
#######################################################
#                                                     #
#                        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  262 ( 1975),  selected  240 , name one
# Molecule2: number of CA atoms  240 ( 1805),  selected  240 , 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:   130       4_A - 133_A       4.51    29.24
  LCS_AVERAGE:     52.64

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   126       4_A - 129_A       1.93    30.42
  LCS_AVERAGE:     50.32

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   112     132_A - 243_A       0.99    32.88
  LCS_AVERAGE:     31.53

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  240
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     E     4_A     E     4_A      7  126  130     31   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     V     5_A     V     5_A      7  126  130     31   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     Q     6_A     Q     6_A      7  126  130     31   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     L     7_A     L     7_A      7  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     V     8_A     V     8_A      7  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     Q     9_A     Q     9_A      7  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     S    10_A     S    10_A      7  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     G    11_A     G    11_A      7  126  130      3    8   20   39  103  116  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     A    12_A     A    12_A     14  126  130      4   18   69   99  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     E    13_A     E    13_A     16  126  130     13   75   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     V    14_A     V    14_A     16  126  130     10   56   94  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     K    15_A     K    15_A     16  126  130     13   49   93  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     K    16_A     K    16_A     16  126  130     13   41   79  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     P    17_A     P    17_A     16  126  130     13   56   94  105  115  118  122  122  123  124  125  125  126  126  126  126  127  129  131  132 
LCS_GDT     G    18_A     G    18_A     16  126  130     24   75   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  128  131  132 
LCS_GDT     S    19_A     S    19_A     16  126  130     13   66   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     S    20_A     S    20_A     16  126  130     33   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     V    21_A     V    21_A     16  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     K    22_A     K    22_A     16  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     V    23_A     V    23_A     16  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     S    24_A     S    24_A     16  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     C    25_A     C    25_A     16  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     K    26_A     K    26_A     16  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     A    27_A     A    27_A     16  126  130     40   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     S    28_A     S    28_A     16  126  130     24   74   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     G    29_A     G    29_A     11  126  130      5   34   83  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     G    30_A     G    30_A     11  126  130     10   68   94  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     T    31_A     T    31_A      4  126  130      3    4   15   45  102  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     F    32_A     F    32_A      3  126  130      3    3    5    7    9   10   31   48   83  115  124  125  126  126  126  126  127  127  128  128 
LCS_GDT     N    33_A     N    33_A      3  126  130      3   18   52   97  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     R    34_A     R    34_A     11  126  130      3    7   10   27   49  109  118  121  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     Y    35_A     Y    35_A     70  126  130      9   20   81  103  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     T    36_A     T    36_A     70  126  130     42   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     V    37_A     V    37_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     N    38_A     N    38_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     W    39_A     W    39_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     V    40_A     V    40_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     R    41_A     R    41_A     70  126  130     33   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     Q    42_A     Q    42_A     70  126  130     49   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     A    43_A     A    43_A     70  126  130     52   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  128  131  132 
LCS_GDT     P    44_A     P    44_A     70  126  130     34   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  131  132 
LCS_GDT     G    45_A     G    45_A     70  126  130      3   33   89  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     Q    46_A     Q    46_A     70  126  130     24   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     G    47_A     G    47_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     L    48_A     L    48_A     70  126  130     49   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     E    49_A     E    49_A     70  126  130     50   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     W    50_A     W    50_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     M    51_A     M    51_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     G    52_A     G    52_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     G    53_A     G    53_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     I    54_A     I    54_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     I    