
#######################################################
#                                                     #
#                        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  176 ( 1334),  selected  176 , name one
# Molecule2: number of CA atoms  176 ( 1334),  selected  176 , 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:   163       2_A - 164_A       4.97     9.41
  LONGEST_CONTINUOUS_SEGMENT:   163       3_A - 165_A       4.99     9.30
  LCS_AVERAGE:     89.26

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   120      41_A - 160_A       1.97     9.68
  LCS_AVERAGE:     56.36

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    79      51_A - 129_A       1.00     9.67
  LCS_AVERAGE:     23.88

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  176
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     M     1_A     M     1_A      4    4  162      3    3    4    4    4    4    4    5    5    5    5    5    6    6    6    8    8    8    8   10 
LCS_GDT     E     2_A     E     2_A      4    4  163      3    3    4    4    4    4    4    5    5    5    5    5    6    7    9   11   15   26   26   33 
LCS_GDT     Q     3_A     Q     3_A      4    4  163      3    3    4    4    4    4    4    5    5    6    6    8    8   16   17   21   26   36   44   54 
LCS_GDT     S     4_A     S     4_A      4    5  163      2    3    4    4    4    5    7    8   11   16   20   23   25   36   63   90   96  123  150  156 
LCS_GDT     S     5_A     S     5_A      5    8  163      3    3    5    7    9   11   14   23   28   35  102  116  122  134  140  144  146  152  155  156 
LCS_GDT     G     6_A     G     6_A      5    8  163      5    6    6    7    9   16   20   35   43   57  102  116  122  134  142  147  149  152  155  156 
LCS_GDT     D     7_A     D     7_A      5    8  163      5    6    6    7    9   17   30   44   55   63   83  116  137  142  144  148  150  152  155  156 
LCS_GDT     K     8_A     K     8_A      5    8  163      5    6    6    7    9   18   30   40   54   78  114  133  140  142  145  148  151  153  155  156 
LCS_GDT     D     9_A     D     9_A      5    8  163      5    6    6    7    9   18   28   38   50   77  113  133  140  142  145  148  151  153  155  156 
LCS_GDT     G    10_A     G    10_A      5    8  163      3    6    6    7    8   11   21   35   45   72  111  133  140  142  145  148  151  153  155  156 
LCS_GDT     G    11_A     G    11_A      3    8  163      3    3    5    6    8   27   51   92  129  138  140  143  146  148  149  151  151  153  155  156 
LCS_GDT     S    12_A     S    12_A      3    8  163      5    6    6    7    9   12   18   32   40   57   76  111  135  142  144  148  151  153  155  156 
LCS_GDT     D    13_A     D    13_A      3    8  163      3    3    6   13   30   72  116  132  136  140  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     S    14_A     S    14_A      3    6  163      3    3   10   25   67  113  127  134  136  140  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     G    15_A     G    15_A      6    6  163      3    5    6    8   10   37   44  104  126  133  137  141  146  146  149  151  151  153  155  156 
LCS_GDT     G    16_A     G    16_A      6    6  163      3    5   21   33   99  113  125  132  136  140  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     A    17_A     A    17_A      6    6  163      3    5    6   52  105  122  130  134  138  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     Q    18_A     Q    18_A      6  113  163     13   38   74  101  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     D    19_A     D    19_A      6  113  163      3    5   10   25   56   86  121  133  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     G    20_A     G    20_A      6  113  163      3    4    6   12   16   30   38   47  109  132  141  144  146  148  149  151  151  153  155  156 
LCS_GDT     G    21_A     G    21_A      3  116  163      3   12   43   63   79  115  131  134  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     S    22_A     S    22_A     12  116  163      3   57   92  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     L    23_A     L    23_A     12  116  163      3   10   74  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     D    24_A     D    24_A     12  116  163     17   61   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     S    25_A     S    25_A     12  116  163     22   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     L    26_A     L    26_A     12  116  163      6   63   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     K    27_A     K    27_A     12  116  163      6   55   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     K    28_A     K    28_A     12  116  163      6   46   79  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     Y    29_A     Y    29_A     12  116  163      6   57   92  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     N    30_A     N    30_A     12  116  163      6   59   