
#######################################################
#                                                     #
#                        LGA                          #
#                  ---------------                    #
#                                                     #
#               Local-Global Alignment                #
#        A Method for Finding 3-D Similarities        #
#               in Protein Structures                 #
#                                                     #
#                  ------------ 10/2009               #
#                                                     #
#      Adam Zemla (adamz@llnl.gov)                    #
#      Lawrence Livermore National Laboratory, CA     #
#                                                     #
#######################################################

!!!   License for LGA program has expired  !!!
#   For updated version of the LGA program   #
# please contact Adam Zemla:  adamz@llnl.gov #

# Molecule1: number of CA atoms  205 ( 1624),  selected  205 , name one
# Molecule2: number of CA atoms  205 ( 1624),  selected  205 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:A  -ch2:A  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   132       1_A - 132_A       4.57    86.55
  LCS_AVERAGE:     43.56

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   126       2_A - 127_A       2.00    87.29
  LONGEST_CONTINUOUS_SEGMENT:   126       3_A - 128_A       1.95    87.11
  LCS_AVERAGE:     39.42

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    45       4_A - 48_A        0.99    86.56
  LCS_AVERAGE:     12.10

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  205
LCS_GDT     RESIDUE       RESIDUE       SEGMENT_SIZE    GLOBAL DISTANCE TEST COLUMNS: number of residues under the threshold assigned to each residue pair
LCS_GDT   NAME NUMBER   NAME NUMBER    1.0  2.0  5.0    0.5  1.0  1.5  2.0  2.5  3.0  3.5  4.0  4.5  5.0  5.5  6.0  6.5  7.0  7.5  8.0  8.5  9.0  9.5 10.0
LCS_GDT     S     1_A     S     1_A      3    4  132      3    3    3    4    4    5    5    5    6   11   15   15   16   17   87   98  115  119  122  124 
LCS_GDT     M     2_A     M     2_A      3  126  132      3    3    3    4    4    5    6    8    9   82   92   99  115  117  125  125  125  125  126  127 
LCS_GDT     N     3_A     N     3_A      3  126  132      3    8   18   23   78  111  118  120  123  123  124  124  124  125  126  126  126  126  126  127 
LCS_GDT     I     4_A     I     4_A     45  126  132     12   51   97  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     E     5_A     E     5_A     45  126  132     15   73   98  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     V     6_A     V     6_A     45  126  132     19   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     A     7_A     A     7_A     45  126  132     14   73   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     R     8_A     R     8_A     45  126  132     14   73   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     A     9_A     A     9_A     45  126  132     23   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     A    10_A     A    10_A     45  126  132     24   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     R    11_A     R    11_A     45  126  132     26   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     L    12_A     L    12_A     45  126  132     27   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     A    13_A     A    13_A     45  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     Q    14_A     Q    14_A     45  126  132     25   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     I    15_A     I    15_A     45  126  132     22   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     F    16_A     F    16_A     45  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     K    17_A     K    17_A     45  126  132     29   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     E    18_A     E    18_A     45  126  132     23   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     I    19_A     I    19_A     45  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     C    20_A     C    20_A     45  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     D    21_A     D    21_A     45  126  132     31   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     G    22_A     G    22_A     45  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     I    23_A     I    23_A     45  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     I    24_A     I    24_A     45  126  132     24   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     S    25_A     S    25_A     45  126  132     21   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     Y    26_A     Y    26_A     45  126  132     27   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     R    27_A     R    27_A     45  126  132     24   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     D    28_A     D    28_A     45  126  132     23   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     S    29_A     S    29_A     45  126  132     16   73   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     S    30_A     S    30_A     45  126  132     10   55   98  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     Q    31_A     Q    31_A     45  126  132     15   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     Q    32_A     Q    32_A     45  126  132     13   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     T    33_A     T    33_A     45  126  132     13   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     L    34_A     L    34_A     45  126  132     27   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     A    35_A     A    35_A     45  126  132     21   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     A    36_A     A    36_A     45  126  132     21   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     P    37_A     P    37_A     45  126  132     21   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     L    38_A     L    38_A     45  126  132     21   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     L    39_A     L    39_A     45  126  132     16   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     N    40_A     N    40_A     