55_A     I    55_A     70  126  130     52   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     P    56_A     P    56_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     I    57_A     I    57_A     70  126  130     47   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     F    58_A     F    58_A     70  126  130     26   77   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     G    59_A     G    59_A     70  126  130     25   74   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     T    60_A     T    60_A     70  126  130     23   59   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     A    61_A     A    61_A     70  126  130     25   79   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     N    62_A     N    62_A     70  126  130     49   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     Y    63_A     Y    63_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     A    64_A     A    64_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     Q    65_A     Q    65_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     R    66_A     R    66_A     70  126  130      6   80   97  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     F    67_A     F    67_A     70  126  130      8   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     Q    68_A     Q    68_A     70  126  130     30   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     G    69_A     G    69_A     70  126  130     19   77   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     R    70_A     R    70_A     70  126  130     31   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     L    71_A     L    71_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     T    72_A     T    72_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     I    73_A     I    73_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     T    74_A     T    74_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     A    75_A     A    75_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     D    76_A     D    76_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     E    77_A     E    77_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     S    78_A     S    78_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     T    79_A     T    79_A     70  126  130     43   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     S    80_A     S    80_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     T    81_A     T    81_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     A    82_A     A    82_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     Y    83_A     Y    83_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     M    84_A     M    84_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     E    85_A     E    85_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     L    86_A     L    86_A     70  126  130     27   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     S    87_A     S    87_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     S    88_A     S    88_A     70  126  130     47   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  129  131  132 
LCS_GDT     L    89_A     L    89_A     70  126  130     29   79   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  129  131  132 
LCS_GDT     R    90_A     R    90_A     70  126  130     13   55   93  105  115  118  122  122  123  124  125  125  126  126  126  126  127  129  131  132 
LCS_GDT     S    91_A     S    91_A     70  126  130     13   29   72  105  115  118  122  122  123  124  125  125  126  126  126  126  127  129  131  132 
LCS_GDT     D    92_A     D    92_A     70  126  130     10   28   68  105  115  118  122  122  123  124  125  125  126  126  126  126  127  129  131  132 
LCS_GDT     D    93_A     D    93_A     70  126  130      8   60   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  129  131  132 
LCS_GDT     T    94_A     T    94_A     70  126  130      8   75   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  129  131  132 
LCS_GDT     A    95_A     A    95_A     70  126  130     42   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  129  131  132 
LCS_GDT     V    96_A     V    96_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  129  131  132 
LCS_GDT     Y    97_A     Y    97_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     F    98_A     F    98_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     C    99_A     C    99_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     A   100_A     A   100_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     R   101_A     R   101_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     E   102_A     E   102_A     70  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     N   103_A     N   103_A     70  126  130     11   77   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     L   104_A     L   104_A     70  126  130     26   64   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     D   105_A     D   105_A     11  126  130      4   24   78  103  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     N   106_A     N   106_A      8  126  130      5   14   62   91  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     S   107_A     S   107_A      8  126  130      5    7   17   27   78  116  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     G   108_A     G   108_A      8  126  130      3   14   37   80  103  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     T   109_A     T   109_A      8  126  130      3    7   15   27   37   70   84  105  123  123  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     Y   110_A     Y   110_A     13  126  130      5   11   28   64   95  116  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     Y   111_A     Y   111_A     14  126  130      6   25   69  103  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     Y   112_A     Y   112_A     14  126  130      5   20   62  102  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     F   113_A     F   113_A     16  126  130      4   56   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     S   114_A     S   114_A     16  