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     G    31_A     G    31_A     12  116  163     17   58   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     K    32_A     K    32_A     12  116  163     16   58   92  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     L    33_A     L    33_A     12  116  163      5   61   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     P    34_A     P    34_A     10  116  163      5    6   19   58  100  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     K    35_A     K    35_A     10  116  163      5   17   40   58   86  111  130  134  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     H    36_A     H    36_A     10  116  163      6   24   44   72   96  122  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     D    37_A     D    37_A     10  116  163      6   24   44   72   96  122  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     P    38_A     P    38_A     10  116  163      6   22   44   72   95  120  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     S    39_A     S    39_A     10  116  163      6   24   44   72   95  120  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     F    40_A     F    40_A     10  116  163      6   22   44   72  104  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     V    41_A     V    41_A     10  120  163      6   13   41   72  103  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     Q    42_A     Q    42_A     10  120  163      5   35   73  104  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     P    43_A     P    43_A     10  120  163      3    8   56   88  115  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     G    44_A     G    44_A      6  120  163      3    6   18   39  110  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     N    45_A     N    45_A      5  120  163      3   22   51   87  113  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     R    46_A     R    46_A      5  120  163      3   18   74  104  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     H    47_A     H    47_A      5  120  163      3   25   60  102  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     Y    48_A     Y    48_A     14  120  163      3   28   61  101  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     K    49_A     K    49_A     14  120  163      3   17   64  103  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     Y    50_A     Y    50_A     44  120  163      4   24   53   90  110  122  130  134  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     Q    51_A     Q    51_A     79  120  163      8   47   86  105  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     C    52_A     C    52_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     T    53_A     T    53_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     W    54_A     W    54_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     Y    55_A     Y    55_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     A    56_A     A    56_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     Y    57_A     Y    57_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     N    58_A     N    58_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     R    59_A     R    59_A     79  120  163     22   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     R    60_A     R    60_A     79  120  163     10   64   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     G    61_A     G    61_A     79  120  163     19   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     Q    62_A     Q    62_A     79  120  163      8   11   57  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     L    63_A     L    63_A     79  120  163      8   11   42  107  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     G    64_A     G    64_A     79  120  163      8   62   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     I    65_A     I    65_A     79  120  163     16   64   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     P    66_A     P    66_A     79  120  163      3   57   91  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     V    67_A     V    67_A     79  120  163      6   57   92  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     P    68_A     P    68_A     79  120  163     19   64   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     L    69_A     L    69_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     W    70_A     W    70_A     79  120  163     24   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     G    71_A     G    71_A     79  120  163     16   64   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     D    72_A     D    72_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     A    73_A     A    73_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     A    74_A     A    74_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     D    75_A     D    75_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     