45  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     L    41_A     L    41_A     45  126  132     29   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     P    42_A     P    42_A     45  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     P    43_A     P    43_A     45  126  132      5   50   97  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     K    44_A     K    44_A     45  126  132     29   74   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     K    45_A     K    45_A     45  126  132     28   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     K    46_A     K    46_A     45  126  132      8   64   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     N    47_A     N    47_A     45  126  132     17   67   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     A    48_A     A    48_A     45  126  132      4   67   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     D    49_A     D    49_A     18  126  132      5   53   95  112  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     Y    50_A     Y    50_A     40  126  132      9   67   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     Y    51_A     Y    51_A     41  126  132     27   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     E    52_A     E    52_A     41  126  132      8   59   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     K    53_A     K    53_A     41  126  132      3   14   64  103  115  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     I    54_A     I    54_A     41  126  132     22   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     S    55_A     S    55_A     41  126  132      3   20   73   99  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     D    56_A     D    56_A     41  126  132     10   58   98  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     P    57_A     P    57_A     41  126  132      3   55   98  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     L    58_A     L    58_A     41  126  132     28   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     D    59_A     D    59_A     41  126  132     24   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     L    60_A     L    60_A     41  126  132     28   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     S    61_A     S    61_A     41  126  132      9   74   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     T    62_A     T    62_A     41  126  132     15   71   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     I    63_A     I    63_A     41  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     E    64_A     E    64_A     41  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     K    65_A     K    65_A     41  126  132     15   74   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     Q    66_A     Q    66_A     41  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     I    67_A     I    67_A     41  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     L    68_A     L    68_A     41  126  132      9   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     I    69_A     I    69_A     41  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     G    70_A     G    70_A     41  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     Y    71_A     Y    71_A     41  126  132     27   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     Y    72_A     Y    72_A     41  126  132     11   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     K    73_A     K    73_A     41  126  132     13   61   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     T    74_A     T    74_A     41  126  132     17   73   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     V    75_A     V    75_A     41  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     E    76_A     E    76_A     41  126  132     13   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     A    77_A     A    77_A     41  126  132     23   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     F    78_A     F    78_A     41  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     D    79_A     D    79_A     41  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     A    80_A     A    80_A     41  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     D    81_A     D    81_A     41  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     M    82_A     M    82_A     41  126  132     23   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     L    83_A     L    83_A     41  126  132     30   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     K    84_A     K    84_A     41  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     V    85_A     V    85_A     41  126  132     19   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     F    86_A     F    86_A     41  126  132     20   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     R    87_A     R    87_A     41  126  132     23   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     N    88_A     N    88_A     41  126  132     13   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     A    89_A     A    89_A     41  126  132     19   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     E    90_A     E    90_A     41  126  132     15   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     K    91_A     K    91_A     41  126  132     15   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     Y    92_A     Y    92_A     41  126  132      3   55   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     Y    93_A     Y    93_A     41  126  132     14   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     G    94_A     G    94_A     41  126  132      3    9   54  107  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     R    95_A     R    95_A      4  126  132      3    4    4    5   18   30   43   94  118  122  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     K    96_A     K    96_A      4  126  132      3    7   15   23   93  109  118  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     S    97_A     S    97_A      4  126  132      3    4   22   35   87  109  116  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     P    98_A     P    98_A      4  126  132      8   17   23   39   96  114  118  