
#######################################################
#                                                     #
#                        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:   161       2_A - 162_A       4.94    12.61
  LONGEST_CONTINUOUS_SEGMENT:   161       3_A - 163_A       4.97    12.46
  LCS_AVERAGE:     69.72

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   126       3_A - 128_A       1.97    12.73
  LCS_AVERAGE:     45.88

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    43       4_A - 46_A        0.97    13.35
  LONGEST_CONTINUOUS_SEGMENT:    43       5_A - 47_A        1.00    13.31
  LCS_AVERAGE:     14.95

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      4    5  157      3    4    5    6   13   13   22   29   32   43   97  105  111  123  129  130  136  138  141  143 
LCS_GDT     M     2_A     M     2_A      4  125  161      3   11   19   28   41   54   80  108  113  118  125  129  132  134  136  142  146  148  153  156 
LCS_GDT     N     3_A     N     3_A      4  126  161      3    8   18   28   37  101  118  122  124  128  130  132  137  142  145  148  150  153  155  157 
LCS_GDT     I     4_A     I     4_A     43  126  161      7   54   98  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     E     5_A     E     5_A     43  126  161     14   69  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     V     6_A     V     6_A     43  126  161     23   71  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     A     7_A     A     7_A     43  126  161     15   66  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     R     8_A     R     8_A     43  126  161     11   64  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     A     9_A     A     9_A     43  126  161     30   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     A    10_A     A    10_A     43  126  161     30   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     R    11_A     R    11_A     43  126  161     30   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     L    12_A     L    12_A     43  126  161     22   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     A    13_A     A    13_A     43  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     Q    14_A     Q    14_A     43  126  161     28   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     I    15_A     I    15_A     43  126  161     17   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     F    16_A     F    16_A     43  126  161     28   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     K    17_A     K    17_A     43  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     E    18_A     E    18_A     43  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     I    19_A     I    19_A     43  126  161     16   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     C    20_A     C    20_A     43  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     D    21_A     D    21_A     43  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     G    22_A     G    22_A     43  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     I    23_A     I    23_A     43  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     I    24_A     I    24_A     43  126  161     30   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     S    25_A     S    25_A     43  126  161     17   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     Y    26_A     Y    26_A     43  126  161     30   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     R    27_A     R    27_A     43  126  161     30   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     D    28_A     D    28_A     43  126  161     18   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     S    29_A     S    29_A     43  126  161      7   60   98  112  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     S    30_A     S    30_A     43  126  161     23   70  100  113  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     Q    31_A     Q    31_A     43  126  161     22   71  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     Q    32_A     Q    32_A     43  126  161      7   71  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     T    33_A     T    33_A     43  126  161     22   71  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     L    34_A     L    34_A     43  126  161     22   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     A    35_A     A    35_A     43  126  161     22   69  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     A    36_A     A    36_A     43  126  161     22   69  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     P    37_A     P    37_A     43  126  161     22   69  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     L    38_A     L    38_A     43  126  161     22   69  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     L    39_A     L    39_A     43  126  161      3   60  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     N    40_A     N    40_A     43  126  161     24   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     L    41_A     L    41_A     43  126  161     31   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     P    42_A     P    42_A     43  126  161     31   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     