W    76_A     W    76_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     I    77_A     I    77_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     G    78_A     G    78_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     G    79_A     G    79_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     A    80_A     A    80_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     K    81_A     K    81_A     79  120  163     17   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     G    82_A     G    82_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     A    83_A     A    83_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     G    84_A     G    84_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     Y    85_A     Y    85_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     G    86_A     G    86_A     79  120  163     19   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     V    87_A     V    87_A     79  120  163     25   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     G    88_A     G    88_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     R    89_A     R    89_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     T    90_A     T    90_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     P    91_A     P    91_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     K    92_A     K    92_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     Q    93_A     Q    93_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     G    94_A     G    94_A     79  120  163     18   55   88  107  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     A    95_A     A    95_A     79  120  163     22   59   92  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     C    96_A     C    96_A     79  120  163     26   60   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     V    97_A     V    97_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     I    98_A     I    98_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     W    99_A     W    99_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     Q   100_A     Q   100_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     R   101_A     R   101_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     G   102_A     G   102_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     V   103_A     V   103_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     Q   104_A     Q   104_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     G   105_A     G   105_A     79  120  163     24   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     G   106_A     G   106_A     79  120  163     25   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     S   107_A     S   107_A     79  120  163     14   62   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     P   108_A     P   108_A     79  120  163     11   58   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     Q   109_A     Q   109_A     79  120  163     21   63   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     Y   110_A     Y   110_A     79  120  163     24   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     G   111_A     G   111_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     H   112_A     H   112_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     V   113_A     V   113_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     A   114_A     A   114_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     F   115_A     F   115_A     79  120  163     26   65   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     V   116_A     V   116_A     79  120  163     26   65   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     E   117_A     E   117_A     79  120  163     26   62   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     K   118_A     K   118_A     79  120  163     26   65   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     V   119_A     V   119_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     L   120_A     L   120_A     79  120  163     20   65   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     D   121_A     D   121_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     G   122_A     G   122_A     79  120  163     26   65   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     G   123_A     G   123_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     K   124_A     K   124_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     K   125_A     K   125_A     79  120  163     20   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     I   126_A     I   126_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     F   127_A     F   127_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     I   128_A     I   128_A     79  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     S   129_A     S   129_A     79  120  163     25   55   92  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     E   130_A     E   130_A     67  120  