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     I    99_A     I    99_A     28  126  132     10   61   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     G   100_A     G   100_A     28  126  132      6   36   97  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     R   101_A     R   101_A     28  126  132      6   63   97  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     D   102_A     D   102_A     28  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     V   103_A     V   103_A     28  126  132     27   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     C   104_A     C   104_A     28  126  132      6   74   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     R   105_A     R   105_A     28  126  132     23   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     L   106_A     L   106_A     28  126  132     23   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     R   107_A     R   107_A     28  126  132     23   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     K   108_A     K   108_A     28  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     A   109_A     A   109_A     28  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     Y   110_A     Y   110_A     28  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     Y   111_A     Y   111_A     28  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     S   112_A     S   112_A     28  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     A   113_A     A   113_A     28  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     R   114_A     R   114_A     28  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     H   115_A     H   115_A     28  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     E   116_A     E   116_A     28  126  132     28   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     A   117_A     A   117_A     28  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     S   118_A     S   118_A     28  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     A   119_A     A   119_A     28  126  132     13   65   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     Q   120_A     Q   120_A     28  126  132     32   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     I   121_A     I   121_A     28  126  132     25   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     D   122_A     D   122_A     28  126  132     16   66   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     E   123_A     E   123_A     28  126  132     19   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     I   124_A     I   124_A     28  126  132     24   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     V   125_A     V   125_A     28  126  132     20   76   99  113  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     G   126_A     G   126_A     28  126  132     12   27   90  111  118  119  119  122  123  123  124  124  125  125  126  126  126  126  126  127 
LCS_GDT     E   127_A     E   127_A      4  126  132      4    4    4    8   15   33   50   87  105  119  122  122  125  125  126  126  126  126  126  127 
LCS_GDT     T   128_A     T   128_A      4  126  132      4    5    8   13   21   32   61   94  113  119  122  122  125  125  126  126  126  126  126  127 
LCS_GDT     A   129_A     A   129_A      4    7  132      4    4    4    6    6    7    9   10   12   15   28   37   45   60   75  116  121  123  124  127 
LCS_GDT     S   130_A     S   130_A      4    7  132      3    4    4    6    6    7    9   11   15   16   18   24   29   30   37   54   84  108  120  123 
LCS_GDT     E   131_A     E   131_A      4    7  132      3    4    4    6    6    7    9   10   11   12   13   15   16   17   20   31   32   33   34   46 
LCS_GDT     A   132_A     A   132_A      4    7  132      3    4    4    6    6    7    9   10   11   12   13   15   16   17   18   21   23   28   30   33 
LCS_GDT     D   133_A     D   133_A      4    7   15      3    4    4    6    6    7    9   10   11   12   13   15   16   17   18   19   21   25   27   31 
LCS_GDT     S   134_A     S   134_A      4    7   15      3    3    4    5    6    7    9   10   11   12   13   15   16   17   18   21   23   25   28   31 
LCS_GDT     S   135_A     S   135_A      4    7   15      3    4    4    5    6    7    8   10   11   12   13   15   16   17   18   19   20   22   23   25 
LCS_GDT     E   136_A     E   136_A      4    7   15      3    4    4    5    6    7    8    9   11   12   13   14   15   17   18   19   20   22   23   25 
LCS_GDT     T   137_A     T   137_A      4    6   15      3    4    4    5    6    7    8    9   10   12   12   12   15   16   18   19   20   22   23   24 
LCS_GDT     S   138_A     S   138_A      4    6   14      3    4    4    5    5    6    8    9    9   10   10   12   13   13   17   17   18   22   23   24 
LCS_GDT     V   139_A     V   139_A      4    5   12      3    4    4    5    5    6    8    9    9   10   10   10   11   11   12   12   13   14   16   18 
LCS_GDT     S   140_A     S   140_A      4    6   12      3    4    4    5    5    6    8    9    9   10   10   10   11   11   12   12   13   13   14   14 
LCS_GDT     E   141_A     E   141_A      4    6   12      3    4    4    5    5    6    8    9    9   10   10   10   11   11   12   12   13   13   14   15 
LCS_GDT     K   142_A     K   142_A      4    6   12      3    4    4    5    5    6    8    9    9   10   10   10   11   11   12   12   13   13   14   15 
LCS_GDT     E   143_A     E   143_A      4    6   12      3    4    4    5    5    6    8    9    9   10   10   10   11   11   12   12   13   13   14   15 
LCS_GDT     S   144_A     S   144_A      4    6   12      3    4    4    5    5    7    8    9    9   10   10   10   11   11   12   12   13   13   14   15 
LCS_GDT     G   145_A     G   145_A      4    6   12      3    4    5    5    6    7    8    9    9   10   10   10   11   11   12   12   13   13   14   15 
LCS_GDT     H   146_A     H   146_A      4    6   12      3    4    4    5    6    7    8    8    9   10   10   10   11   11   12   12   13   13   14   15 
LCS_GDT     E   147_A     E   147_A      4    6   12      3    4    5    5    6    7    8    8    8    9    9   10   11   11   12   12   13   13   14   15 
LCS_GDT     K   148_A     K   148_A      4    6   11      3    4    5    5    6    7    8    8    8    8    9   10   11   11   12   12   13   13   14   15 
