_A      3   18  173      0    3    3    3    9   50   66   80  105  125  141  157  163  165  168  169  169  171  172  173 
LCS_AVERAGE  LCS_A:  58.24  (  11.61   63.12  100.00 )

GLOBAL_DISTANCE_TEST (summary information about detected largest sets of residues (represented by selected AToms) that can fit under specified thresholds)
GDT DIST_CUTOFF  0.50   1.00   1.50   2.00   2.50   3.00   3.50   4.00   4.50   5.00   5.50   6.00   6.50   7.00   7.50   8.00   8.50   9.00   9.50  10.00
GDT NUMBER_AT     16     47     79    100    120    127    133    140    150    153    157    159    163    166    168    169    171    172    172    173 
GDT PERCENT_AT   9.25  27.17  45.66  57.80  69.36  73.41  76.88  80.92  86.71  88.44  90.75  91.91  94.22  95.95  97.11  97.69  98.84  99.42  99.42 100.00
GDT RMS_LOCAL    0.35   0.76   1.04   1.27   1.56   1.66   1.91   2.03   2.42   2.54   3.00   3.02   3.09   3.21   3.31   3.38   3.44   3.51   3.52   3.59
GDT RMS_ALL_AT   4.34   4.46   4.31   4.26   4.06   4.06   3.87   3.89   3.71   3.68   3.62   3.62   3.60   3.59   3.60   3.60   3.59   3.59   3.59   3.59

# Checking swapping
#   possible swapping detected:  D    13_B      D    13_A
#   possible swapping detected:  F    27_B      F    27_A
#   possible swapping detected:  E    30_B      E    30_A
#   possible swapping detected:  F    33_B      F    33_A
#   possible swapping detected:  E    39_B      E    39_A
#   possible swapping detected:  F    40_B      F    40_A
#   possible swapping detected:  D    41_B      D    41_A
#   possible swapping detected:  F    42_B      F    42_A
#   possible swapping detected:  E    55_B      E    55_A
#   possible swapping detected:  E    59_B      E    59_A
#   possible swapping detected:  F    60_B      F    60_A
#   possible swapping detected:  E    62_B      E    62_A
#   possible swapping detected:  D    68_B      D    68_A
#   possible swapping detected:  E    72_B      E    72_A
#   possible swapping detected:  D    83_B      D    83_A
#   possible swapping detected:  D    89_B      D    89_A
#   possible swapping detected:  E    96_B      E    96_A
#   possible swapping detected:  E    97_B      E    97_A
#   possible swapping detected:  D   102_B      D   102_A
#   possible swapping detected:  F   113_B      F   113_A
#   possible swapping detected:  D   115_B      D   115_A
#   possible swapping detected:  E   165_B      E   165_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    G     3_B      G     3_A     5.492     0    0.264   0.264     6.932   25.714   25.714
LGA    R     4_B      R     4_A     2.608     0    0.341   1.345     7.737   71.548   34.675
LGA    H     5_B      H     5_A     2.205     0    0.034   1.019     6.772   70.833   48.476
LGA    S     6_B      S     6_A     1.339     0    0.140   0.550     2.496   75.119   73.016
LGA    V     7_B      V     7_A     1.488     0    0.017   1.131     3.209   79.286   72.245
LGA    V     8_B      V     8_A     0.933     0    0.098   0.120     1.517   90.595   85.442
LGA    R     9_B      R     9_A     0.878     0    0.199   1.061     3.555   90.476   76.061
LGA    V    10_B      V    10_A     1.530     0    0.059   0.085     1.662   72.857   74.082
LGA    E    11_B      E    11_A     1.940     0    0.036   0.072     2.323   68.810   70.159
LGA    G    12_B      G    12_A     2.810     0    0.052   0.052     2.810   59.048   59.048
LGA    D    13_B      D    13_A     3.085     0    0.090   0.397     3.834   53.571   50.119
LGA    R    14_B      R    14_A     2.254     0    0.122   1.462     7.769   73.095   52.035
LGA    A    15_B      A    15_A     0.575     0    0.080   0.087     0.720   90.476   90.476
LGA    I    16_B      I    16_A     0.514     0    0.075   0.129     1.267   88.214   91.726
LGA    K    17_B      K    17_A     1.232     0    0.050   0.128     3.176   83.690   72.487
LGA    Q    18_B      Q    18_A     1.255     0    0.064   0.512     2.174   79.286   77.672