126  130     41   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     G   115_A     G   115_A     16  126  130     30   78   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     W   116_A     W   116_A     16  126  130     30   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     F   117_A     F   117_A     16  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     D   118_A     D   118_A     16  126  130      4   67   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     P   119_A     P   119_A     16  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     W   120_A     W   120_A     16  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     G   121_A     G   121_A     16  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     Q   122_A     Q   122_A     16  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     G   123_A     G   123_A     16  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     T   124_A     T   124_A     16  126  130     53   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  127  128  128 
LCS_GDT     L   125_A     L   125_A     16  126  130     50   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  129  130  132 
LCS_GDT     V   126_A     V   126_A     16  126  130     44   80   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  129  131  132 
LCS_GDT     T   127_A     T   127_A     16  126  130     21   72   98  105  115  118  122  122  123  124  125  125  126  126  126  126  127  129  131  132 
LCS_GDT     V   128_A     V   128_A     16  126  130     13   41   88  105  115  118  122  122  123  124  125  125  126  126  126  126  127  129  131  132 
LCS_GDT     S   129_A     S   129_A      3  126  130      3    3    8   17   30   53   92  116  122  124  125  125  126  126  126  126  127  129  131  132 
LCS_GDT     S   130_A     S   130_A      4  115  130      1    3    4    9   22   47   83  105  112  114  117  119  121  122  123  125  127  129  131  132 
LCS_GDT     Q   131_A     Q   131_A      4  115  130      3    5    9   17   25   33   81  103  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     S   132_A     S   132_A    112  115  130      3    3    9   63  103  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     A   133_A     A   133_A    112  115  130      3    3   92  106  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     L   134_A     L   134_A    112  115  122     80  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     T   135_A     T   135_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     Q   136_A     Q   136_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     P   137_A     P   137_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     R   138_A     R   138_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     S   139_A     S   139_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     V   140_A     V   140_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     S   141_A     S   141_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     G   142_A     G   142_A    112  115  122     61  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     S   143_A     S   143_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     P   144_A     P   144_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     G   145_A     G   145_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     Q   146_A     Q   146_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     S   147_A     S   147_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     V   148_A     V   148_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     T   149_A     T   149_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     I   150_A     I   150_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     S   151_A     S   151_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     C   152_A     C   152_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     T   153_A     T   153_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     G   154_A     G   154_A    112  115  122     80  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     T   155_A     T   155_A    112  115  122     82  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     S   156_A     S   156_A    112  115  122     80  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     S   157_A     S   157_A    112  115  122     23  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     D   158_A     D   158_A    112  115  122     23  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     I   159_A     I   159_A    112  115  122     50  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     G   160_A     G   160_A    112  115  122      7  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     G   161_A     G   161_A    112  115  122     23  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     Y   162_A     Y   162_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     N   163_A     N   163_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     F   164_A     F   164_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     V   165_A     V   165_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     S   166_A     S   166_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     W   167_A     W   167_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     Y   168_A     Y   168_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     Q   169_A     Q   169_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     Q   170_A     Q   170_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     H   171_A     H   171_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     P   172_A     P   172_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     G   173_A     G   173_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  126  129  131  132 