P    43_A     P    43_A     43  126  161      9   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     K    44_A     K    44_A     43  126  161     31   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     K    45_A     K    45_A     43  126  161     27   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     K    46_A     K    46_A     43  126  161     20   71  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     N    47_A     N    47_A     43  126  161      8   56  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     A    48_A     A    48_A     21  126  161      4   56  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     D    49_A     D    49_A     21  126  161      4   24   87  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     Y    50_A     Y    50_A     21  126  161      5   62  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     Y    51_A     Y    51_A     21  126  161     20   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     E    52_A     E    52_A     21  126  161      7   46   96  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     K    53_A     K    53_A     41  126  161      3   24   74  105  118  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     I    54_A     I    54_A     41  126  161     17   69  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     S    55_A     S    55_A     41  126  161      6   37   74  108  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     D    56_A     D    56_A     41  126  161      7   57   97  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     P    57_A     P    57_A     41  126  161     12   71   99  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     L    58_A     L    58_A     41  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     D    59_A     D    59_A     41  126  161     18   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     L    60_A     L    60_A     41  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     S    61_A     S    61_A     41  126  161     10   46   93  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     T    62_A     T    62_A     41  126  161     16   45   94  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     I    63_A     I    63_A     41  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     E    64_A     E    64_A     41  126  161     13   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     K    65_A     K    65_A     41  126  161     10   57   98  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     Q    66_A     Q    66_A     41  126  161     16   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     I    67_A     I    67_A     41  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     L    68_A     L    68_A     41  126  161     10   71  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     I    69_A     I    69_A     41  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     G    70_A     G    70_A     41  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     Y    71_A     Y    71_A     41  126  161     28   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     Y    72_A     Y    72_A     41  126  161      8   65  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     K    73_A     K    73_A     41  126  161     15   64   98  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     T    74_A     T    74_A     41  126  161     18   69  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     V    75_A     V    75_A     41  126  161     28   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     E    76_A     E    76_A     41  126  161     14   69  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     A    77_A     A    77_A     41  126  161     20   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     F    78_A     F    78_A     41  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     D    79_A     D    79_A     41  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     A    80_A     A    80_A     41  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     D    81_A     D    81_A     41  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     M    82_A     M    82_A     41  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     L    83_A     L    83_A     41  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     K    84_A     K    84_A     41  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     V    85_A     V    85_A     41  126  161     30   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     F    86_A     F    86_A     41  126  161     30   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     R    87_A     R    87_A     41  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     N    88_A     N    88_A     41  126  161     17   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     A    89_A     A    89_A     41  126  161     28   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     E    90_A     E    90_A     41  126  161     23   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     K    91_A     K    91_A     41  126  161     29   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     Y    92_A     Y    92_A     41  126  161      5   62  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     Y    93_A     Y    93_A     41  126  161     12   68  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     G    94_A     G    94_A     41  126  161     10   46   95  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     R    95_A     R    95_A      4  126  161      3    4   21   49  103  120  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     K    96_A     K    96_A      4  126  161      3    4    6    8   42   80   91  117  125  128  129  133  137  142  144  148  151  153  155  157 