LCS_GDT     D   149_A     D   149_A      4    6   11      3    4    5    5    6    8    9    9    9    9    9   10   11   11   12   12   13   13   14   15 
LCS_GDT     D   150_A     D   150_A      4    8   11      3    4    5    6    7    8    9    9    9    9    9   10   11   11   12   12   13   13   14   15 
LCS_GDT     D   151_A     D   151_A      6    8   11      3    4    6    7    7    8    9    9    9    9    9   10   11   11   12   12   13   13   14   15 
LCS_GDT     V   152_A     V   152_A      6    8   11      4    5    6    7    7    8    9    9    9    9    9   10   10   11   11   12   13   13   14   15 
LCS_GDT     I   153_A     I   153_A      6    8   11      4    5    6    7    7    8    9    9    9    9    9   10   10   10   11   12   13   13   14   15 
LCS_GDT     R   154_A     R   154_A      6    8   11      3    5    6    7    7    8    9    9    9    9    9   10   10   10   10   11   12   12   13   15 
LCS_GDT     C   155_A     C   155_A      6    8   11      4    5    6    7    7    8    9    9    9    9    9   10   10   10   10   11   12   12   13   15 
LCS_GDT     I   156_A     I   156_A      6    8   11      4    5    6    7    7    8    9    9    9    9    9   10   10   10   10   11   12   12   13   13 
LCS_GDT     C   157_A     C   157_A      6    8   11      0    4    5    7    7    8    9    9    9    9    9   10   10   10   10   11   12   12   13   13 
LCS_GDT     G   158_A     G   158_A      5    7   11      0    4    6    6    7    7    7    8    8    8    9   10   10   10   10   11   11   11   11   13 
LCS_GDT     L   159_A     L   159_A      5    7   11      0    4    6    6    7    7    7    8    8    8    8    9    9    9   10   11   11   12   12   13 
LCS_GDT     Y   160_A     Y   160_A      5    7   10      4    5    6    6    7    7    7    8    8    8    8    9    9    9   10   10   10   12   12   13 
LCS_GDT     K   161_A     K   161_A      5    7   11      4    5    6    6    7    7    7    8    8    8    8    9   10   10   11   11   11   12   12   13 
LCS_GDT     D   162_A     D   162_A      5    7   11      4    5    6    6    7    7    7    8    8    8    8    9   10   10   11   11   11   12   12   13 
LCS_GDT     E   163_A     E   163_A      5    9   11      4    5    6    6    7    8    9    9    9    9    9   10   10   10   11   11   11   12   12   13 
LCS_GDT     G   164_A     G   164_A      5    9   11      4    5    7    8    8    8    9    9    9    9    9   10   10   10   11   11   11   12   12   13 
LCS_GDT     L   165_A     L   165_A      7    9   11      3    4    7    8    8    8    9    9    9    9    9   10   10   10   11   11   11   12   12   13 
LCS_GDT     M   166_A     M   166_A      7    9   11      3    6    7    8    8    8    9    9    9    9    9   10   10   10   11   11   11   12   12   13 
LCS_GDT     I   167_A     I   167_A      7    9   11      3    6    7    8    8    8    9    9    9    9    9   10   10   10   11   11   11   12   12   13 
LCS_GDT     Q   168_A     Q   168_A      7    9   11      3    6    7    8    8    8    9    9    9    9    9   10   10   10   11   11   11   12   12   13 
LCS_GDT     C   169_A     C   169_A      7    9   11      3    6    7    8    8    8    9    9    9    9    9   10   10   10   11   11   11   12   12   13 
LCS_GDT     D   170_A     D   170_A      7    9   11      3    6    7    8    8    8    9    9    9    9    9   10   10   10   11   11   11   12   12   13 
LCS_GDT     K   171_A     K   171_A      7    9   11      3    6    7    8    8    8    9    9    9    9    9   10   10   10   11   11   11   11   11   12 
LCS_GDT     C   172_A     C   172_A      4    8   11      3    3    4    6    7    8    8    8    9    9    9   10   10   10   11   11   11   11   11   12 
LCS_GDT     M   173_A     M   173_A      5    8   11      3    4    5    6    7    8    8    8    9    9    9   10   10   10   11   11   11   11   11   12 
LCS_GDT     V   174_A     V   174_A      5    8   11      3    4    5    6    7    8    8    8    9    9    9   10   10   10   11   11   11   11   11   12 
LCS_GDT     W   175_A     W   175_A      5    8   11      3    4    5    6    7    8    8    8    9    9    9   10   10   10   11   11   11   11   11   12 
LCS_GDT     Q   176_A     Q   176_A      5    8   11      3    4    5    6    7    8    8    8    9    9    9   10   10   10   11   11   11   11   11   12 
LCS_GDT     H   177_A     H   177_A      5    8   11      3    4    5    6    7    8    8    8    9    9    9   10   10   10   11   11   11   11   11   12 
LCS_GDT     C   178_A     C   178_A      3    8   11      3    3    4    5    7    8    8    8    9    9    9   10   10   10   11   11   11   11   11   12 
LCS_GDT     D   179_A     D   179_A      3    8   11      3    3    5    6    7    8    8    8    9    9    9   10   10   10   11   11   11   11   11   12 
LCS_GDT     C   180_A     C   180_A      3    5   11      3    3    3    4    4    5    8    8    9    9    9   10   10   10   11   11   11   11   11   12 
LCS_GDT     M   181_A     M   181_A      3    6   11      0    3    3    4    4    6    7    7    7    7    9    9    9   10   10   11   11   11   11   12 
LCS_GDT     G   182_A     G   182_A      4    6   11      3    4    4    5    5    6    7    7    7    8    9    9    9   10   10   11   11   11   11   12 
LCS_GDT     V   183_A     V   183_A      4    6   10      3    4    4    5    5    6    7    7    7    8    9    9    9   10   10   10   10   11   11   13 
LCS_GDT     N   184_A     N   184_A      4    6   12      3    4    4    5    5    6    7    7    7    8    9    9   11   12   12   12   12   12   12   13 
LCS_GDT     T   185_A     T   185_A      5    6   12      3    4    5    5    5    6    7    7    7    8   10   10   11   12   12   12   12   12   14   15 
LCS_GDT     D   186_A     D   186_A      5    6   12      3    4    5    5    5    7    9    9    9    9   10   10   11   12   12   12   14   14   14   15 
LCS_GDT     V   187_A     V   187_A      5    6   12      3    4    5    5    5    7    9    9    9    9   10   10   11   12   12   12   14   14   14   15 
LCS_GDT     E   188_A     E   188_A      5    7   12      3    4    5    6    7    7    9    9    9    9   10   10   11   12   13   16   17   18   18   18 