LCS_GDT     K   174_A     K   174_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     A   175_A     A   175_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     P   176_A     P   176_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     K   177_A     K   177_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     L   178_A     L   178_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     M   179_A     M   179_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     I   180_A     I   180_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     Y   181_A     Y   181_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     D   182_A     D   182_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     A   183_A     A   183_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     T   184_A     T   184_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     K   185_A     K   185_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     R   186_A     R   186_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     P   187_A     P   187_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     S   188_A     S   188_A    112  115  122     67  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     G   189_A     G   189_A    112  115  122     61  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     V   190_A     V   190_A    112  115  122     75  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     P   191_A     P   191_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     D   192_A     D   192_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     R   193_A     R   193_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     F   194_A     F   194_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     S   195_A     S   195_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     G   196_A     G   196_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     S   197_A     S   197_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     K   198_A     K   198_A    112  115  122     67  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     S   199_A     S   199_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     G   200_A     G   200_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     N   201_A     N   201_A    112  115  122     84  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     T   202_A     T   202_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     A   203_A     A   203_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     S   204_A     S   204_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     L   205_A     L   205_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     T   206_A     T   206_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     I   207_A     I   207_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     S   208_A     S   208_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     G   209_A     G   209_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     L   210_A     L   210_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     Q   211_A     Q   211_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     A   212_A     A   212_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     E   213_A     E   213_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     D   214_A     D   214_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     E   215_A     E   215_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     A   216_A     A   216_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     D   217_A     D   217_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     Y   218_A     Y   218_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     Y   219_A     Y   219_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     C   220_A     C   220_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     C   221_A     C   221_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     S   222_A     S   222_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     Y   223_A     Y   223_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     A   224_A     A   224_A    112  115  122     23   94  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     G   225_A     G   225_A    112  115  122      3   46   94  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     D   226_A     D   226_A    112  115  122      3    3    7   16   22   85  100  108  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     Y   227_A     Y   227_A    112  115  122      3    3    4    4   13   30  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     T   228_A     T   228_A    112  115  122     23   94  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     P   229_A     P   229_A    112  115  122      3   94  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     G   230_A     G   230_A    112  115  122      4   87  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     V   231_A     V   231_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     V   232_A     V   232_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     F   233_A     F   233_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     G   234_A     G   234_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     G   235_A     G   235_A    112  115  122     61  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     G   236_A     G   236_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     T   237_A     T   237_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     K   238_A     K   238_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     L   239_A     L   239_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     T   240_A     T   240_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     V   241_A     V   241_A    112  115  122     85  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     L   242_A     L   242_A    112  115  122     61  102  104  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_GDT     G   243_A     G   243_A    112  115  122      4   62  101  107  109  110  110  111  112  114  117  119  121  122  123  123  127  129  131  132 
LCS_AVERAGE  LCS_A:  44.83  (  31.53   50.32   52.64 )

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     85    102    104    107    115    118    122    122    123    124    125    125    126    126    126    126    127    129    131    132 
GDT PERCENT_AT  35.42  42.50  43.33  44.58  47.92  49.17  50.83  50.83  51.25  51.67  52.08  52.08  52.50  52.50  52.50  52.50  52.92  53.75  54.58  55.00