LGA    F    19_B      F    19_A     2.539     0    0.353   0.621     4.977   62.976   46.710
LGA    F    20_B      F    20_A     3.108     0    0.607   1.446     6.822   49.048   36.537
LGA    P    21_B      P    21_A     1.327     0    0.639   0.994     3.461   71.071   64.150
LGA    A    22_B      A    22_A     4.387     0    0.053   0.065     6.050   39.405   34.952
LGA    Y    23_B      Y    23_A     3.709     0    0.288   1.344     9.938   51.905   27.937
LGA    R    24_B      R    24_A     1.247     0    0.168   1.152     3.483   75.119   68.009
LGA    Y    25_B      Y    25_A     2.438     0    0.027   0.085     3.893   66.786   52.817
LGA    N    26_B      N    26_A     2.463     0    0.107   1.269     2.724   64.762   67.024
LGA    F    27_B      F    27_A     1.165     0    0.089   1.291     8.258   79.286   50.563
LGA    W    28_B      W    28_A     1.259     0    0.069   1.285     5.981   81.429   62.925
LGA    K    29_B      K    29_A     2.283     0    0.096   1.366     5.644   66.786   60.212
LGA    E    30_B      E    30_A     2.283     0    0.092   1.146     4.025   68.810   60.159
LGA    A    31_B      A    31_A     1.314     0    0.039   0.040     1.597   79.286   79.714
LGA    G    32_B      G    32_A     0.857     0    0.023   0.023     0.995   90.476   90.476
LGA    F    33_B      F    33_A     1.524     0    0.057   0.520     2.295   75.000   70.693
LGA    L    34_B      L    34_A     1.920     0    0.017   1.386     3.263   72.857   71.190
LGA    S    35_B      S    35_A     1.311     0    0.027   0.029     1.524   79.286   80.000
LGA    L    36_B      L    36_A     1.180     0    0.180   1.149     4.936   79.286   68.988
LGA    L    37_B      L    37_A     2.049     0    0.178   0.190     2.539   68.810   65.833
LGA    Q    38_B      Q    38_A     2.666     0    0.130   1.340     3.424   59.048   61.799
LGA    E    39_B      E    39_A     3.327     0    0.171   0.821     7.939   51.786   32.540
LGA    F    40_B      F    40_A     3.104     0    0.709   0.734     4.612   51.905   43.766
LGA    D    41_B      D    41_A     3.025     0    0.102   1.198     6.345   50.000   40.595
LGA    F    42_B      F    42_A     3.424     0    0.223   1.148     5.017   59.405   45.498
LGA    V    43_B      V    43_A     1.170     0    0.059   1.107     3.845   79.286   69.048
LGA    P    44_B      P    44_A     1.443     0    0.025   0.134     2.377   81.429   75.442
LGA    R    45_B      R    45_A     1.285     0    0.008   1.468     6.742   81.429   59.091
LGA    L    46_B      L    46_A     1.199     0    0.038   1.349     3.579   79.405   71.488
LGA    Y    47_B      Y    47_A     2.626     0    0.084   1.327     6.226   57.262   50.833
LGA    S    48_B      S    48_A     2.661     0    0.086   0.128     2.925   60.952   59.683
LGA    I    49_B      I    49_A     2.754     0    0.143   1.067     3.907   57.143   54.583
LGA    N    50_B      N    50_A     2.301     0    0.175   1.122     5.175   54.167   56.786
LGA    P    51_B      P    51_A     5.431     0    0.100   0.344     6.767   25.714   23.537
LGA    E    52_B      E    52_A     3.650     3    0.627   0.764     5.589   36.310   31.534
LGA    K    53_B      K    53_A     4.621     0    0.135   0.479    13.002   37.738   18.783
LGA    L    54_B      L    54_A     2.008     0    0.368   0.349     6.102   68.810   51.250
LGA    E    55_B      E    55_A     1.815     0    0.066   0.141     2.289   75.000   71.111
LGA    I    56_B      I    56_A     1.744     0    0.085   1.010     4.555   79.405   68.452
LGA    E    57_B      E    57_A     1.191     0    0.092   0.765     4.317   81.429   60.794
LGA    M    58_B      M    58_A     1.230     0    0.062   0.348     1.363   81.429   84.821
LGA    E    59_B      E    59_A     1.298     0    0.055   0.960     2.951   81.429   77.778
LGA    F    60_B      F    60_A     1.491     0    0.068   0.186     2.813   79.286   71.558