LCS_GDT     H   189_A     H   189_A      6    7   12      4    4    6    6    7    7    9    9    9    9   10   10   11   12   13   16   17   18   18   18 
LCS_GDT     Y   190_A     Y   190_A      6    7   12      4    4    6    6    7    7    9    9    9    9   10   10   11   12   13   16   17   18   18   18 
LCS_GDT     L   191_A     L   191_A      6    7   13      4    4    6    6    7    7    9    9    9    9   10   10   11   13   14   16   17   18   18   18 
LCS_GDT     C   192_A     C   192_A      6    7   14      4    4    6    6    7    7    9    9    9    9   10   11   12   14   14   16   17   18   18   18 
LCS_GDT     E   193_A     E   193_A      6    7   14      3    4    6    6    7    7    9    9    9    9   12   12   13   14   14   16   17   18   18   18 
LCS_GDT     Q   194_A     Q   194_A      6    7   14      3    4    6    6    7   11   11   11   12   12   12   12   13   14   14   16   17   18   18   18 
LCS_GDT     C   195_A     C   195_A      6    8   14      4    5    6    7    8   11   11   11   12   12   12   12   13   14   14   16   17   18   18   18 
LCS_GDT     D   196_A     D   196_A      6    8   14      4    5    6    7    8   11   11   11   12   12   12   12   13   14   14   16   17   18   18   18 
LCS_GDT     P   197_A     P   197_A      6    8   14      4    5    6    7    8   11   11   11   12   12   12   12   13   14   14   16   17   18   18   18 
LCS_GDT     R   198_A     R   198_A      6    8   14      4    5    6    7    8   11   11   11   12   12   12   12   13   14   14   16   17   18   18   18 
LCS_GDT     P   199_A     P   199_A      6    8   14      4    5    6    7    8    8   10   11   12   12   12   12   13   14   14   16   17   18   18   18 
LCS_GDT     V   200_A     V   200_A      6    8   14      4    4    6    7    8   11   11   11   12   12   12   12   13   14   14   14   17   18   18   18 
LCS_GDT     D   201_A     D   201_A      5    8   14      4    4    5    7    8   11   11   11   12   12   12   12   13   14   14   16   17   18   18   18 
LCS_GDT     R   202_A     R   202_A      5    8   14      3    4    5    6    8   11   11   11   12   12   12   12   13   14   14   16   17   18   18   18 
LCS_GDT     E   203_A     E   203_A      5    8   14      3    4    5    6    7   11   11   11   12   12   12   12   13   14   14   16   17   18   18   18 
LCS_GDT     V   204_A     V   204_A      4    8   14      3    4    4    4    7   11   11   11   12   12   12   12   13   14   14   16   17   18   18   18 
LCS_GDT     P   205_A     P   205_A      4    6   14      3    4    4    4    7   11   11   11   12   12   12   12   13   14   14   14   16   18   18   18 
LCS_AVERAGE  LCS_A:  31.69  (  12.10   39.42   43.56 )

GLOBAL_DISTANCE_TEST (summary information about detected largest sets of residues (represented by selected AToms) that can fit under specified thresholds)
GDT DIST_CUTOFF  0.50   1.00   1.50   2.00   2.50   3.00   3.50   4.00   4.50   5.00   5.50   6.00   6.50   7.00   7.50   8.00   8.50   9.00   9.50  10.00
GDT NUMBER_AT     32     76     99    113    118    119    119    122    123    123    124    124    125    125    126    126    126    126    126    127 
GDT PERCENT_AT  15.61  37.07  48.29  55.12  57.56  58.05  58.05  59.51  60.00  60.00  60.49  60.49  60.98  60.98  61.46  61.46  61.46  61.46  61.46  61.95
GDT RMS_LOCAL    0.36   0.65   0.84   1.02   1.13   1.16   1.16   1.40   1.48   1.48   1.57   1.57   1.89   1.89   1.95   1.95   1.95   1.95   1.95   2.14
GDT RMS_ALL_AT  86.91  86.98  86.96  87.05  87.01  87.07  87.07  87.34  87.34  87.34  87.36  87.36  87.09  87.09  87.11  87.11  87.11  87.11  87.11  87.17

# Checking swapping
#   possible swapping detected:  E     5_A      E     5_A
#   possible swapping detected:  E    18_A      E    18_A
#   possible swapping detected:  D    21_A      D    21_A
#   possible swapping detected:  Y    26_A      Y    26_A
#   possible swapping detected:  Y    51_A      Y    51_A
#   possible swapping detected:  E    52_A      E    52_A
#   possible swapping detected:  D    56_A      D    56_A
#   possible swapping detected:  E    64_A      E    64_A
#   possible swapping detected:  Y    71_A      Y    71_A
#   possible swapping detected:  E    90_A      E    90_A
#   possible swapping detected:  D   102_A      D   102_A
#   possible swapping detected:  E   116_A      E   116_A
#   possible swapping detected:  D   122_A      D   122_A
#   possible swapping detected:  E   123_A      E   123_A
#   possible swapping detected:  E   127_A      E   127_A
#   possible swapping detected:  E   131_A      E   131_A
#   possible swapping detected:  D   133_A      D   133_A
#   possible swapping detected:  E   141_A      E   141_A
#   possible swapping detected:  E   147_A      E   147_A
#   possible swapping detected:  D   151_A      D   151_A
#   possible swapping detected:  D   162_A      D   162_A
#   possible swapping detected:  E   163_A      E   163_A
#   possible swapping detected:  D   186_A      D   186_A
#   possible swapping detected:  Y   190_A      Y   190_A
#   possible swapping detected:  E   193_A      E   193_A
#   possible swapping detected:  D   201_A      D   201_A
#   possible swapping detected:  E   203_A      E   203_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    S     1_A      S     1_A    15.264     0    0.053   0.118    17.094    0.000    0.000
LGA    M     2_A      M     2_A    10.116     0    0.139   0.654    12.208    3.571    3.155
LGA    N     3_A      N     3_A     5.391     0    0.573   1.070     9.334   36.667   20.714
LGA    I     4_A      I     4_A     2.281     0    0.647   1.076     7.572   66.786   41.845
LGA    E     5_A      E     5_A     1.897     0    0.057   0.881     3.957   70.833   66.508
LGA    V     6_A      V     6_A     1.624     0    0.080   0.108     1.841   77.143   75.306
LGA    A     7_A      A     7_A     1.717     0    0.025   0.055     1.985   77.143   76.286
LGA    R     8_A      R     8_A     1.507     0    0.050   0.949     4.488   77.143   69.264
LGA    A     9_A      A     9_A     0.956     0    0.083   0.099     1.184   88.214   88.667
LGA    A    10_A      A    10_A     0.888     0    0.068   0.066     1.172   90.476   88.667
LGA    R    11_A      R    11_A     0.740     0    0.072   1.430     6.029   95.238   70.087
LGA    L    12_A      L    12_A     0.502     0    0.058   0.820     2.418   95.238   87.619