LCS_GDT     S    97_A     S    97_A      4  126  161      3    4   19   39   59   96  111  122  127  128  130  134  137  142  144  148  151  153  155  157 
LCS_GDT     P    98_A     P    98_A      4  126  161      3   14   20   51   86  106  119  124  127  128  133  135  139  142  145  148  151  153  155  157 
LCS_GDT     I    99_A     I    99_A     28  126  161      9   57   93  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     G   100_A     G   100_A     28  126  161      6   47   92  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     R   101_A     R   101_A     28  126  161      6   66   94  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     D   102_A     D   102_A     28  126  161     24   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     V   103_A     V   103_A     28  126  161     16   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     C   104_A     C   104_A     28  126  161      5   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     R   105_A     R   105_A     28  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     L   106_A     L   106_A     28  126  161     31   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     R   107_A     R   107_A     28  126  161     31   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     K   108_A     K   108_A     28  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     A   109_A     A   109_A     28  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     Y   110_A     Y   110_A     28  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     Y   111_A     Y   111_A     28  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     S   112_A     S   112_A     28  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     A   113_A     A   113_A     28  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     R   114_A     R   114_A     28  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     H   115_A     H   115_A     28  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     E   116_A     E   116_A     28  126  161     30   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     A   117_A     A   117_A     28  126  161     30   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     S   118_A     S   118_A     28  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     A   119_A     A   119_A     28  126  161     11   67  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     Q   120_A     Q   120_A     28  126  161     28   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     I   121_A     I   121_A     28  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     D   122_A     D   122_A     28  126  161     17   71  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     E   123_A     E   123_A     28  126  161     24   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     I   124_A     I   124_A     28  126  161     32   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     V   125_A     V   125_A     28  126  161     30   72  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     G   126_A     G   126_A     28  126  161     11   20   91  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     E   127_A     E   127_A      3  126  161      3    3    4    5    7    9   41   54  115  125  130  136  139  142  145  148  151  153  155  157 
LCS_GDT     T   128_A     T   128_A      3  126  161      3    3    8   20   31   50   87  110  123  127  131  136  139  142  145  148  151  153  155  157 
LCS_GDT     A   129_A     A   129_A      3    8  161      3    3    4    5   11   17   31   59   93  117  128  136  139  142  145  148  151  153  155  157 
LCS_GDT     S   130_A     S   130_A      5    8  161      3    5   13   34   63  109  122  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     E   131_A     E   131_A      5    8  161      3   12   21   40   57   83  117  123  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     A   132_A     A   132_A      5    8  161      3    5   17   25   45   79  110  123  125  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     D   133_A     D   133_A      5    8  161      3    4   17   27   42   60   86  113  122  127  133  135  139  142  145  148  151  153  155  157 
LCS_GDT     S   134_A     S   134_A      5    8  161      3    3   14   16   30   72   87  116  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     S   135_A     S   135_A      4    8  161      3    3    5    6    8   44   74   97  121  125  130  134  139  142  145  148  151  153  155  157 
LCS_GDT     E   136_A     E   136_A      4    7  161      3    5   11   15   19   72   87  117  125  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     T   137_A     T   137_A      4    7  161      3    3    5   22   26   41   70   88  105  121  130  136  139  142  145  148  151  153  155  157 