GDT RMS_LOCAL    0.29   0.41   0.48   0.58   1.20   1.32   1.56   1.56   1.61   1.74   1.84   1.84   1.93   1.93   1.93   1.93   2.30   4.32   4.39   4.53
GDT RMS_ALL_AT  33.10  33.14  33.06  33.02  30.51  30.49  30.50  30.50  30.48  30.38  30.42  30.42  30.42  30.42  30.42  30.42  30.23  28.90  29.02  28.79

# Checking swapping
#   possible swapping detected:  E    13_A      E    13_A
#   possible swapping detected:  E    77_A      E    77_A
#   possible swapping detected:  Y    83_A      Y    83_A
#   possible swapping detected:  E    85_A      E    85_A
#   possible swapping detected:  E   102_A      E   102_A
#   possible swapping detected:  Y   110_A      Y   110_A
#   possible swapping detected:  Y   111_A      Y   111_A
#   possible swapping detected:  F   113_A      F   113_A
#   possible swapping detected:  D   158_A      D   158_A
#   possible swapping detected:  Y   162_A      Y   162_A
#   possible swapping detected:  Y   168_A      Y   168_A
#   possible swapping detected:  D   182_A      D   182_A
#   possible swapping detected:  D   192_A      D   192_A
#   possible swapping detected:  E   213_A      E   213_A
#   possible swapping detected:  D   214_A      D   214_A
#   possible swapping detected:  D   217_A      D   217_A
#   possible swapping detected:  Y   223_A      Y   223_A
#   possible swapping detected:  F   233_A      F   233_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    E     4_A      E     4_A     2.052     0    0.249   0.745     3.145   63.095   73.439
LGA    V     5_A      V     5_A     1.793     0    0.103   0.919     3.207   77.143   69.796
LGA    Q     6_A      Q     6_A     1.499     0    0.094   0.972     3.832   77.143   63.862
LGA    L     7_A      L     7_A     0.792     0    0.054   0.860     2.511   90.476   84.107
LGA    V     8_A      V     8_A     0.680     0    0.015   0.082     0.766   92.857   91.837
LGA    Q     9_A      Q     9_A     0.431     0    0.017   0.146     0.485  100.000  100.000
LGA    S    10_A      S    10_A     0.389     0    0.035   0.169     3.392   78.690   72.937
LGA    G    11_A      G    11_A     3.809     0    0.177   0.177     3.809   65.833   65.833
LGA    A    12_A      A    12_A     2.509     0    0.089   0.126     3.660   63.690   62.381
LGA    E    13_A      E    13_A     0.751     0    0.082   1.048     2.446   90.476   80.794
LGA    V    14_A      V    14_A     1.565     0    0.027   0.184     2.626   72.976   71.905
LGA    K    15_A      K    15_A     1.750     0    0.011   0.412     2.614   72.857   73.016
LGA    K    16_A      K    16_A     2.483     0    0.093   1.096     7.148   66.786   44.127
LGA    P    17_A      P    17_A     1.544     0    0.070   0.164     2.606   75.000   70.680
LGA    G    18_A      G    18_A     0.942     0    0.057   0.057     1.270   83.690   83.690
LGA    S    19_A      S    19_A     1.768     0    0.026   0.630     2.254   81.548   78.730
LGA    S    20_A      S    20_A     1.256     0    0.039   0.684     1.647   79.286   78.571
LGA    V    21_A      V    21_A     0.865     0    0.058   1.105     3.169   90.476   82.177
LGA    K    22_A      K    22_A     0.649     0    0.044   0.696     1.637   92.857   86.561
LGA    V    23_A      V    23_A     0.559     0    0.038   0.110     0.730   90.476   90.476
LGA    S    24_A      S    24_A     0.312     0    0.030   0.661     2.368  100.000   94.127
LGA    C    25_A      C    25_A     0.328     0    0.034   0.051     0.468  100.000  100.000
LGA    K    26_A      K    26_A     0.750     0    0.021   1.187     3.684   90.476   79.418
LGA    A    27_A      A    27_A     1.203     0    0.055   0.063     1.578   77.143   78.000
LGA    S    28_A      S    28_A     2.250     0    0.623   0.581     4.520   58.452   61.905
LGA    G    29_A      G    29_A     2.161     0    0.627   0.627     4.599   58.690   58.690
LGA    G    30_A      G    30_A     1.311     0    0.085   0.085     2.829   71.190   71.190
LGA    T    31_A      T    31_A     3.670     0    0.621   1.293     6.247   42.857   33.878
LGA    F    32_A      F    32_A     6.862     0    0.176   0.301    15.169   16.548    6.277
LGA    N    33_A      N    33_A     2.860     0    0.668   1.229     6.064   45.952   45.774
LGA    R    34_A      R    34_A     4.812     0    0.664   1.154    13.843   42.262   17.013
LGA    Y    35_A      Y    35_A     2.311     0    0.032   0.125     3.293   61.190   64.921
LGA    T    36_A      T    36_A     0.676     0    0.079   1.115     2.880   88.214   82.109
LGA    V    37_A      V    37_A     0.599     0    0.102   0.948     2.821   90.476   83.197
LGA    N    38_A      N    38_A     0.764     0    0.045   1.054     3.985   92.857   77.262
LGA    W    39_A      W    39_A     0.659     0    0.046   0.049     0.816   90.476   91.837
LGA    V    40_A      V    40_A     0.568     0    0.041   0.083     0.625   90.476   90.476
LGA    R    41_A      R    41_A     0.860     0    0.030   0.261     1.621   90.476   83.939
LGA    Q    42_A      Q    42_A     0.903     0    0.019   0.188     1.015   88.214   89.471
LGA    A    43_A      A    43_A     0.883     0    0.041   0.052     1.026   92.857   90.571
LGA    P    44_A      P    44_A     0.280     0    0.099   0.115     1.101   92.976   91.973
LGA    G    45_A      G    45_A     1.762     0    0.069   0.069     2.141   72.976   72.976
LGA    Q    46_A      Q    46_A     0.867     0    0.047   0.170     2.485   88.214   78.889
LGA    G    47_A      G    47_A     1.011     0    0.048   0.048     1.011   88.214   88.214
LGA    L    48_A      L    48_A     0.886     0    0.028   0.183     0.973   90.476   90.476
LGA    E    49_A      E    49_A     1.020     0    0.059   0.310     2.548   88.214   79.841
LGA    W    50_A      W    50_A     1.037     0    0.015   0.172     1.656   83.690   81.497
LGA    M    51_A      M    51_A     1.167     0    0.024   0.225     1.606   81.429   80.357
LGA    G    52_A      G    52_A     1.008     0    0.039   0.039     1.008   88.214   88.214
LGA    G    53_A      G    53_A     0.969     0    0.037   0.037     1.012   88.214   88.214
LGA    I    54_A      I    54_A     0.767     0    0.037   1.111     3.302   90.476   82.083