LGA    I    61_B      I    61_A     1.390     0    0.055   0.160     2.214   81.429   76.131
LGA    E    62_B      E    62_A     1.336     0    0.131   0.593     3.622   81.429   73.439
LGA    G    63_B      G    63_A     1.313     0    0.074   0.074     1.320   81.429   81.429
LGA    R    64_B      R    64_A     1.210     0    0.120   1.453     6.263   81.429   66.190
LGA    P    65_B      P    65_A     1.349     0    0.601   0.973     3.671   67.619   73.605
LGA    I    66_B      I    66_A     0.992     0    0.030   1.068     2.427   83.690   79.464
LGA    K    67_B      K    67_A     0.852     0    0.110   0.856     5.554   88.214   66.455
LGA    D    68_B      D    68_A     0.801     0    0.163   0.252     1.577   88.214   84.881
LGA    V    69_B      V    69_A     0.392     0    0.062   0.080     0.687   97.619   94.558
LGA    I    70_B      I    70_A     0.374     0    0.066   0.656     2.761   97.619   89.881
LGA    N    71_B      N    71_A     1.505     0    0.175   1.038     4.926   79.405   67.976
LGA    E    72_B      E    72_A     1.457     0    0.078   0.964     6.338   85.952   60.053
LGA    L    73_B      L    73_A     0.516     0    0.067   1.363     4.902   95.238   80.000
LGA    N    74_B      N    74_A     1.278     0    0.105   0.326     3.393   81.429   73.274
LGA    S    75_B      S    75_A     1.962     0    0.030   0.599     2.704   72.857   68.889
LGA    E    76_B      E    76_A     2.121     0    0.036   0.922     3.506   68.810   60.000
LGA    T    77_B      T    77_A     1.327     0    0.026   0.042     2.006   79.286   76.599
LGA    I    78_B      I    78_A     1.389     0    0.035   0.662     4.005   81.429   70.714
LGA    G    79_B      G    79_A     1.901     0    0.042   0.042     1.901   72.857   72.857
LGA    R    80_B      R    80_A     1.226     0    0.044   1.479     6.331   83.690   60.173
LGA    I    81_B      I    81_A     0.841     0    0.032   0.148     2.126   90.476   80.714
LGA    L    82_B      L    82_A     1.493     0    0.031   1.436     5.940   81.429   61.071
LGA    D    83_B      D    83_A     1.597     0    0.046   0.154     2.414   79.286   73.036
LGA    I    84_B      I    84_A     0.841     0    0.044   0.717     2.373   88.214   86.131
LGA    C    85_B      C    85_A     0.647     0    0.042   0.098     0.743   90.476   90.476
LGA    R    86_B      R    86_A     1.067     0    0.031   1.275     5.702   83.690   64.026
LGA    K    87_B      K    87_A     1.306     0    0.038   1.202     4.802   81.429   70.688
LGA    L    88_B      L    88_A     1.062     0    0.034   1.400     3.507   81.429   70.833
LGA    D    89_B      D    89_A     1.314     0    0.039   0.168     1.581   79.286   80.357
LGA    V    90_B      V    90_A     1.767     0    0.055   0.167     2.084   70.833   71.701
LGA    L    91_B      L    91_A     1.915     0    0.065   0.106     1.915   72.857   72.857
LGA    G    92_B      G    92_A     1.551     0    0.184   0.184     1.823   72.857   72.857
LGA    I    93_B      I    93_A     1.837     0    0.085   1.536     4.423   75.000   64.762
LGA    Q    94_B      Q    94_A     1.207     0    0.048   0.881     3.241   81.429   77.937
LGA    K    95_B      K    95_A     1.277     0    0.520   1.142     6.078   75.357   57.831
LGA    E    96_B      E    96_A     1.283     0    0.605   0.961     3.883   67.619   64.709
LGA    E    97_B      E    97_A     1.169     0    0.305   1.145     4.483   77.262   65.291
LGA    M    98_B      M    98_A     1.231     0    0.095   0.736     1.646   81.548   83.869
LGA    N    99_B      N    99_A     2.121     0    0.186   0.995     3.737   70.833   63.214
LGA    H   100_B      H   100_A     2.126     0    0.510   1.252     5.730   68.810   55.810
LGA    P   101_B      P   101_A     4.597     0    0.674   0.680     7.665   42.024   29.388
LGA    D   102_B      D   102_A     2.286     0    0.451   1.305     7.253   66.786   45.238