163      5   32   67  106  116  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     H   131_A     H   131_A     50  120  163      5   12   27   47   87  113  126  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     N   132_A     N   132_A      8  120  163      5   12   24   41   72  109  126  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     Y   133_A     Y   133_A      7  120  163      5   15   41   72   88  119  130  134  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     A   134_A     A   134_A      7  120  163      5   19   77  103  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     T   135_A     T   135_A      7  120  163     15   46   92  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     P   136_A     P   136_A      7  120  163      4   11   44   74  106  113  122  135  140  141  143  144  146  148  149  151  151  153  154  156 
LCS_GDT     N   137_A     N   137_A      8  120  163      5    7   10   12   26   46   69   83  105  120  125  138  144  146  148  151  151  151  152  154 
LCS_GDT     G   138_A     G   138_A     19  120  163      5   10   23   45   69   90  113  121  126  137  142  144  146  148  149  151  151  152  154  156 
LCS_GDT     Y   139_A     Y   139_A     21  120  163      8   31   58   86  106  115  123  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     G   140_A     G   140_A     21  120  163      8   49   62   98  113  121  127  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     T   141_A     T   141_A     21  120  163     20   55   92  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     R   142_A     R   142_A     21  120  163     24   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     T   143_A     T   143_A     21  120  163     24   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     I   144_A     I   144_A     21  120  163     21   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     D   145_A     D   145_A     21  120  163     20   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     M   146_A     M   146_A     21  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     S   147_A     S   147_A     21  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     S   148_A     S   148_A     21  120  163     21   63   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     A   149_A     A   149_A     21  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     I   150_A     I   150_A     21  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     G   151_A     G   151_A     21  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     K   152_A     K   152_A     21  120  163     22   66   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     N   153_A     N   153_A     21  120  163     20   66   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     A   154_A     A   154_A     21  120  163     20   65   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     Q   155_A     Q   155_A     21  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     F   156_A     F   156_A     21  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     I   157_A     I   157_A     21  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     Y   158_A     Y   158_A     21  120  163     26   67   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     D   159_A     D   159_A     21  120  163      4   29   93  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     K   160_A     K   160_A     21  120  163      7   52   89  109  117  123  131  135  140  141  143  144  146  148  149  151  151  153  155  156 
LCS_GDT     K   161_A     K   161_A      4  116  163      3   14   35   57   63   75   88  109  123  132  137  144  146  148  149  151  151  153  155  156 
LCS_GDT     K   162_A     K   162_A      5   76  163      3    4   27   37   56   63   80   88   98  119  130  137  140  146  149  151  151  153  155  156 
LCS_GDT     N   163_A     N   163_A      5    7  163      3    4    5    7   15   37   58   65   70   81   94  101  119  131  139  142  145  148  153  156 
LCS_GDT     S   164_A     S   164_A      5    7  163      3    4    5    6    9   11   14   15   16   19   24   25   51   75   90   98  112  120  134  143 
LCS_GDT     S   165_A     S   165_A      5    7  163      3    4    5    6    9   11   14   15   16   17   19   23   28   36   39   47   76  105  115  133 
LCS_GDT     S   166_A     S   166_A      5    7  162      3    4    5    6    9   11   36   43   59   68   74   79   86   92  106  120  131  137  142  145 
LCS_GDT     V   167_A     V   167_A      3    7  161      3    3    5    6    9   14   21   29   36   40   49   65   70   78   85   99  110  123  132  139 
LCS_GDT     D   168_A     D   168_A      6    7  161      5    5    6    7    8   10   12   22   32   39   46   53   63   71   79   85   98  108  119  130 
LCS_GDT     K   169_A     K   169_A      6    7  159      5    5    6    7    8   10   17   29   33   40   46   55   65   73   81   92  106  116  125  136 