LGA    I    55_A      I    55_A     0.759     0    0.048   0.083     1.142   88.214   89.345
LGA    P    56_A      P    56_A     1.276     0    0.026   0.060     1.635   81.429   78.980
LGA    I    57_A      I    57_A     0.932     0    0.025   1.524     3.646   85.952   73.214
LGA    F    58_A      F    58_A     1.332     0    0.093   0.682     2.122   81.429   77.576
LGA    G    59_A      G    59_A     1.766     0    0.047   0.047     2.134   70.833   70.833
LGA    T    60_A      T    60_A     1.576     0    0.064   0.081     2.182   79.405   75.442
LGA    A    61_A      A    61_A     1.073     0    0.057   0.065     1.442   83.690   83.238
LGA    N    62_A      N    62_A     1.013     0    0.044   1.359     5.007   85.952   65.774
LGA    Y    63_A      Y    63_A     0.976     0    0.016   0.290     1.384   83.690   88.294
LGA    A    64_A      A    64_A     1.649     0    0.041   0.057     1.734   75.000   74.571
LGA    Q    65_A      Q    65_A     2.104     0    0.060   1.217     7.168   66.786   48.624
LGA    R    66_A      R    66_A     2.068     0    0.139   1.670     5.487   70.833   58.961
LGA    F    67_A      F    67_A     1.413     0    0.098   0.259     1.718   79.286   80.736
LGA    Q    68_A      Q    68_A     1.180     0    0.025   1.264     4.496   81.429   68.413
LGA    G    69_A      G    69_A     0.952     0    0.190   0.190     1.924   83.810   83.810
LGA    R    70_A      R    70_A     1.137     0    0.128   1.315     2.877   79.286   73.853
LGA    L    71_A      L    71_A     1.255     0    0.050   0.201     1.917   81.429   78.214
LGA    T    72_A      T    72_A     0.969     0    0.043   0.105     1.338   88.214   85.306
LGA    I    73_A      I    73_A     0.514     0    0.048   0.658     2.549   90.476   86.310
LGA    T    74_A      T    74_A     0.487     0    0.039   0.782     1.794  100.000   92.245
LGA    A    75_A      A    75_A     0.704     0    0.028   0.057     0.838   90.476   90.476
LGA    D    76_A      D    76_A     0.787     0    0.032   0.502     1.370   90.476   89.345
LGA    E    77_A      E    77_A     1.056     0    0.082   1.329     6.121   83.690   60.582
LGA    S    78_A      S    78_A     1.287     0    0.052   0.076     1.366   81.429   81.429
LGA    T    79_A      T    79_A     1.411     0    0.099   0.292     1.885   81.429   77.755
LGA    S    80_A      S    80_A     0.744     0    0.069   0.178     1.049   88.214   88.968
LGA    T    81_A      T    81_A     0.614     0    0.060   0.085     0.697   90.476   90.476
LGA    A    82_A      A    82_A     0.359     0    0.043   0.046     0.430  100.000  100.000
LGA    Y    83_A      Y    83_A     0.198     0    0.043   0.113     1.101  100.000   95.278
LGA    M    84_A      M    84_A     0.457     0    0.045   0.160     0.727  100.000   95.238
LGA    E    85_A      E    85_A     0.856     0    0.060   0.844     3.430   88.214   76.561
LGA    L    86_A      L    86_A     1.368     0    0.020   0.054     1.522   81.429   80.357
LGA    S    87_A      S    87_A     1.394     0    0.054   0.716     1.664   81.429   80.000
LGA    S    88_A      S    88_A     0.635     0    0.046   0.785     3.039   90.595   83.810
LGA    L    89_A      L    89_A     0.414     0    0.034   0.163     0.974   95.238   94.048
LGA    R    90_A      R    90_A     1.366     0    0.095   0.921     5.954   83.690   58.745
LGA    S    91_A      S    91_A     2.303     0    0.305   0.699     3.502   64.762   61.190
LGA    D    92_A      D    92_A     2.263     0    0.097   0.730     2.845   68.810   65.833
LGA    D    93_A      D    93_A     1.123     0    0.200   0.246     1.567   81.548   82.619
LGA    T    94_A      T    94_A     0.850     0    0.080   0.910     2.695   88.214   80.748
LGA    A    95_A      A    95_A     0.821     0    0.027   0.034     1.067   90.476   88.667
LGA    V    96_A      V    96_A     0.836     0    0.051   0.081     0.942   90.476   90.476
LGA    Y    97_A      Y    97_A     0.567     0    0.058   0.080     1.212   90.476   88.214
LGA    F    98_A      F    98_A     0.468     0    0.039   0.088     0.547  100.000   93.939
LGA    C    99_A      C    99_A     0.354     0    0.072   0.067     0.368  100.000  100.000
LGA    A   100_A      A   100_A     0.453     0    0.058   0.062     0.537   95.238   96.190
LGA    R   101_A      R   101_A     0.810     0    0.022   0.390     2.337   85.952   78.485
LGA    E   102_A      E   102_A     1.290     0    0.081   0.520     2.768   81.429   70.635
LGA    N   103_A      N   103_A     0.980     0    0.408   0.478     2.566   86.071   76.548
LGA    L   104_A      L   104_A     1.654     0    0.084   1.061     5.291   70.833   55.119
LGA    D   105_A      D   105_A     2.145     0    0.034   1.048     6.015   70.952   54.821
LGA    N   106_A      N   106_A     3.048     0    0.084   0.932     4.820   43.929   55.476
LGA    S   107_A      S   107_A     4.939     0    0.700   0.625     5.911   35.714   30.952
LGA    G   108_A      G   108_A     4.548     0    0.236   0.236     4.967   31.429   31.429
LGA    T   109_A      T   109_A     7.262     0    0.186   1.025    10.911   14.405    8.503
LGA    Y   110_A      Y   110_A     4.680     0    0.210   1.376    10.072   36.071   22.460
LGA    Y   111_A      Y   111_A     2.279     0    0.058   1.339     8.220   55.476   47.897
LGA    Y   112_A      Y   112_A     2.509     0    0.171   0.812     3.285   71.190   62.540
LGA    F   113_A      F   113_A     1.589     0    0.063   1.171     3.929   79.405   64.199
LGA    S   114_A      S   114_A     1.627     0    0.648   0.695     4.229   64.048   65.794
LGA    G   115_A      G   115_A     1.853     0    0.456   0.456     1.853   75.000   75.000
LGA    W   116_A      W   116_A     1.722     0    0.047   1.749     6.192   72.857   58.639
LGA    F   117_A      F   117_A     1.003     0    0.118   0.322     1.793   85.952   83.983
LGA    D   118_A      D   118_A     1.820     0    0.617   0.971     4.253   69.286   58.095
LGA    P   119_A      P   119_A     1.192     0    0.132   0.276     2.839   83.810   73.469
LGA    W   120_A      W   120_A     0.483     0    0.018   0.084     0.675   95.238   95.238
LGA    G   121_A      G   121_A     0.462     0    0.076   0.076     0.686   95.238   95.238