LGA    R   103_B      R   103_A     1.818     0    0.132   1.137     4.660   72.857   61.429
LGA    H   104_B      H   104_A     1.800     0    0.196   0.553     3.876   77.143   63.238
LGA    I   105_B      I   105_A     1.628     0    0.095   0.615     2.823   72.857   70.893
LGA    I   106_B      I   106_A     1.750     0    0.052   0.628     3.070   72.857   71.071
LGA    I   107_B      I   107_A     1.812     0    0.059   0.669     2.134   72.857   71.845
LGA    S   108_B      S   108_A     1.874     0    0.445   0.435     2.449   75.000   71.587
LGA    D   109_B      D   109_A     1.690     0    0.107   1.166     4.429   72.976   63.512
LGA    R   110_B      R   110_A     1.296     0    0.113   1.538     8.524   81.429   50.693
LGA    I   111_B      I   111_A     1.149     0    0.063   0.709     1.981   81.429   80.357
LGA    V   112_B      V   112_A     1.325     0    0.117   1.084     2.958   79.286   74.354
LGA    F   113_B      F   113_A     0.923     0    0.072   1.297     7.224   90.595   58.615
LGA    I   114_B      I   114_A     0.217     0    0.442   1.609     3.458   86.905   78.214
LGA    D   115_B      D   115_A     0.700     0    0.279   1.209     3.291   85.952   82.083
LGA    F   116_B      F   116_A     1.648     0    0.516   0.598     3.019   69.524   65.844
LGA    E   117_B      E   117_A     2.146     0    0.023   0.908     2.975   68.810   64.868
LGA    R   118_B      R   118_A     1.528     0    0.161   1.540     6.045   77.143   61.212
LGA    G   119_B      G   119_A     1.201     0    0.104   0.104     1.296   81.429   81.429
LGA    V   120_B      V   120_A     1.469     0    0.051   1.096     4.224   77.143   71.429
LGA    I   121_B      I   121_A     1.443     0    0.049   0.079     1.845   77.143   77.143
LGA    K   122_B      K   122_A     2.160     0    0.479   1.168     3.199   63.095   63.228
LGA    C   123_B      C   123_A     3.759     0    0.635   1.081     7.656   39.524   32.778
LGA    R   124_B      R   124_A     1.956     0    0.394   1.043    10.666   72.976   39.048
LGA    P   125_B      P   125_A     4.429     0    0.608   0.808     6.249   48.571   37.959
LGA    S   126_B      S   126_A     1.512     0    0.396   0.644     2.474   72.976   73.016
LGA    N   127_B      N   127_A     1.476     0    0.079   0.090     2.591   85.952   75.417
LGA    L   128_B      L   128_A     0.767     0    0.043   1.199     2.670   90.476   82.976
LGA    T   129_B      T   129_A     0.793     0    0.062   1.098     2.835   83.810   77.143
LGA    Q   130_B      Q   130_A     0.941     0    0.030   0.949     5.338   90.476   69.259
LGA    F   131_B      F   131_A     0.724     0    0.062   0.972     2.988   85.952   75.671
LGA    A   132_B      A   132_A     1.717     0    0.031   0.028     2.123   75.000   72.952
LGA    V   133_B      V   133_A     2.186     0    0.034   0.055     2.660   68.810   64.898
LGA    Y   134_B      Y   134_A     1.167     0    0.031   0.170     2.881   83.810   77.500
LGA    L   135_B      L   135_A     1.019     0    0.031   1.316     4.387   83.690   69.881
LGA    N   136_B      N   136_A     3.082     0    0.034   0.887     8.550   52.024   33.631
LGA    S   137_B      S   137_A     5.453     0    0.225   0.259     9.292   28.214   20.714
LGA    R   138_B      R   138_A     5.719     0    0.620   1.095    12.957   28.929   11.818
LGA    L   139_B      L   139_A     6.619     0    0.223   0.188    13.188   12.738    6.548
LGA    R   140_B      R   140_A     7.705     0    0.138   1.139    11.612    7.619    3.463
LGA    L   141_B      L   141_A    10.417     0    0.371   0.308    14.066    0.714    0.357
LGA    M   142_B      M   142_A    10.608     0    0.317   0.911    11.440    0.119    0.238
LGA    K   143_B      K   143_A    11.128     4    0.133   0.175    13.380    0.357    0.159
LGA    N   144_B      N   144_A    10.653     3    0.575   0.573    13.074    0.119    0.060