LCS_GDT     L   170_A     L   170_A      6    7   16      5    5    6    7    8   10   11   13   16   16   18   20   25   29   31   32   60   67   75   80 
LCS_GDT     A   171_A     A   171_A      6    7   16      5    5    6    7    8   10   12   13   16   16   18   19   25   29   31   32   35   37   41   42 
LCS_GDT     A   172_A     A   172_A      6    7   16      5    5    6    7    8   10   12   13   16   16   18   20   25   29   31   32   35   44   47   48 
LCS_GDT     A   173_A     A   173_A      6    7   16      4    5    6    7    8   10   12   13   16   16   18   21   25   29   31   32   38   51   59   76 
LCS_GDT     L   174_A     L   174_A      5    7   16      3    4    6    7    8   10   12   13   16   16   18   22   25   27   30   32   34   37   41   42 
LCS_GDT     E   175_A     E   175_A      4    5   16      3    4    4    4    5    9   12   13   16   16   18   22   23   26   28   31   33   37   41   44 
LCS_GDT     H   176_A     H   176_A      4    5   16      0    4    4    4    5    8    8   11   13   14   18   22   23   26   28   31   45   49   59   63 
LCS_AVERAGE  LCS_A:  56.50  (  23.88   56.36   89.26 )

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     26     67     93    109    117    123    131    135    140    141    143    144    146    148    149    151    151    153    155    156 
GDT PERCENT_AT  14.77  38.07  52.84  61.93  66.48  69.89  74.43  76.70  79.55  80.11  81.25  81.82  82.95  84.09  84.66  85.80  85.80  86.93  88.07  88.64
GDT RMS_LOCAL    0.33   0.66   0.88   1.08   1.25   1.39   1.71   1.85   2.01   2.04   2.13   2.19   2.34   2.49   2.58   2.79   2.79   3.23   3.77   3.92
GDT RMS_ALL_AT   9.72   9.66   9.73   9.79   9.75   9.69   9.76   9.80   9.77   9.76   9.74   9.72   9.69   9.66   9.65   9.61   9.61   9.54   9.55   9.56

# Checking swapping
#   possible swapping detected:  E     2_A      E     2_A
#   possible swapping detected:  D    19_A      D    19_A
#   possible swapping detected:  Y    48_A      Y    48_A
#   possible swapping detected:  Y    55_A      Y    55_A
#   possible swapping detected:  Y    57_A      Y    57_A
#   possible swapping detected:  D    72_A      D    72_A
#   possible swapping detected:  Y    85_A      Y    85_A
#   possible swapping detected:  Y   110_A      Y   110_A
#   possible swapping detected:  F   115_A      F   115_A
#   possible swapping detected:  E   117_A      E   117_A
#   possible swapping detected:  F   127_A      F   127_A
#   possible swapping detected:  Y   133_A      Y   133_A
#   possible swapping detected:  F   156_A      F   156_A
#   possible swapping detected:  D   159_A      D   159_A
#   possible swapping detected:  E   175_A      E   175_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    M     1_A      M     1_A    29.965     0    0.045   1.003    32.936    0.000    0.000
LGA    E     2_A      E     2_A    27.045     0    0.122   1.087    29.033    0.000    0.000
LGA    Q     3_A      Q     3_A    22.200     0    0.675   0.918    29.182    0.000    0.000
LGA    S     4_A      S     4_A    19.653     0    0.520   0.608    22.173    0.000    0.000
LGA    S     5_A      S     5_A    20.966     0    0.654   0.687    23.143    0.000    0.000
LGA    G     6_A      G     6_A    19.632     0    0.479   0.479    19.632    0.000    0.000
LGA    D     7_A      D     7_A    17.992     0    0.095   1.386    23.162    0.000    0.000
LGA    K     8_A      K     8_A    15.398     0    0.121   0.761    16.036    0.000    0.000
LGA    D     9_A      D     9_A    14.614     0    0.056   1.166    19.084    0.000    0.000
LGA    G    10_A      G    10_A    12.187     0    0.222   0.222    12.187    0.000    0.000
LGA    G    11_A      G    11_A     8.086     0    0.516   0.516     9.542    2.024    2.024
LGA    S    12_A      S    12_A    11.828     0    0.581   0.765    16.388    0.000    0.000
LGA    D    13_A      D    13_A     6.664     0    0.477   0.993     8.285   13.095   20.952
LGA    S    14_A      S    14_A     5.702     0    0.428   0.383     5.965   23.929   25.556
LGA    G    15_A      G    15_A     8.946     0    0.175   0.175     9.976    3.810    3.810
LGA    G    16_A      G    16_A     5.711     0    0.195   0.195     6.554   25.833   25.833
LGA    A    17_A      A    17_A     4.643     0    0.050   0.058     5.373   34.524   33.905
LGA    Q    18_A      Q    18_A     3.236     0    0.316   1.235     6.314   50.000   40.688
LGA    D    19_A      D    19_A     5.209     0    0.203   1.418     8.890   22.024   13.810
LGA    G    20_A      G    20_A     8.054     0    0.439   0.439     8.054    8.214    8.214
LGA    G    21_A      G    21_A     4.202     0    0.424   0.424     5.125   37.619   37.619
LGA    S    22_A      S    22_A     1.464     0    0.126   0.641     2.600   73.214   69.127
LGA    L    23_A      L    23_A     1.866     0    0.456   0.453     4.607   60.476   72.143
LGA    D    24_A      D    24_A     0.625     0    0.051   0.762     3.752   92.857   76.548
LGA    S    25_A      S    25_A     0.654     0    0.156   0.620     1.743   86.190   86.111