LCS_GDT     S   138_A     S   138_A      4    7  161      3    4    4   17   35   45   64   89  113  123  126  132  139  142  145  148  151  153  155  157 
LCS_GDT     V   139_A     V   139_A      4    7  161      3    8   31   51   82  109  119  123  127  128  130  136  139  142  145  148  151  153  155  157 
LCS_GDT     S   140_A     S   140_A      4    7  161      3    4    4    8   37  109  118  124  127  128  133  135  139  142  145  148  151  153  155  157 
LCS_GDT     E   141_A     E   141_A      4    7  161      3    4    4   16   20   38   70   89  116  125  131  133  137  142  144  148  151  153  154  157 
LCS_GDT     K   142_A     K   142_A      4    7  161      7   19   54   79   98  113  119  123  125  128  133  135  139  142  145  148  151  153  155  157 
LCS_GDT     E   143_A     E   143_A      4    7  161      3    4   13   35   62   86  102  117  123  127  131  135  139  142  144  148  151  152  154  156 
LCS_GDT     S   144_A     S   144_A      5   55  161      3    4   32   40   69   84   97  100  117  124  131  133  135  139  144  146  147  150  151  153 
LCS_GDT     G   145_A     G   145_A      5   55  161      4    4   13   44   57   68   77   92  103  113  130  133  135  139  142  146  147  149  151  152 
LCS_GDT     H   146_A     H   146_A      5   55  161      4    9   27   39   47   49   52   54   57   59   62   74  119  131  137  140  142  143  147  149 
LCS_GDT     E   147_A     E   147_A      5   55  161      4    4    8   18   38   43   47   54   57   59   90  110  125  130  136  140  141  144  149  151 
LCS_GDT     K   148_A     K   148_A      5   55  161      4    4    5    6    9   17   41   49   67   75   87  108  118  128  134  137  141  145  149  151 
LCS_GDT     D   149_A     D   149_A      3   55  161      3    3   12   25   42   49   52   54   57   75   87   98  109  110  118  125  136  144  149  150 
LCS_GDT     D   150_A     D   150_A     11   55  161      3    7   12   19   43   48   51   54   57   59   62   66   80   87   96  100  130  138  140  142 
LCS_GDT     D   151_A     D   151_A     11   55  161      3   18   36   42   48   49   52   54   57   59   66   98  109  110  118  125  130  140  149  150 
LCS_GDT     V   152_A     V   152_A     33   55  161     15   32   40   45   48   56   79  109  122  127  130  134  137  141  143  147  151  152  154  156 
LCS_GDT     I   153_A     I   153_A     33   55  161     15   32   45   79  101  111  120  125  127  128  131  136  139  142  145  148  151  153  155  157 
LCS_GDT     R   154_A     R   154_A     33   55  161     10   37   77  105  117  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     C   155_A     C   155_A     33   55  161     15   32   40   45   73   89  109  120  123  128  129  131  138  142  145  148  151  153  155  157 
LCS_GDT     I   156_A     I   156_A     33   55  161     11   31   40   45   48   49   52   54   69   88   97  116  127  130  133  136  142  146  150  156 
LCS_GDT     C   157_A     C   157_A     33   55  161      6   30   40   45   48   49   52   60   91  112  120  123  127  131  135  140  145  149  152  156 
LCS_GDT     G   158_A     G   158_A     33   55  161      6   31   40   45   48   49   52   54   57   66  110  123  132  136  139  144  146  148  152  156 
LCS_GDT     L   159_A     L   159_A     33   55  161      3   30   40   45   48   97  119  124  127  128  133  134  137  142  144  148  150  153  155  157 
LCS_GDT     Y   160_A     Y   160_A     33   55  161     17   69  100  114  119  121  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     K   161_A     K   161_A     33   55  161      3   34   62   96  112  120  123  125  127  128  133  136  139  142  145  148  151  153  155  157 
LCS_GDT     D   162_A     D   162_A     35   55  161      3   14   39   45   48   67   80   97  105  119  128  136  139  142  145  148  151  153  155  157 
LCS_GDT     E   163_A     E   163_A     35   55  161      3   20   39   45   48   55   78   91  103  113  125  133  139  142  145  148  151  153  155  157 
LCS_GDT     G   164_A     G   164_A     35   55   73      4   22   33   45   48   49   52   54   64   79   94   99  113  123  128  136  144  148  152  156 
LCS_GDT     L   165_A     L   165_A     35   55   73      9   32   40   45   48   49   52   54   57   59   66   74  102  114  125  128  132  137  145  150 
LCS_GDT     M   166_A     M   166_A     35   55   73      5   31   40   45   48   49   52   54   60   67   75   99  109  121  125  130  138  145  149  155 
LCS_GDT     I   167_A     I   167_A     35   55   73     12   32   40   45   48   49   52   54   57   59   66   74   88   98  105  125  132  137  140  147 
LCS_GDT     Q   168_A     Q   168_A     35   55   73     11   32   40   45   48   49   52   54   60   67   75   85   98  106  112  122  133  137  147  152 
LCS_GDT     C   169_A     C   169_A     35   55   73     12   32   40   45   48   49   52   54   65   79   83   99  110  123  128  136  144  151  153  156 
LCS_GDT     D   170_A     D   170_A     35   55   73     12   32   40   45   48   49   52   54   57   59   62   66   70   71  103  107  112  127  135  141 
LCS_GDT     K   171_A     K   171_A     35   55   73     15   32   40   45   48   49   52   54   65   79   83  100  111  123  128  139  147  151  153  157 