LGA    Q   122_A      Q   122_A     0.638     0    0.090   1.065     5.067   90.476   70.635
LGA    G   123_A      G   123_A     0.610     0    0.033   0.033     0.781   90.476   90.476
LGA    T   124_A      T   124_A     0.781     0    0.055   0.853     2.087   90.476   85.510
LGA    L   125_A      L   125_A     0.481     0    0.019   0.213     0.601   97.619   96.429
LGA    V   126_A      V   126_A     0.295     0    0.022   0.066     0.681   97.619   97.279
LGA    T   127_A      T   127_A     0.903     0    0.037   0.144     1.355   88.333   86.667
LGA    V   128_A      V   128_A     2.095     0    0.554   0.618     3.259   65.119   71.156
LGA    S   129_A      S   129_A     7.519     0    0.257   0.360    11.416    7.143    8.413
LGA    S   130_A      S   130_A    14.445     0    0.322   0.707    16.775    0.000    0.000
LGA    Q   131_A      Q   131_A    21.875     0    0.269   0.976    29.456    0.000    0.000
LGA    S   132_A      S   132_A    25.954     0    0.121   0.176    29.861    0.000    0.000
LGA    A   133_A      A   133_A    32.121     0    0.543   0.542    35.423    0.000    0.000
LGA    L   134_A      L   134_A    36.908     0    0.013   0.075    40.563    0.000    0.000
LGA    T   135_A      T   135_A    37.600     0    0.018   0.052    40.672    0.000    0.000
LGA    Q   136_A      Q   136_A    37.124     0    0.030   0.115    37.124    0.000    0.000
LGA    P   137_A      P   137_A    37.363     0    0.035   0.138    39.688    0.000    0.000
LGA    R   138_A      R   138_A    31.106     0    0.031   1.344    33.699    0.000    0.000
LGA    S   139_A      S   139_A    32.191     0    0.020   0.585    36.852    0.000    0.000
LGA    V   140_A      V   140_A    37.066     0    0.039   0.096    39.962    0.000    0.000
LGA    S   141_A      S   141_A    37.302     0    0.076   0.128    41.733    0.000    0.000
LGA    G   142_A      G   142_A    40.704     0    0.037   0.037    40.704    0.000    0.000
LGA    S   143_A      S   143_A    40.746     0    0.042   0.055    43.043    0.000    0.000
LGA    P   144_A      P   144_A    39.248     0    0.055   0.323    43.432    0.000    0.000
LGA    G   145_A      G   145_A    45.612     0    0.120   0.120    49.702    0.000    0.000
LGA    Q   146_A      Q   146_A    48.675     0    0.042   0.846    51.116    0.000    0.000
LGA    S   147_A      S   147_A    50.020     0    0.031   0.059    53.662    0.000    0.000
LGA    V   148_A      V   148_A    46.866     0    0.045   1.176    47.872    0.000    0.000
LGA    T   149_A      T   149_A    48.653     0    0.062   1.136    52.989    0.000    0.000
LGA    I   150_A      I   150_A    43.965     0    0.052   0.068    46.148    0.000    0.000
LGA    S   151_A      S   151_A    46.793     0    0.017   0.039    48.311    0.000    0.000
LGA    C   152_A      C   152_A    44.362     0    0.041   0.064    48.022    0.000    0.000
LGA    T   153_A      T   153_A    46.811     0    0.023   1.059    49.372    0.000    0.000
LGA    G   154_A      G   154_A    46.179     0    0.049   0.049    48.798    0.000    0.000
LGA    T   155_A      T   155_A    49.896     0    0.044   0.951    52.281    0.000    0.000
LGA    S   156_A      S   156_A    56.213     0    0.104   0.650    58.152    0.000    0.000
LGA    S   157_A      S   157_A    52.496     0    0.202   0.751    53.137    0.000    0.000
LGA    D   158_A      D   158_A    49.952     0    0.053   0.948    53.620    0.000    0.000
LGA    I   159_A      I   159_A    52.654     0    0.065   1.346    57.328    0.000    0.000
LGA    G   160_A      G   160_A    58.608     0    0.057   0.057    62.710    0.000    0.000
LGA    G   161_A      G   161_A    60.660     0    0.205   0.205    63.482    0.000    0.000
LGA    Y   162_A      Y   162_A    61.198     0    0.048   1.116    61.883    0.000    0.000
LGA    N   163_A      N   163_A    61.535     0    0.304   0.911    65.988    0.000    0.000
LGA    F   164_A      F   164_A    55.777     0    0.077   0.255    62.845    0.000    0.000
LGA    V   165_A      V   165_A    50.851     0    0.039   0.127    53.156    0.000    0.000
LGA    S   166_A      S   166_A    46.765     0    0.040   0.620    47.628    0.000    0.000
LGA    W   167_A      W   167_A    41.673     0    0.026   0.084    47.296    0.000    0.000
LGA    Y   168_A      Y   168_A    35.812     0    0.068   1.262    42.330    0.000    0.000
LGA    Q   169_A      Q   169_A    31.210     0    0.034   0.061    33.189    0.000    0.000
LGA    Q   170_A      Q   170_A    24.377     0    0.038   0.135    26.544    0.000    0.000
LGA    H   171_A      H   171_A    19.552     0    0.051   0.129    25.681    0.000    0.000
LGA    P   172_A      P   172_A    12.908     0    0.040   0.108    15.007    0.000    0.000
LGA    G   173_A      G   173_A    14.835     0    0.054   0.054    19.158    0.000    0.000
LGA    K   174_A      K   174_A    21.383     0    0.032   0.880    23.275    0.000    0.000
LGA    A   175_A      A   175_A    26.383     0    0.040   0.046    28.893    0.000    0.000
LGA    P   176_A      P   176_A    29.285     0    0.045   0.100    33.073    0.000    0.000
LGA    K   177_A      K   177_A    35.218     0    0.047   0.278    40.598    0.000    0.000
LGA    L   178_A      L   178_A    41.485     0    0.029   0.075    48.297    0.000    0.000
LGA    M   179_A      M   179_A    43.836     0    0.051   0.568    48.344    0.000    0.000
LGA    I   180_A      I   180_A    49.459     0    0.033   0.127    52.276    0.000    0.000
LGA    Y   181_A      Y   181_A    53.030     0    0.018   0.104    62.161    0.000    0.000
LGA    D   182_A      D   182_A    58.535     0    0.022   1.216    63.256    0.000    0.000
LGA    A   183_A      A   183_A    56.953     0    0.077   0.076    59.034    0.000    0.000
LGA    T   184_A      T   184_A    60.413     0    0.039   1.203    64.663    0.000    0.000
LGA    K   185_A      K   185_A    60.155     0    0.035   0.216    69.374    0.000    0.000
LGA    R   186_A      R   186_A    55.850     0    0.042   0.538    59.424    0.000    0.000
LGA    P   187_A      P   187_A    54.717     0    0.060   0.326    54.816    0.000    0.000