LGA    L    26_A      L    26_A     1.113     0    0.118   0.119     1.586   85.952   82.619
LGA    K    27_A      K    27_A     1.326     0    0.019   1.043     3.672   81.429   75.556
LGA    K    28_A      K    28_A     1.835     0    0.021   0.498     3.255   72.857   64.233
LGA    Y    29_A      Y    29_A     1.147     0    0.055   0.190     3.187   85.952   74.087
LGA    N    30_A      N    30_A     0.709     0    0.092   1.208     3.961   90.476   75.476
LGA    G    31_A      G    31_A     0.902     0    0.062   0.062     0.934   90.476   90.476
LGA    K    32_A      K    32_A     1.025     0    0.256   1.043     4.631   79.524   63.069
LGA    L    33_A      L    33_A     0.796     0    0.019   0.160     1.997   84.048   82.798
LGA    P    34_A      P    34_A     3.425     0    0.060   0.120     4.233   57.381   50.544
LGA    K    35_A      K    35_A     4.886     0    0.012   0.951    14.484   34.286   17.460
LGA    H    36_A      H    36_A     4.087     0    0.073   1.246     5.801   35.714   35.095
LGA    D    37_A      D    37_A     4.265     0    0.013   0.909     6.073   38.690   33.988
LGA    P    38_A      P    38_A     4.340     0    0.086   0.321     4.914   37.143   35.510
LGA    S    39_A      S    39_A     4.346     0    0.037   0.254     4.486   37.143   38.175
LGA    F    40_A      F    40_A     3.827     0    0.079   0.159     3.963   43.333   46.364
LGA    V    41_A      V    41_A     3.660     0    0.075   1.084     6.168   50.238   39.524
LGA    Q    42_A      Q    42_A     2.279     0    0.070   1.293     4.897   62.857   54.762
LGA    P    43_A      P    43_A     3.060     0    0.592   0.583     4.885   50.357   45.646
LGA    G    44_A      G    44_A     3.144     0    0.108   0.108     3.391   53.571   53.571
LGA    N    45_A      N    45_A     3.188     0    0.577   1.276     8.646   55.476   35.357
LGA    R    46_A      R    46_A     2.364     0    0.201   0.870     4.049   64.762   65.238
LGA    H    47_A      H    47_A     2.935     0    0.143   0.603     6.054   57.143   42.238
LGA    Y    48_A      Y    48_A     2.794     0    0.142   0.227     5.449   57.143   43.571
LGA    K    49_A      K    49_A     2.775     0    0.654   1.004     5.957   62.976   43.598
LGA    Y    50_A      Y    50_A     4.242     0    0.073   1.258    10.464   41.905   20.198
LGA    Q    51_A      Q    51_A     2.290     0    0.039   1.107     7.123   66.905   48.148
LGA    C    52_A      C    52_A     0.988     0    0.094   0.135     1.346   88.214   88.968
LGA    T    53_A      T    53_A     0.374     0    0.020   0.067     0.581   97.619   98.639
LGA    W    54_A      W    54_A     0.320     0    0.021   1.481     6.758  100.000   70.510
LGA    Y    55_A      Y    55_A     0.850     0    0.085   1.526    10.579   88.214   48.730
LGA    A    56_A      A    56_A     0.874     0    0.029   0.037     0.948   90.476   90.476
LGA    Y    57_A      Y    57_A     0.613     0    0.043   1.387     6.928   90.476   63.413
LGA    N    58_A      N    58_A     0.946     0    0.028   1.105     3.522   88.214   81.190
LGA    R    59_A      R    59_A     0.957     0    0.106   1.220     6.751   83.810   56.104
LGA    R    60_A      R    60_A     1.206     0    0.052   0.916     3.770   81.429   73.203
LGA    G    61_A      G    61_A     1.149     0    0.117   0.117     1.614   79.405   79.405
LGA    Q    62_A      Q    62_A     2.303     0    0.072   1.021     5.350   64.881   54.021
LGA    L    63_A      L    63_A     2.241     0    0.026   0.141     3.716   68.810   62.202
LGA    G    64_A      G    64_A     1.405     0    0.052   0.052     1.647   83.810   83.810
LGA    I    65_A      I    65_A     0.785     0    0.269   0.292     1.717   83.810   81.548
LGA    P    66_A      P    66_A     1.345     0    0.093   0.240     1.542   81.548   81.565
LGA    V    67_A      V    67_A     1.291     0    0.019   0.077     1.494   83.690   82.721
LGA    P    68_A      P    68_A     0.876     0    0.045   0.295     0.988   90.476   90.476
LGA    L    69_A      L    69_A     0.638     0    0.020   0.271     0.815   90.476   90.476
LGA    W    70_A      W    70_A     0.837     0    0.661   0.510     3.346   78.095   86.939
LGA    G    71_A      G    71_A     1.180     0    0.284   0.284     2.346   77.262   77.262
LGA    D    72_A      D    72_A     0.944     0    0.082   0.822     2.309   90.476   82.798
LGA    A    73_A      A    73_A     0.733     0    0.047   0.044     0.945   90.476   90.476
LGA    A    74_A      A    74_A     0.488     0    0.014   0.028     0.688   92.857   92.381
LGA    D    75_A      D    75_A     0.531     0    0.039   0.516     2.348   97.619   89.702
LGA    W    76_A      W    76_A     0.320     0    0.011   0.088     0.390  100.000  100.000
LGA    I    77_A      I    77_A     0.322     0    0.013   0.115     0.577  100.000   97.619
LGA    G    78_A      G    78_A     0.547     0    0.067   0.067     0.588   92.857   92.857
LGA    G    79_A      G    79_A     0.478     0    0.038   0.038     0.499  100.000  100.000