LGA    A    13_A      A    13_A     0.245     0    0.082   0.099     0.532  100.000   98.095
LGA    Q    14_A      Q    14_A     0.893     0    0.116   1.128     5.312   90.476   74.709
LGA    I    15_A      I    15_A     0.940     0    0.042   0.525     1.900   90.476   83.810
LGA    F    16_A      F    16_A     0.561     0    0.027   0.205     0.929   92.857   93.074
LGA    K    17_A      K    17_A     0.683     0    0.030   0.586     1.969   92.857   88.571
LGA    E    18_A      E    18_A     0.848     0    0.068   1.150     4.892   90.476   69.894
LGA    I    19_A      I    19_A     0.673     0    0.036   0.162     1.229   90.476   89.345
LGA    C    20_A      C    20_A     0.596     0    0.048   0.750     3.256   90.476   83.730
LGA    D    21_A      D    21_A     0.733     0    0.038   0.936     3.764   90.476   76.310
LGA    G    22_A      G    22_A     0.540     0    0.065   0.065     0.622   95.238   95.238
LGA    I    23_A      I    23_A     0.469     0    0.032   0.730     3.120   97.619   87.857
LGA    I    24_A      I    24_A     0.660     0    0.038   0.098     1.118   92.857   89.405
LGA    S    25_A      S    25_A     0.746     0    0.276   0.601     4.008   88.214   77.143
LGA    Y    26_A      Y    26_A     0.578     0    0.027   0.102     0.584   92.857   91.270
LGA    R    27_A      R    27_A     0.974     0    0.046   1.271     8.374   85.952   55.714
LGA    D    28_A      D    28_A     1.316     0    0.032   0.871     3.886   77.143   69.405
LGA    S    29_A      S    29_A     1.980     0    0.046   0.642     3.856   68.810   63.889
LGA    S    30_A      S    30_A     2.349     0    0.124   0.112     3.047   68.810   65.000
LGA    Q    31_A      Q    31_A     1.646     0    0.134   0.926     4.827   77.143   63.280
LGA    Q    32_A      Q    32_A     1.101     0    0.104   0.948     5.758   81.429   61.587
LGA    T    33_A      T    33_A     1.009     0    0.047   0.838     1.830   85.952   82.857
LGA    L    34_A      L    34_A     0.367     0    0.031   0.136     0.639   97.619   95.238
LGA    A    35_A      A    35_A     0.739     0    0.127   0.119     1.225   90.476   88.667
LGA    A    36_A      A    36_A     0.721     0    0.029   0.046     0.831   90.476   90.476
LGA    P    37_A      P    37_A     0.783     0    0.055   0.183     1.181   88.214   87.891
LGA    L    38_A      L    38_A     0.849     0    0.030   1.065     3.323   90.476   81.071
LGA    L    39_A      L    39_A     0.988     0    0.168   1.256     2.589   90.476   80.893
LGA    N    40_A      N    40_A     1.105     0    0.092   1.356     6.095   88.214   63.929
LGA    L    41_A      L    41_A     1.095     0    0.029   0.277     2.274   79.286   75.060
LGA    P    42_A      P    42_A     1.136     0    0.087   0.283     1.747   81.548   82.789
LGA    P    43_A      P    43_A     2.124     0    0.153   0.312     3.330   72.976   66.259
LGA    K    44_A      K    44_A     1.493     0    0.055   0.820     2.241   83.810   76.878
LGA    K    45_A      K    45_A     0.607     0    0.056   0.915     2.734   90.595   81.905
LGA    K    46_A      K    46_A     1.682     0    0.327   1.196     3.454   79.286   73.545
LGA    N    47_A      N    47_A     1.386     0    0.017   0.136     1.842   81.429   80.357
LGA    A    48_A      A    48_A     1.429     0    0.049   0.069     1.577   79.286   79.714
LGA    D    49_A      D    49_A     1.893     0    0.101   0.766     5.253   72.857   57.857
LGA    Y    50_A      Y    50_A     1.244     0    0.032   0.464     4.542   85.952   64.841
LGA    Y    51_A      Y    51_A     0.216     0    0.129   0.503     3.063   92.976   77.817
LGA    E    52_A      E    52_A     1.610     0    0.091   0.969     5.382   69.048   57.831
LGA    K    53_A      K    53_A     2.729     0    0.058   1.097     5.081   60.952   53.492
LGA    I    54_A      I    54_A     0.806     0    0.214   0.197     1.679   81.548   81.548
LGA    S    55_A      S    55_A     3.056     0    0.255   0.621     4.160   57.262   51.587
LGA    D    56_A      D    56_A     1.955     0    0.124   0.729     2.450   75.119   74.048
LGA    P    57_A      P    57_A     2.031     0    0.636   0.542     4.521   58.452   61.156
LGA    L    58_A      L    58_A     0.796     0    0.090   1.230     2.994   86.071   78.631
LGA    D    59_A      D    59_A     0.766     0    0.200   0.763     2.545   92.857   84.107
LGA    L    60_A      L    60_A     0.141     0    0.038   0.148     1.499   95.238   90.595
LGA    S    61_A      S    61_A     1.362     0    0.075   0.593     2.145   83.690   77.381
LGA    T    62_A      T    62_A     1.527     0    0.024   0.958     3.837   79.286   72.313
LGA    I    63_A      I    63_A     0.592     0    0.031   0.088     1.336   95.238   89.464
LGA    E    64_A      E    64_A     0.546     0    0.085   0.559     1.717   92.857   88.571
LGA    K    65_A      K    65_A     1.080     0    0.074   1.245     3.044   88.214   78.201
LGA    Q    66_A      Q    66_A     0.647     0    0.091   0.313     1.782   92.857   85.608
LGA    I    67_A      I    67_A     0.522     0    0.053   1.210     2.543   92.857   81.071
LGA    L    68_A      L    68_A     0.927     0    0.034   0.218     2.360   90.476   81.726
LGA    I    69_A      I    69_A     0.795     0    0.137   1.203     3.901   90.476   74.226
LGA    G    70_A      G    70_A     0.566     0    0.096   0.096     0.823   90.476   90.476
LGA    Y    71_A      Y    71_A     0.609     0    0.030   0.181     1.377   92.857   85.238
LGA    Y    72_A      Y    72_A     1.128     0    0.605   0.465     3.082   75.833   78.175
LGA    K    73_A      K    73_A     1.777     0    0.141   0.764     4.014   70.833   65.291
LGA    T    74_A      T    74_A     1.270     0    0.052   0.142     2.003   85.952   81.633
LGA    V    75_A      V    75_A     0.674     0    0.044   1.116     2.567   90.476   82.041
LGA    E    76_A      E    76_A     1.270     0    0.121   1.118     3.694   88.214   78.413
LGA    A    77_A      A    77_A     0.944     0    0.039   0.042     1.230   90.476   88.667
LGA    F    78_A      F    78_A     0.355     0    0.039   0.318     1.456   97.619   91.515
LGA    D    79_A      D    79_A     0.318     0    0.061   0.518     1.429  100.000   95.357
LGA    A    80_A      A    80_A     0.585     0    0.054   0.072     0.774   92.857   92.381