LCS_GDT     C   172_A     C   172_A     35   55   73     12   32   40   45   48   49   71   88   97  110  125  136  139  142  145  148  151  153  155  157 
LCS_GDT     M   173_A     M   173_A     35   55   73     12   32   40   45   48   49   52   54   57   74   85   90   99  108  131  135  142  148  151  156 
LCS_GDT     V   174_A     V   174_A     35   55   73     11   32   40   45   48   63   80   97  104  119  128  136  139  142  145  148  151  153  155  157 
LCS_GDT     W   175_A     W   175_A     35   55   73     15   32   40   45   48   55   70   80   97  105  120  131  138  142  145  148  151  153  155  157 
LCS_GDT     Q   176_A     Q   176_A     35   55   73     11   32   40   45   48   51   67   89  102  114  120  126  138  142  145  148  150  153  155  157 
LCS_GDT     H   177_A     H   177_A     35   55   73     15   32   40   45   48   49   57   68   83   94  106  117  125  131  139  145  148  151  155  157 
LCS_GDT     C   178_A     C   178_A     35   55   73     15   32   40   45   48   49   52   54   57   59   66   93  101  111  115  123  129  136  147  152 
LCS_GDT     D   179_A     D   179_A     35   55   73     15   32   40   45   48   49   52   54   57   59   66   79  101  111  117  124  129  136  147  150 
LCS_GDT     C   180_A     C   180_A     35   55   73     15   32   40   45   48   49   52   54   57   74   82   92  101  111  120  128  136  140  147  152 
LCS_GDT     M   181_A     M   181_A     35   55   73     15   32   40   45   48   49   52   54   57   59   70   84   95  111  117  127  132  136  141  148 
LCS_GDT     G   182_A     G   182_A     35   55   73     15   32   40   45   48   49   52   54   57   59   62   66   70   71   73   74   76   89   96  131 
LCS_GDT     V   183_A     V   183_A     35   55   73      9   32   40   45   48   49   52   54   57   59   62   66   70   71   73   74   76   79   82   85 
LCS_GDT     N   184_A     N   184_A     35   55   73      3   20   37   45   48   49   52   54   57   59   62   66   70   71   73   74   76   79   82   85 
LCS_GDT     T   185_A     T   185_A     35   55   73      3    8   23   45   48   49   52   54   57   59   62   66   70   71   73   74   76   79   82   85 
LCS_GDT     D   186_A     D   186_A     35   55   73      8   32   40   45   48   49   52   54   57   59   62   66   70   71   73   74   76   79   82   85 
LCS_GDT     V   187_A     V   187_A     35   55   73      3   17   40   45   48   49   52   54   57   59   62   66   70   71   73   74   76   79   82   85 
LCS_GDT     E   188_A     E   188_A     35   55   73      3   25   40   45   48   49   52   54   57   59   62   66   70   71   73   74   76   79   82   85 
LCS_GDT     H   189_A     H   189_A     35   55   73     15   32   40   45   48   49   52   54   57   59   62   66   70   71   73   74   76   79   82   85 
LCS_GDT     Y   190_A     Y   190_A     35   55   73     15   32   40   45   48   49   52   54   57   59   62   66   70   71   73   74   76   98  125  127 
LCS_GDT     L   191_A     L   191_A     35   55   73     15   32   40   45   48   49   52   54   57   59   66   79  101  111  117  123  132  140  147  152 
LCS_GDT     C   192_A     C   192_A     35   55   73     12   32   40   45   48   49   52   64   81   94  109  122  127  131  136  144  148  151  155  157 
LCS_GDT     E   193_A     E   193_A     35   55   73     15   32   40   45   48   49   52   54   57   70   87   96  103  127  131  134  138  143  147  152 
LCS_GDT     Q   194_A     Q   194_A     35   55   73      8   32   40   45   48   49   52   62  110  119  122  126  129  132  135  142  147  150  155  157 
LCS_GDT     C   195_A     C   195_A     35   55   73      8   32   40   45   48   49   56   91  110  121  123  129  131  134  144  148  150  153  155  157 
LCS_GDT     D   196_A     D   196_A     35   55   73      8   32   40   45   48   49   52   54   57   60   70   84   95  111  118  127  134  140  147  152 
LCS_GDT     P   197_A     P   197_A     34   55   73      4    5   27   43   48   49   52   54   57   59   62   63   85   95  100  124  128  133  141  144 
LCS_GDT     R   198_A     R   198_A      7   55   73      4    7   17   31   41   49   52   54   57   59   62   66   70   71   73   74  120  129  130  131 
LCS_GDT     P   199_A     P   199_A      6   55   73      3    7   21   30   40   47   52   54   56   59   62   66   70   71   73   74   76   89   96  103 
LCS_GDT     V   200_A     V   200_A      6   52   73      4    5    6   15   25   31   40   47   54   59   61   63   65   71   73   74   78   89   96  103 
LCS_GDT     D   201_A     D   201_A      6    7   73      4    5    6    7   11   14   24   31   38   47   51   56   63   71   73   74   76   79   82   85 
LCS_GDT     R   202_A     R   202_A      6    7   73      4    5    5    7    8   10   13   15   22   25   31   42   47   59   64   73   78   89   96  109 
LCS_GDT     E   203_A     E   203_A      6    7   73      4    5    5    7    8   10   14   18   22   25   28   32   38   46   51   58   63   89   96  103 
LCS_GDT     V   204_A     V   204_A      3    7   73      3    3    3    5    7   10   14   18   21   25   27   37   47   49   64   66   70   77   79   81 
LCS_GDT     P   205_A     P   205_A      3    3   66      0    3    3    4    4    5   14   18   21   25   27   32   34   39   43   47   49   52   59   64 
LCS_AVERAGE  LCS_A:  43.52  (  14.95   45.88   69.72 )