LGA    A    80_A      A    80_A     0.443     0    0.048   0.056     0.594   95.238   94.286
LGA    K    81_A      K    81_A     0.872     0    0.028   0.803     2.907   90.476   80.847
LGA    G    82_A      G    82_A     1.203     0    0.029   0.029     1.334   81.429   81.429
LGA    A    83_A      A    83_A     0.889     0    0.084   0.079     0.889   90.476   90.476
LGA    G    84_A      G    84_A     0.714     0    0.039   0.039     0.744   90.476   90.476
LGA    Y    85_A      Y    85_A     0.521     0    0.092   0.601     2.180   95.238   87.024
LGA    G    86_A      G    86_A     0.548     0    0.088   0.088     0.548   97.619   97.619
LGA    V    87_A      V    87_A     0.221     0    0.035   1.069     2.591  100.000   88.844
LGA    G    88_A      G    88_A     1.104     0    0.075   0.075     1.104   88.214   88.214
LGA    R    89_A      R    89_A     0.722     0    0.089   1.226     6.792   92.857   68.052
LGA    T    90_A      T    90_A     0.598     0    0.017   0.059     0.925   90.476   90.476
LGA    P    91_A      P    91_A     0.902     0    0.121   0.158     1.280   85.952   87.959
LGA    K    92_A      K    92_A     0.941     0    0.036   0.587     4.104   88.214   77.672
LGA    Q    93_A      Q    93_A     1.344     0    0.040   0.344     2.645   79.405   72.275
LGA    G    94_A      G    94_A     2.633     0    0.211   0.211     3.609   55.595   55.595
LGA    A    95_A      A    95_A     1.856     0    0.020   0.038     1.989   77.143   76.286
LGA    C    96_A      C    96_A     1.767     0    0.057   0.819     2.406   77.143   77.302
LGA    V    97_A      V    97_A     0.324     0    0.034   1.119     2.226   97.619   88.571
LGA    I    98_A      I    98_A     0.690     0    0.024   0.073     0.974   90.476   90.476
LGA    W    99_A      W    99_A     0.729     0    0.078   0.141     1.021   88.214   93.231
LGA    Q   100_A      Q   100_A     0.708     0    0.047   0.491     1.527   90.476   87.513
LGA    R   101_A      R   101_A     0.530     0    0.062   1.295     3.966   90.595   78.658
LGA    G   102_A      G   102_A     1.296     0    0.115   0.115     2.239   79.524   79.524
LGA    V   103_A      V   103_A     1.047     0    0.033   0.074     1.241   85.952   85.306
LGA    Q   104_A      Q   104_A     1.359     0    0.026   0.852     4.752   81.429   67.831
LGA    G   105_A      G   105_A     1.082     0    0.027   0.027     1.178   85.952   85.952
LGA    G   106_A      G   106_A     0.697     0    0.064   0.064     0.763   90.476   90.476
LGA    S   107_A      S   107_A     1.016     0    0.099   0.682     3.733   85.952   78.095
LGA    P   108_A      P   108_A     1.059     0    0.041   0.271     1.317   85.952   85.306
LGA    Q   109_A      Q   109_A     0.870     0    0.028   0.935     2.420   90.476   82.751
LGA    Y   110_A      Y   110_A     0.521     0    0.109   0.196     2.867   92.857   79.762
LGA    G   111_A      G   111_A     0.427     0    0.073   0.073     0.631   95.238   95.238
LGA    H   112_A      H   112_A     0.358     0    0.035   0.487     2.340  100.000   90.143
LGA    V   113_A      V   113_A     0.738     0    0.037   1.243     2.468   88.214   80.544
LGA    A   114_A      A   114_A     1.210     0    0.040   0.063     1.438   83.690   83.238
LGA    F   115_A      F   115_A     1.728     0    0.041   0.221     2.456   72.857   69.177
LGA    V   116_A      V   116_A     1.641     0    0.084   0.084     1.847   72.857   76.531
LGA    E   117_A      E   117_A     2.103     0    0.043   0.142     2.695   68.810   65.714
LGA    K   118_A      K   118_A     1.930     0    0.052   0.645     2.981   75.000   69.471
LGA    V   119_A      V   119_A     1.541     0    0.079   0.114     2.107   70.833   75.374
LGA    L   120_A      L   120_A     1.840     0    0.058   0.105     2.213   72.857   69.821
LGA    D   121_A      D   121_A     1.348     0    0.211   1.270     5.073   77.143   64.524
LGA    G   122_A      G   122_A     1.161     0    0.288   0.288     2.194   77.262   77.262
LGA    G   123_A      G   123_A     0.964     0    0.155   0.155     1.243   88.214   88.214
LGA    K   124_A      K   124_A     0.634     0    0.115   0.633     1.103   88.214   87.460
LGA    K   125_A      K   125_A     1.355     0    0.077   0.923     3.742   81.429   74.339
LGA    I   126_A      I   126_A     1.230     0    0.062   0.061     1.367   81.429   83.690
LGA    F   127_A      F   127_A     1.633     0    0.033   0.164     3.236   75.000   64.459
LGA    I   128_A      I   128_A     1.556     0    0.033   0.044     1.888   72.857   77.143
LGA    S   129_A      S   129_A     2.252     0    0.106   0.695     4.616   66.786   59.286
LGA    E   130_A      E   130_A     2.557     0    0.070   0.652     5.158   55.476   49.206
LGA    H   131_A      H   131_A     4.283     0    0.406   0.496     7.019   29.167   38.143
LGA    N   132_A      N   132_A     4.781     0    0.275   1.281    10.315   30.357   17.857
LGA    Y   133_A      Y   133_A     4.332     0    0.058   0.151     9.777   40.238   21.746