LGA    D    81_A      D    81_A     0.834     0    0.027   0.678     2.240   90.476   83.929
LGA    M    82_A      M    82_A     0.741     0    0.047   0.597     2.270   90.476   85.000
LGA    L    83_A      L    83_A     0.450     0    0.074   0.943     2.532   95.238   87.857
LGA    K    84_A      K    84_A     0.492     0    0.065   1.207     2.415   92.857   83.862
LGA    V    85_A      V    85_A     0.918     0    0.032   1.045     2.616   90.476   83.129
LGA    F    86_A      F    86_A     0.748     0    0.026   0.332     1.024   90.476   91.385
LGA    R    87_A      R    87_A     0.748     0    0.068   1.359     7.341   90.476   66.017
LGA    N    88_A      N    88_A     1.069     0    0.070   1.198     3.948   88.214   78.988
LGA    A    89_A      A    89_A     0.759     0    0.069   0.090     0.791   90.476   90.476
LGA    E    90_A      E    90_A     0.846     0    0.052   0.395     1.438   88.214   88.519
LGA    K    91_A      K    91_A     0.902     0    0.094   0.903     3.110   85.952   78.307
LGA    Y    92_A      Y    92_A     1.518     0    0.194   0.263     5.787   83.810   54.365
LGA    Y    93_A      Y    93_A     0.964     0    0.023   0.205     2.290   79.643   82.540
LGA    G    94_A      G    94_A     3.041     0    0.290   0.290     5.444   44.524   44.524
LGA    R    95_A      R    95_A     6.206     0    0.215   1.138    11.382   19.286    9.697
LGA    K    96_A      K    96_A     5.251     0    0.026   0.682     7.055   26.429   22.751
LGA    S    97_A      S    97_A     4.906     0    0.281   0.353     6.841   40.476   32.063
LGA    P    98_A      P    98_A     4.703     0    0.205   0.323     7.265   39.048   28.095
LGA    I    99_A      I    99_A     1.703     0    0.155   1.380     2.628   70.833   69.940
LGA    G   100_A      G   100_A     1.780     0    0.112   0.112     1.780   75.000   75.000
LGA    R   101_A      R   101_A     1.742     0    0.083   1.372     6.902   77.143   52.900
LGA    D   102_A      D   102_A     0.761     0    0.026   1.056     2.626   85.952   78.571
LGA    V   103_A      V   103_A     1.187     0    0.104   1.240     3.660   83.690   76.054
LGA    C   104_A      C   104_A     1.347     0    0.075   0.805     3.161   81.429   76.190
LGA    R   105_A      R   105_A     1.022     0    0.033   1.248     5.027   81.429   65.195
LGA    L   106_A      L   106_A     1.035     0    0.066   0.210     1.104   85.952   89.405
LGA    R   107_A      R   107_A     0.826     0    0.052   1.352     5.219   90.595   71.861
LGA    K   108_A      K   108_A     0.407     0    0.038   0.935     5.129   97.619   75.714
LGA    A   109_A      A   109_A     0.703     0    0.110   0.107     1.118   90.476   88.667
LGA    Y   110_A      Y   110_A     0.522     0    0.042   0.331     1.381   92.857   91.349
LGA    Y   111_A      Y   111_A     0.487     0    0.045   0.195     1.909  100.000   87.698
LGA    S   112_A      S   112_A     0.096     0    0.028   0.685     2.342  100.000   94.127
LGA    A   113_A      A   113_A     0.280     0    0.045   0.048     0.456  100.000  100.000
LGA    R   114_A      R   114_A     0.109     0    0.058   0.995     2.389  100.000   90.087
LGA    H   115_A      H   115_A     0.281     0    0.032   1.140     2.248  100.000   89.238
LGA    E   116_A      E   116_A     0.592     0    0.071   1.001     3.130   92.857   76.878
LGA    A   117_A      A   117_A     0.523     0    0.090   0.088     0.717   90.476   90.476
LGA    S   118_A      S   118_A     0.362     0    0.076   0.074     0.615   95.238   96.825
LGA    A   119_A      A   119_A     1.328     0    0.082   0.097     1.963   88.214   85.143
LGA    Q   120_A      Q   120_A     0.621     0    0.032   1.136     5.900   95.238   69.365
LGA    I   121_A      I   121_A     0.531     0    0.024   0.129     1.048   90.595   90.536
LGA    D   122_A      D   122_A     1.300     0    0.030   0.928     3.860   83.690   68.929
LGA    E   123_A      E   123_A     0.813     0    0.078   0.700     2.612   90.476   77.354
LGA    I   124_A      I   124_A     0.504     0    0.065   0.197     1.308   92.857   91.726
LGA    V   125_A      V   125_A     0.695     0    0.079   0.133     1.477   88.333   86.667
LGA    G   126_A      G   126_A     2.651     0    0.470   0.470     7.211   40.357   40.357
LGA    E   127_A      E   127_A     9.720     0    0.207   0.969    16.239    3.452    1.534
LGA    T   128_A      T   128_A     9.214     0    0.596   0.670    10.266    1.071    7.551
LGA    A   129_A      A   129_A    13.756     0    0.681   0.625    17.832    0.000    0.000
LGA    S   130_A      S   130_A    18.777     0    0.266   0.600    20.497    0.000    0.000
LGA    E   131_A      E   131_A    24.427     0    0.640   1.205    27.384    0.000    0.000
LGA    A   132_A      A   132_A    30.151     0    0.361   0.359    33.511    0.000    0.000
LGA    D   133_A      D   133_A    36.099     0    0.535   0.899    39.462    0.000    0.000
LGA    S   134_A      S   134_A    41.134     0    0.584   0.523    44.755    0.000    0.000
LGA    S   135_A      S   135_A    47.819     0    0.230   0.344    49.351    0.000    0.000
LGA    E   136_A      E   136_A    52.767     0    0.220   0.939    56.725    0.000    0.000
LGA    T   137_A      T   137_A    54.621     0    0.676   1.012    56.430    0.000    0.000
LGA    S   138_A      S   138_A    57.651     0    0.512   1.047    60.450    0.000    0.000
LGA    V   139_A      V   139_A    56.448     0    0.141   0.372    58.598    0.000    0.000
LGA    S   140_A      S   140_A    56.347     0    0.582   0.537    58.263    0.000    0.000
LGA    E   141_A      E   141_A    58.506     0    0.637   1.182    61.105    0.000    0.000
LGA    K   142_A      K   142_A    64.688     0    0.499   1.283    67.399    0.000    0.000
LGA    E   143_A      E   143_A    67.876     0    0.559   1.259    74.158    0.000    0.000
LGA    S   144_A      S   144_A    64.448     0    0.503   0.526    65.629    0.000    0.000
LGA    G   145_A      G   145_A    67.068     0    0.193   0.193    68.354    0.000    0.000
LGA    H   146_A      H   146_A    71.038     0    0.589   1.170    75.495    0.000    0.000
LGA    E   147_A      E   147_A    77.305     0    0.121   1.030    81.006    0.000    0.000
LGA    K   148_A      K   148_A    80.519     0    0.259   1.106    84.275    0.000    0.000