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     72    100    114    119    121    123    125    127    128    133    136    139    142    145    148    151    153    155    157 
GDT PERCENT_AT  15.61  35.12  48.78  55.61  58.05  59.02  60.00  60.98  61.95  62.44  64.88  66.34  67.80  69.27  70.73  72.20  73.66  74.63  75.61  76.59
GDT RMS_LOCAL    0.37   0.62   0.89   1.08   1.16   1.24   1.36   1.53   1.65   1.72   2.12   2.54   2.55   2.65   3.29   3.11   3.53   3.69   4.02   4.15
GDT RMS_ALL_AT  12.93  12.98  12.97  12.84  12.85  12.72  12.59  12.55  12.55  12.55  12.71  12.35  12.73  12.68  11.75  12.48  12.06  11.78  11.48  11.46

# Checking swapping
#   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:  D    56_A      D    56_A
#   possible swapping detected:  D    59_A      D    59_A
#   possible swapping detected:  E    64_A      E    64_A
#   possible swapping detected:  E    76_A      E    76_A
#   possible swapping detected:  D    79_A      D    79_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:  E   123_A      E   123_A
#   possible swapping detected:  E   127_A      E   127_A
#   possible swapping detected:  D   133_A      D   133_A
#   possible swapping detected:  E   143_A      E   143_A
#   possible swapping detected:  E   147_A      E   147_A
#   possible swapping detected:  D   149_A      D   149_A
#   possible swapping detected:  E   163_A      E   163_A
#   possible swapping detected:  D   179_A      D   179_A
#   possible swapping detected:  E   188_A      E   188_A
#   possible swapping detected:  Y   190_A      Y   190_A
#   possible swapping detected:  E   193_A      E   193_A
#   possible swapping detected:  D   196_A      D   196_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    S     1_A      S     1_A    15.050     0    0.237   0.325    16.583    0.000    0.000
LGA    M     2_A      M     2_A    10.074     0    0.031   1.063    11.728    5.119    2.619
LGA    N     3_A      N     3_A     5.850     0    0.203   0.589    12.093   29.643   15.714
LGA    I     4_A      I     4_A     1.727     0    0.618   0.753     6.589   72.857   52.798
LGA    E     5_A      E     5_A     1.289     0    0.033   0.778     3.081   81.429   71.534
LGA    V     6_A      V     6_A     1.024     0    0.025   0.100     1.137   85.952   84.014
LGA    A     7_A      A     7_A     1.211     0    0.027   0.027     1.480   83.690   83.238
LGA    R     8_A      R     8_A     1.287     0    0.056   1.263     4.561   81.429   64.892
LGA    A     9_A      A     9_A     0.912     0    0.145   0.155     1.024   88.214   88.667
LGA    A    10_A      A    10_A     0.936     0    0.055   0.053     1.232   90.476   88.667
LGA    R    11_A      R    11_A     0.871     0    0.091   1.629     7.260   88.214   62.511
LGA    L    12_A      L    12_A     0.559     0    0.072   0.256     0.948   95.238   92.857
LGA    A    13_A      A    13_A     0.391     0    0.088   0.114     0.644   95.238   96.190
LGA    Q    14_A      Q    14_A     1.300     0    0.098   1.371     6.983   81.429   59.630
LGA    I    15_A      I    15_A     1.324     0    0.050   0.095     2.241   83.690   77.262
LGA    F    16_A      F    16_A     0.695     0    0.033   0.238     1.083   88.214   90.519
LGA    K    17_A      K    17_A     0.619     0    0.053   0.810     2.412   90.476   87.619
LGA    E    18_A      E    18_A     0.705     0    0.056   1.345     4.759   90.476   71.323
LGA    I    19_A      I    19_A     0.885     0    0.023   0.121     0.970   90.476   90.476
LGA    C    20_A      C    20_A     0.632     0    0.053   0.777     3.073   92.857   85.317
LGA    D    21_A      D    21_A     0.507     0    0.052   0.866     3.637   95.238   79.583
LGA    G    22_A      G    22_A     0.617     0    0.059   0.059     0.617   95.238   95.238
LGA    I    23_A      I    23_A     0.434     0    0.022   1.470     4.256   97.619   80.000
LGA    I    24_A      I    24_A     0.483     0    0.094   0.162     1.135   95.238   91.726
LGA    S    25_A      S    25_A     0.999     0    0.217   0.666     4.254   88.214   77.143
LGA    Y    26_A      Y    26_A     0.702     0    0.027   0.093     1.061   92.857   90.516
LGA    R    27_A      R    27_A     0.942     0    0.030   1.073     3.449   85.952   76.364
LGA    D    28_A      D    28_A     1.401     0    0.019   0.791     4.060   77.143   69.583
LGA    S    29_A      S    29_A     2.333     0    0.029   0.730     4.888   64.762   57.937
LGA    S    30_A      S    30_A     1.680     0    0.127   0.213     2.162   72.857   72.937
LGA    Q    31_A      Q    31_A     1.452     0    0.191   1.095     3.736   81.429   73.704
LGA    Q    32_A      Q    32_A     1.026     0    0.034   1.245     5.780   81.429   62.751
LGA    T    33_A      T    33_A     1.025     0    0.014   0.280     1.830   88.214   85.374
LGA    L    34_A      L    34_A     0.555     0    0.017   0.252     0.977   90.476   94.048
LGA    A    35_A      A    35_A     1.096     0    0.066   0.061     1.232   83.690   83.238
LGA    A    36_A      A    36_A     1.268     0    0.027   0.025     1.454   81.429   81.429
LGA    P    37_A      P    37_A     1.515     0    0.033   0.089     1.816   75.000   77.755
LGA    L    38_A      L    38_A     1.386     0    0.121   1.231     2.743   81.429   76.488