LGA    E   145_B      E   145_A     9.601     4    0.210   0.224    10.153    2.024    0.952
LGA    E   146_B      E   146_A     7.621     4    0.211   0.225     8.536    9.167    4.868
LGA    L   147_B      L   147_A     5.942     0    0.107   1.190     7.726   21.548   22.738
LGA    K   148_B      K   148_A     5.976     0    0.044   0.859     9.300   20.357   12.910
LGA    K   149_B      K   149_A     6.647     0    0.057   0.858    12.086   16.310    8.836
LGA    L   150_B      L   150_A     5.512     0    0.043   0.583     6.658   27.857   23.095
LGA    L   151_B      L   151_A     4.190     0    0.028   1.402     4.796   37.262   46.190
LGA    R   152_B      R   152_A     4.380     0    0.028   0.788     7.851   40.238   25.411
LGA    E   153_B      E   153_A     3.977     0    0.035   0.999     9.010   46.905   29.312
LGA    Y   154_B      Y   154_A     2.685     0    0.026   0.512     3.216   61.190   65.079
LGA    K   155_B      K   155_A     2.531     0    0.094   0.785     4.364   59.048   54.444
LGA    K   156_B      K   156_A     2.486     0    0.060   0.573     5.617   66.786   52.910
LGA    G   157_B      G   157_A     1.889     0    0.295   0.295     3.028   63.095   63.095
LGA    F   158_B      F   158_A     2.294     0    0.144   0.471     4.164   61.190   51.775
LGA    D   159_B      D   159_A     4.535     0    0.217   1.004     5.657   38.929   40.119
LGA    D   160_B      D   160_A     4.976     0    0.241   0.952     5.643   31.429   36.369
LGA    E   161_B      E   161_A     4.632     0    0.048   1.085     5.292   28.810   35.714
LGA    S   162_B      S   162_A     6.486     0    0.086   0.234     7.214   15.476   13.651
LGA    Y   163_B      Y   163_A     6.078     0    0.034   0.673     6.358   19.286   20.437
LGA    R   164_B      R   164_A     4.860     0    0.031   1.120     5.833   25.119   46.017
LGA    E   165_B      E   165_A     6.869     0    0.040   1.000     7.872   12.976   18.889
LGA    L   166_B      L   166_A     7.994     0    0.063   0.081     9.608    7.262    5.000
LGA    R   167_B      R   167_A     6.534     0    0.068   1.269     7.260   12.500   17.532
LGA    T   168_B      T   168_A     7.511     0    0.058   0.068     9.052    6.190    7.551
LGA    Q   169_B      Q   169_A     9.653     0    0.054   0.993    10.680    0.952    2.698
LGA    I   170_B      I   170_A     9.577     0    0.038   0.057     9.994    0.714    1.607
LGA    L   171_B      L   171_A     8.905     0    0.070   1.402    10.282    1.667    1.667
LGA    Q   172_B      Q   172_A    10.096     0    0.107   1.031    13.235    0.119    0.053
LGA    Y   173_B      Y   173_A    10.559     0    0.213   1.301    15.492    0.000    0.000
LGA    M   174_B      M   174_A     9.532     0    0.612   0.552    10.159    0.238    4.940
LGA    K   175_B      K   175_A    12.103     4    0.655   0.627    13.821    0.357    0.159

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      173     692    692  100.00    1441   1441  100.00               173
SUMMARY(RMSD_GDC):     3.591          3.549                  4.231           61.720   54.884

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  175  173    4.0    140    2.03    65.896    69.838     6.583

LGA_LOCAL      RMSD:   2.027  Number of atoms:  140  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   3.912  Number of assigned atoms:  173 
Std_ASGN_ATOMS RMSD:   3.591  Standard rmsd on all 173 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.875331 * X  +  -0.474681 * Y  +  -0.092053 * Z  +  11.956523
  Y_new =   0.482501 * X  +   0.845128 * Y  +   0.230111 * Z  + -66.015190
  Z_new =  -0.031433 * X  +  -0.245839 * Y  +   0.968801 * Z  +  18.293985 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  0.503781  0.031438 -0.248511   [DEG:   28.8645    1.8013  -14.2386 ]
ZXZ: -2.761054  0.250450 -3.014424   [DEG: -158.1967   14.3497 -172.7138 ]
 
# END of job