LGA    D   149_A      D   149_A    87.911     0    0.387   0.915    93.464    0.000    0.000
LGA    D   150_A      D   150_A    91.094     0    0.465   0.705    93.822    0.000    0.000
LGA    D   151_A      D   151_A    95.085     0    0.672   1.031    98.344    0.000    0.000
LGA    V   152_A      V   152_A    93.374     0    0.059   1.051    94.594    0.000    0.000
LGA    I   153_A      I   153_A    95.434     0    0.036   1.418    99.648    0.000    0.000
LGA    R   154_A      R   154_A    94.063     0    0.334   0.698    94.986    0.000    0.000
LGA    C   155_A      C   155_A    96.575     0    0.053   0.048    99.546    0.000    0.000
LGA    I   156_A      I   156_A    95.859     0    0.622   1.050    97.241    0.000    0.000
LGA    C   157_A      C   157_A   100.404     0    0.605   0.797   104.059    0.000    0.000
LGA    G   158_A      G   158_A   103.112     0    0.683   0.683   103.864    0.000    0.000
LGA    L   159_A      L   159_A   106.873     0    0.643   1.005   109.739    0.000    0.000
LGA    Y   160_A      Y   160_A   109.657     0    0.426   1.369   111.645    0.000    0.000
LGA    K   161_A      K   161_A   115.336     0    0.064   0.818   118.199    0.000    0.000
LGA    D   162_A      D   162_A   120.304     0    0.179   0.798   123.606    0.000    0.000
LGA    E   163_A      E   163_A   123.695     0    0.062   0.610   126.196    0.000    0.000
LGA    G   164_A      G   164_A   127.669     0    0.180   0.180   130.370    0.000    0.000
LGA    L   165_A      L   165_A   132.090     0    0.057   1.068   134.852    0.000    0.000
LGA    M   166_A      M   166_A   132.053     0    0.057   1.037   136.102    0.000    0.000
LGA    I   167_A      I   167_A   135.912     0    0.157   1.353   136.362    0.000    0.000
LGA    Q   168_A      Q   168_A   138.881     0    0.123   1.091   144.690    0.000    0.000
LGA    C   169_A      C   169_A   138.672     0    0.068   0.812   141.696    0.000    0.000
LGA    D   170_A      D   170_A   144.542     0    0.654   0.665   149.107    0.000    0.000
LGA    K   171_A      K   171_A   144.931     0    0.634   1.098   146.415    0.000    0.000
LGA    C   172_A      C   172_A   146.359     0    0.607   0.823   149.100    0.000    0.000
LGA    M   173_A      M   173_A   152.779     0    0.418   1.014   154.028    0.000    0.000
LGA    V   174_A      V   174_A   153.271     0    0.113   1.096   155.178    0.000    0.000
LGA    W   175_A      W   175_A   157.050     0    0.059   1.191   168.572    0.000    0.000
LGA    Q   176_A      Q   176_A   157.248     0    0.033   1.101   159.012    0.000    0.000
LGA    H   177_A      H   177_A   160.714     0    0.047   1.417   163.504    0.000    0.000
LGA    C   178_A      C   178_A   164.698     0    0.631   0.598   167.828    0.000    0.000
LGA    D   179_A      D   179_A   165.066     0    0.622   0.926   168.659    0.000    0.000
LGA    C   180_A      C   180_A   164.766     0    0.604   0.549   165.131    0.000    0.000
LGA    M   181_A      M   181_A   167.977     0    0.704   1.241   170.001    0.000    0.000
LGA    G   182_A      G   182_A   172.640     0    0.571   0.571   174.901    0.000    0.000
LGA    V   183_A      V   183_A   179.509     0    0.124   1.246   182.772    0.000    0.000
LGA    N   184_A      N   184_A   184.739     0    0.651   0.611   188.895    0.000    0.000
LGA    T   185_A      T   185_A   190.736     0    0.575   0.581   193.499    0.000    0.000
LGA    D   186_A      D   186_A   194.954     0    0.568   0.918   198.289    0.000    0.000
LGA    V   187_A      V   187_A   195.985     0    0.098   1.004   197.695    0.000    0.000
LGA    E   188_A      E   188_A   201.125     0    0.662   0.863   203.038    0.000    0.000
LGA    H   189_A      H   189_A   201.582     0    0.418   1.081   202.906    0.000    0.000
LGA    Y   190_A      Y   190_A   201.926     0    0.054   1.347   203.032    0.000    0.000
LGA    L   191_A      L   191_A   201.161     0    0.044   0.202   201.192    0.000    0.000
LGA    C   192_A      C   192_A   202.153     0    0.130   0.774   203.562    0.000    0.000
LGA    E   193_A      E   193_A   198.568     0    0.569   1.169   200.046    0.000    0.000
LGA    Q   194_A      Q   194_A   200.472     0    0.559   1.501   203.310    0.000    0.000
LGA    C   195_A      C   195_A   206.170     0    0.576   0.868   210.633    0.000    0.000
LGA    D   196_A      D   196_A   206.525     0    0.068   0.562   208.743    0.000    0.000
LGA    P   197_A      P   197_A   206.896     0    0.158   0.174   206.998    0.000    0.000
LGA    R   198_A      R   198_A   207.968     0    0.176   1.543   208.765    0.000    0.000
LGA    P   199_A      P   199_A   207.060     0    0.169   0.440   208.034    0.000    0.000
LGA    V   200_A      V   200_A   206.109     0    0.147   0.223   206.711    0.000    0.000
LGA    D   201_A      D   201_A   203.995     0    0.196   0.274   205.043    0.000    0.000
LGA    R   202_A      R   202_A   200.652     0    0.254   1.567   202.080    0.000    0.000
LGA    E   203_A      E   203_A   197.453     0    0.432   1.065   200.546    0.000    0.000
LGA    V   204_A      V   204_A   191.500     0    0.141   0.150   194.032    0.000    0.000
LGA    P   205_A      P   205_A   187.142     0    0.532   0.547   188.346    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      205     820    820  100.00    1624   1624  100.00               205
SUMMARY(RMSD_GDC):    65.289         65.362                 66.106           50.758   46.298

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  205  205    4.0    122    1.40    53.293    51.600     8.118

LGA_LOCAL      RMSD:   1.403  Number of atoms:  122  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  87.336  Number of assigned atoms:  205 
Std_ASGN_ATOMS RMSD:  65.289  Standard rmsd on all 205 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.038287 * X  +   0.926376 * Y  +  -0.374649 * Z  +   1.141446
  Y_new =  -0.769589 * X  +   0.266485 * Y  +   0.580274 * Z  + -43.604069
  Z_new =   0.637390 * X  +   0.266109 * Y  +   0.723132 * Z  +  21.932865 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -1.521087 -0.691107  0.352616   [DEG:  -87.1519  -39.5975   20.2034 ]
ZXZ: -2.568287  0.762471  1.175297   [DEG: -147.1520   43.6863   67.3396 ]
 
# END of job