LGA    L    39_A      L    39_A     1.610     0    0.138   1.409     2.697   79.405   75.357
LGA    N    40_A      N    40_A     1.260     0    0.076   1.345     5.879   85.952   62.321
LGA    L    41_A      L    41_A     0.733     0    0.027   0.287     1.548   88.214   86.012
LGA    P    42_A      P    42_A     0.719     0    0.095   0.185     1.196   88.214   90.544
LGA    P    43_A      P    43_A     1.445     0    0.077   0.298     2.868   83.690   75.646
LGA    K    44_A      K    44_A     0.779     0    0.073   1.225     4.061   90.595   76.931
LGA    K    45_A      K    45_A     0.481     0    0.068   0.686     3.700   90.595   73.333
LGA    K    46_A      K    46_A     1.974     0    0.123   0.832     5.011   70.952   59.312
LGA    N    47_A      N    47_A     2.118     0    0.086   0.129     2.973   66.786   64.821
LGA    A    48_A      A    48_A     2.090     0    0.102   0.106     2.206   64.762   64.762
LGA    D    49_A      D    49_A     2.624     0    0.101   0.693     5.637   60.952   48.869
LGA    Y    50_A      Y    50_A     1.612     0    0.020   0.460     4.504   79.405   62.659
LGA    Y    51_A      Y    51_A     0.754     0    0.019   0.458     2.165   85.952   80.913
LGA    E    52_A      E    52_A     1.988     0    0.132   1.186     7.083   67.262   49.048
LGA    K    53_A      K    53_A     2.981     0    0.115   1.144     5.604   57.262   48.201
LGA    I    54_A      I    54_A     0.836     0    0.164   0.460     2.197   85.952   82.798
LGA    S    55_A      S    55_A     2.303     0    0.177   0.439     3.412   68.810   62.540
LGA    D    56_A      D    56_A     1.480     0    0.051   0.611     2.754   81.548   75.238
LGA    P    57_A      P    57_A     1.732     0    0.239   0.278     2.437   75.000   70.612
LGA    L    58_A      L    58_A     0.619     0    0.135   1.037     2.904   88.214   80.714
LGA    D    59_A      D    59_A     0.556     0    0.221   0.804     2.141   95.238   87.381
LGA    L    60_A      L    60_A     0.479     0    0.061   0.151     1.670   95.238   88.393
LGA    S    61_A      S    61_A     1.844     0    0.076   0.589     2.531   75.000   69.048
LGA    T    62_A      T    62_A     1.797     0    0.025   0.110     2.617   77.143   70.748
LGA    I    63_A      I    63_A     0.455     0    0.025   0.089     1.015   97.619   94.107
LGA    E    64_A      E    64_A     0.986     0    0.077   0.591     1.936   85.952   84.497
LGA    K    65_A      K    65_A     1.464     0    0.068   0.781     3.094   83.690   73.386
LGA    Q    66_A      Q    66_A     0.890     0    0.110   0.763     2.876   88.214   82.751
LGA    I    67_A      I    67_A     0.409     0    0.028   1.110     2.355   97.619   87.679
LGA    L    68_A      L    68_A     0.812     0    0.042   0.160     2.286   92.857   82.917
LGA    I    69_A      I    69_A     0.505     0    0.039   1.127     3.412   95.238   79.464
LGA    G    70_A      G    70_A     0.555     0    0.063   0.063     0.814   92.857   92.857
LGA    Y    71_A      Y    71_A     0.684     0    0.063   0.141     1.831   90.476   83.056
LGA    Y    72_A      Y    72_A     1.283     0    0.587   0.431     3.310   73.571   80.317
LGA    K    73_A      K    73_A     1.596     0    0.201   0.893     4.735   70.833   60.688
LGA    T    74_A      T    74_A     1.296     0    0.073   0.189     2.241   85.952   79.184
LGA    V    75_A      V    75_A     0.645     0    0.039   1.186     2.663   90.476   80.952
LGA    E    76_A      E    76_A     1.449     0    0.102   1.042     5.373   85.952   65.026
LGA    A    77_A      A    77_A     0.756     0    0.031   0.030     1.037   95.238   92.476
LGA    F    78_A      F    78_A     0.310     0    0.034   0.166     1.371  100.000   92.338
LGA    D    79_A      D    79_A     0.361     0    0.044   0.636     1.943  100.000   90.893
LGA    A    80_A      A    80_A     0.304     0    0.044   0.048     0.587   97.619   96.190
LGA    D    81_A      D    81_A     0.624     0    0.019   0.576     1.788   92.857   86.131
LGA    M    82_A      M    82_A     0.713     0    0.029   0.590     2.265   90.476   85.000
LGA    L    83_A      L    83_A     0.652     0    0.055   1.030     2.746   90.476   84.107
LGA    K    84_A      K    84_A     0.632     0    0.055   1.075     2.344   90.476   81.905
LGA    V    85_A      V    85_A     0.838     0    0.032   1.062     2.898   90.476   83.197
LGA    F    86_A      F    86_A     0.823     0    0.024   0.144     0.892   90.476   93.074
LGA    R    87_A      R    87_A     0.854     0    0.051   1.119     5.384   88.214   68.874
LGA    N    88_A      N    88_A     1.186     0    0.082   1.204     3.789   88.214   78.988
LGA    A    89_A      A    89_A     0.959     0    0.083   0.093     1.194   90.476   88.667
LGA    E    90_A      E    90_A     0.969     0    0.037   0.397     1.299   88.214   86.455
LGA    K    91_A      K    91_A     0.982     0    0.110   1.213     7.550   85.952   63.175
LGA    Y    92_A      Y    92_A     1.607     0    0.091   0.276     6.585   81.548   50.595
LGA    Y    93_A      Y    93_A     0.922     0    0.150   0.283     2.203   83.810   80.913
LGA    G    94_A      G    94_A     1.636     0    0.293   0.293     5.552   56.429   56.429
LGA    R    95_A      R    95_A     4.269     0    0.615   1.352    10.545   34.405   19.610