LGA    A   134_A      A   134_A     2.577     0    0.033   0.031     3.544   69.286   64.095
LGA    T   135_A      T   135_A     1.862     0    0.026   0.075     4.304   69.405   60.272
LGA    P   136_A      P   136_A     4.807     0    0.142   0.419     6.670   27.976   32.925
LGA    N   137_A      N   137_A     9.086     0    0.284   1.030    14.540    4.048    2.024
LGA    G   138_A      G   138_A     6.231     0    0.133   0.133     7.090   19.881   19.881
LGA    Y   139_A      Y   139_A     4.205     0    0.061   1.007     6.927   35.952   32.857
LGA    G   140_A      G   140_A     3.380     0    0.014   0.014     3.608   50.119   50.119
LGA    T   141_A      T   141_A     2.436     0    0.024   0.079     2.821   62.857   60.408
LGA    R   142_A      R   142_A     1.938     0    0.037   0.552     3.411   72.857   65.714
LGA    T   143_A      T   143_A     1.744     0    0.018   0.077     2.197   72.857   71.701
LGA    I   144_A      I   144_A     1.208     0    0.026   0.551     1.347   81.429   84.821
LGA    D   145_A      D   145_A     1.426     0    0.020   1.112     3.339   79.286   75.357
LGA    M   146_A      M   146_A     0.966     0    0.024   0.609     1.782   83.690   84.881
LGA    S   147_A      S   147_A     1.512     0    0.054   0.536     3.539   72.976   69.444
LGA    S   148_A      S   148_A     2.032     0    0.037   0.750     3.739   72.976   66.667
LGA    A   149_A      A   149_A     1.606     0    0.017   0.037     1.794   77.143   76.286
LGA    I   150_A      I   150_A     0.815     0    0.012   0.603     2.770   90.595   85.238
LGA    G   151_A      G   151_A     0.674     0    0.073   0.073     0.819   90.476   90.476
LGA    K   152_A      K   152_A     1.368     0    0.043   1.266     7.697   79.286   59.947
LGA    N   153_A      N   153_A     1.130     0    0.042   0.062     1.430   83.690   82.560
LGA    A   154_A      A   154_A     0.856     0    0.047   0.065     1.362   85.952   86.857
LGA    Q   155_A      Q   155_A     0.852     0    0.025   0.944     2.266   90.476   84.762
LGA    F   156_A      F   156_A     0.675     0    0.020   0.149     1.277   90.476   88.009
LGA    I   157_A      I   157_A     0.333     0    0.030   0.093     0.608   95.238   97.619
LGA    Y   158_A      Y   158_A     0.607     0    0.288   0.421     2.235   86.429   86.865
LGA    D   159_A      D   159_A     1.558     0    0.045   0.172     6.765   69.286   48.274
LGA    K   160_A      K   160_A     2.221     0    0.640   1.075     3.883   60.476   64.762
LGA    K   161_A      K   161_A     8.331     0    0.068   0.912    16.459    7.619    3.386
LGA    K   162_A      K   162_A    10.458     0    0.569   0.916    14.916    0.357    8.519
LGA    N   163_A      N   163_A    14.856     0    0.142   1.191    16.618    0.000    0.000
LGA    S   164_A      S   164_A    21.212     0    0.466   0.486    24.154    0.000    0.000
LGA    S   165_A      S   165_A    23.864     0    0.379   0.665    25.029    0.000    0.000
LGA    S   166_A      S   166_A    20.394     0    0.639   0.938    22.098    0.000    0.000
LGA    V   167_A      V   167_A    23.090     0    0.602   0.907    24.549    0.000    0.000
LGA    D   168_A      D   168_A    23.715     0    0.660   1.058    26.973    0.000    0.000
LGA    K   169_A      K   169_A    23.371     0    0.109   0.868    26.215    0.000    0.000
LGA    L   170_A      L   170_A    25.477     0    0.020   0.786    30.164    0.000    0.000
LGA    A   171_A      A   171_A    30.365     0    0.053   0.069    34.730    0.000    0.000
LGA    A   172_A      A   172_A    33.645     0    0.078   0.073    36.115    0.000    0.000
LGA    A   173_A      A   173_A    33.026     0    0.598   0.545    33.968    0.000    0.000
LGA    L   174_A      L   174_A    36.867     0    0.220   1.194    39.033    0.000    0.000
LGA    E   175_A      E   175_A    38.980     0    0.688   1.074    41.852    0.000    0.000
LGA    H   176_A      H   176_A    36.229     0    0.673   0.870    37.489    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      176     704    704  100.00    1334   1334  100.00               176
SUMMARY(RMSD_GDC):     8.730          8.793                  8.969           61.508   57.515

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  176  176    4.0    135    1.85    65.625    66.156     6.906

LGA_LOCAL      RMSD:   1.855  Number of atoms:  135  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   9.796  Number of assigned atoms:  176 
Std_ASGN_ATOMS RMSD:   8.730  Standard rmsd on all 176 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.110454 * X  +  -0.302902 * Y  +  -0.946599 * Z  +   1.010425
  Y_new =  -0.290779 * X  +  -0.900904 * Y  +   0.322209 * Z  +  -2.335087
  Z_new =  -0.950393 * X  +   0.310840 * Y  +   0.011431 * Z  +   1.212315 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -1.933817  1.254498  1.534038   [DEG: -110.7996   71.8774   87.8939 ]
ZXZ: -1.898881  1.559365 -1.254698   [DEG: -108.7979   89.3450  -71.8889 ]
 
# END of job