LGA    S   188_A      S   188_A    56.153     0    0.056   0.517    59.652    0.000    0.000
LGA    G   189_A      G   189_A    50.615     0    0.113   0.113    53.055    0.000    0.000
LGA    V   190_A      V   190_A    48.176     0    0.055   0.103    51.846    0.000    0.000
LGA    P   191_A      P   191_A    49.090     0    0.032   0.135    50.836    0.000    0.000
LGA    D   192_A      D   192_A    54.953     0    0.104   1.118    58.848    0.000    0.000
LGA    R   193_A      R   193_A    50.855     0    0.034   0.630    51.732    0.000    0.000
LGA    F   194_A      F   194_A    49.102     0    0.017   0.071    53.122    0.000    0.000
LGA    S   195_A      S   195_A    54.590     0    0.038   0.070    56.963    0.000    0.000
LGA    G   196_A      G   196_A    55.173     0    0.023   0.023    59.838    0.000    0.000
LGA    S   197_A      S   197_A    59.889     0    0.037   0.111    61.407    0.000    0.000
LGA    K   198_A      K   198_A    60.257     0    0.043   0.825    64.863    0.000    0.000
LGA    S   199_A      S   199_A    64.231     0    0.070   0.619    67.472    0.000    0.000
LGA    G   200_A      G   200_A    63.496     0    0.060   0.060    64.423    0.000    0.000
LGA    N   201_A      N   201_A    56.264     0    0.138   0.183    59.030    0.000    0.000
LGA    T   202_A      T   202_A    54.112     0    0.023   0.083    56.845    0.000    0.000
LGA    A   203_A      A   203_A    52.739     0    0.045   0.050    52.739    0.000    0.000
LGA    S   204_A      S   204_A    51.493     0    0.026   0.724    55.244    0.000    0.000
LGA    L   205_A      L   205_A    48.151     0    0.053   0.131    48.822    0.000    0.000
LGA    T   206_A      T   206_A    50.127     0    0.041   0.856    54.063    0.000    0.000
LGA    I   207_A      I   207_A    46.331     0    0.077   0.116    47.506    0.000    0.000
LGA    S   208_A      S   208_A    49.875     0    0.037   0.074    54.302    0.000    0.000
LGA    G   209_A      G   209_A    46.952     0    0.039   0.039    48.443    0.000    0.000
LGA    L   210_A      L   210_A    40.524     0    0.037   0.106    43.193    0.000    0.000
LGA    Q   211_A      Q   211_A    34.611     0    0.033   0.254    40.332    0.000    0.000
LGA    A   212_A      A   212_A    27.485     0    0.038   0.041    30.032    0.000    0.000
LGA    E   213_A      E   213_A    26.733     0    0.087   0.711    33.371    0.000    0.000
LGA    D   214_A      D   214_A    30.613     0    0.053   1.108    36.113    0.000    0.000
LGA    E   215_A      E   215_A    25.235     0    0.068   1.033    26.859    0.000    0.000
LGA    A   216_A      A   216_A    23.147     0    0.039   0.067    25.242    0.000    0.000
LGA    D   217_A      D   217_A    23.945     0    0.041   1.027    26.660    0.000    0.000
LGA    Y   218_A      Y   218_A    30.579     0    0.035   1.245    32.998    0.000    0.000
LGA    Y   219_A      Y   219_A    32.094     0    0.031   0.068    36.067    0.000    0.000
LGA    C   220_A      C   220_A    38.539     0    0.057   0.064    40.270    0.000    0.000
LGA    C   221_A      C   221_A    40.017     0    0.081   0.272    44.622    0.000    0.000
LGA    S   222_A      S   222_A    45.411     0    0.032   0.595    46.416    0.000    0.000
LGA    Y   223_A      Y   223_A    48.703     0    0.126   1.386    56.372    0.000    0.000
LGA    A   224_A      A   224_A    47.164     0    0.497   0.484    49.870    0.000    0.000
LGA    G   225_A      G   225_A    54.019     0    0.119   0.119    54.052    0.000    0.000
LGA    D   226_A      D   226_A    55.926     0    0.405   0.870    60.960    0.000    0.000
LGA    Y   227_A      Y   227_A    51.627     0    0.594   1.451    62.774    0.000    0.000
LGA    T   228_A      T   228_A    46.798     0    0.074   1.102    48.446    0.000    0.000
LGA    P   229_A      P   229_A    47.992     0    0.233   0.411    50.009    0.000    0.000
LGA    G   230_A      G   230_A    42.765     0    0.081   0.081    45.034    0.000    0.000
LGA    V   231_A      V   231_A    40.515     0    0.043   1.043    41.848    0.000    0.000
LGA    V   232_A      V   232_A    35.926     0    0.056   1.122    38.101    0.000    0.000
LGA    F   233_A      F   233_A    32.836     0    0.045   0.086    33.678    0.000    0.000
LGA    G   234_A      G   234_A    32.594     0    0.040   0.040    32.954    0.000    0.000
LGA    G   235_A      G   235_A    27.023     0    0.070   0.070    29.442    0.000    0.000
LGA    G   236_A      G   236_A    27.173     0    0.042   0.042    27.973    0.000    0.000
LGA    T   237_A      T   237_A    29.566     0    0.041   1.024    33.851    0.000    0.000
LGA    K   238_A      K   238_A    25.743     0    0.055   0.663    29.286    0.000    0.000
LGA    L   239_A      L   239_A    29.714     0    0.064   1.116    34.633    0.000    0.000
LGA    T   240_A      T   240_A    28.410     0    0.035   0.205    32.638    0.000    0.000
LGA    V   241_A      V   241_A    30.786     0    0.047   0.081    31.709    0.000    0.000
LGA    L   242_A      L   242_A    32.634     0    0.218   1.051    35.689    0.000    0.000
LGA    G   243_A      G   243_A    30.196     0    0.315   0.315    30.590    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      240     960    960  100.00    1805   1805  100.00               240
SUMMARY(RMSD_GDC):    16.671         16.610                 17.210           41.720   39.348

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  262  240    4.0    122    1.56    47.604    49.136     7.360

LGA_LOCAL      RMSD:   1.558  Number of atoms:  122  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  30.498  Number of assigned atoms:  240 
Std_ASGN_ATOMS RMSD:  16.671  Standard rmsd on all 240 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.629614 * X  +  -0.344447 * Y  +   0.696378 * Z  +  45.226788
  Y_new =   0.246932 * X  +  -0.938588 * Y  +  -0.240993 * Z  + -51.918243
  Z_new =   0.736621 * X  +   0.020225 * Y  +   0.676003 * Z  +  78.101608 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  2.767833 -0.828060  0.029910   [DEG:  158.5851  -47.4444    1.7137 ]
ZXZ:  1.237630  0.828471  1.543347   [DEG:   70.9110   47.4679   88.4272 ]
 
# END of job