LGA    K    96_A      K    96_A     7.235     0    0.307   1.390     8.975   12.262    8.254
LGA    S    97_A      S    97_A     6.322     0    0.272   0.328     7.437   25.476   20.317
LGA    P    98_A      P    98_A     5.577     0    0.190   0.298     8.439   32.381   21.633
LGA    I    99_A      I    99_A     2.278     0    0.176   1.264     4.163   61.071   57.024
LGA    G   100_A      G   100_A     2.440     0    0.088   0.088     2.440   66.786   66.786
LGA    R   101_A      R   101_A     2.202     0    0.075   0.767     6.113   68.810   48.268
LGA    D   102_A      D   102_A     1.177     0    0.038   1.020     2.769   79.286   76.250
LGA    V   103_A      V   103_A     1.409     0    0.111   1.283     3.436   81.429   73.333
LGA    C   104_A      C   104_A     1.525     0    0.065   0.575     1.627   79.286   78.571
LGA    R   105_A      R   105_A     1.179     0    0.026   0.746     4.256   81.429   73.810
LGA    L   106_A      L   106_A     1.154     0    0.051   0.276     1.197   81.429   84.821
LGA    R   107_A      R   107_A     1.035     0    0.030   1.392     5.817   85.952   68.874
LGA    K   108_A      K   108_A     0.954     0    0.013   1.219     6.935   88.214   70.635
LGA    A   109_A      A   109_A     1.137     0    0.110   0.110     1.384   83.690   83.238
LGA    Y   110_A      Y   110_A     0.764     0    0.022   0.300     1.139   90.476   89.722
LGA    Y   111_A      Y   111_A     0.820     0    0.012   0.394     2.639   90.476   78.968
LGA    S   112_A      S   112_A     0.762     0    0.052   0.109     0.826   90.476   90.476
LGA    A   113_A      A   113_A     0.673     0    0.025   0.029     0.717   90.476   90.476
LGA    R   114_A      R   114_A     0.309     0    0.062   0.917     2.284   95.238   87.532
LGA    H   115_A      H   115_A     0.755     0    0.025   1.131     3.597   90.476   82.476
LGA    E   116_A      E   116_A     1.000     0    0.078   1.170     3.128   88.214   77.302
LGA    A   117_A      A   117_A     0.784     0    0.032   0.040     0.810   90.476   90.476
LGA    S   118_A      S   118_A     0.664     0    0.047   0.650     1.684   85.952   84.524
LGA    A   119_A      A   119_A     1.889     0    0.066   0.064     2.583   77.143   73.143
LGA    Q   120_A      Q   120_A     1.326     0    0.018   1.028     5.678   85.952   60.635
LGA    I   121_A      I   121_A     0.525     0    0.045   0.115     0.947   90.476   90.476
LGA    D   122_A      D   122_A     1.367     0    0.031   0.826     2.233   83.690   78.393
LGA    E   123_A      E   123_A     1.062     0    0.049   0.854     2.502   85.952   76.984
LGA    I   124_A      I   124_A     0.337     0    0.038   0.186     0.803  100.000   96.429
LGA    V   125_A      V   125_A     0.353     0    0.090   0.164     1.144   92.976   91.905
LGA    G   126_A      G   126_A     2.316     0    0.656   0.656     6.734   44.286   44.286
LGA    E   127_A      E   127_A     9.177     0    0.110   0.656    15.661    4.762    2.116
LGA    T   128_A      T   128_A     7.696     0    0.452   1.376     8.014    8.571   11.088
LGA    A   129_A      A   129_A     7.153     0    0.338   0.315     8.218   11.667   10.286
LGA    S   130_A      S   130_A     5.351     0    0.287   0.416     7.207   21.548   19.603
LGA    E   131_A      E   131_A     6.184     0    0.560   1.087     9.574   21.548   13.280
LGA    A   132_A      A   132_A     6.331     0    0.376   0.355     6.939   15.238   14.857
LGA    D   133_A      D   133_A     7.678     0    0.365   0.813    11.264    9.286    5.000
LGA    S   134_A      S   134_A     6.739     0    0.221   0.584     7.364   13.333   13.413
LGA    S   135_A      S   135_A     8.205     0    0.634   0.953    10.974   12.381    8.254
LGA    E   136_A      E   136_A     6.654     0    0.263   1.020     8.985   14.762   11.111
LGA    T   137_A      T   137_A     7.415     0    0.610   1.180    11.460   12.619    7.415
LGA    S   138_A      S   138_A     8.452     0    0.244   0.799     9.679    7.262    5.159
LGA    V   139_A      V   139_A     5.670     0    0.096   0.888     8.167   34.762   25.510
LGA    S   140_A      S   140_A     4.957     0    0.520   0.762     8.563   30.119   22.222
LGA    E   141_A      E   141_A     6.966     0    0.631   1.306    12.249   10.476    5.238
LGA    K   142_A      K   142_A     5.221     0    0.224   1.140     9.157   23.810   21.429
LGA    E   143_A      E   143_A     7.153     0    0.540   1.185    11.277    8.810    4.392
LGA    S   144_A      S   144_A     9.063     0    0.480   0.831     9.063    6.548    5.635
LGA    G   145_A      G   145_A    10.864     0    0.228   0.228    14.114    0.000    0.000
LGA    H   146_A      H   146_A    15.854     0    0.431   1.270    20.572    0.000    0.000
LGA    E   147_A      E   147_A    16.303     0    0.260   1.213    19.535    0.000    0.000
LGA    K   148_A      K   148_A    15.242     0    0.440   0.878    16.833    0.000    0.000
LGA    D   149_A      D   149_A    15.953     0    0.270   1.251    18.792    0.000    0.000
LGA    D   150_A      D   150_A    18.344     0    0.616   1.098    20.213    0.000    0.000
LGA    D   151_A      D   151_A    16.345     0    0.438   1.084    19.733    0.000    0.000
LGA    V   152_A      V   152_A     9.772     0    0.102   1.230    11.964    2.500    2.653
LGA    I   153_A      I   153_A     5.672     0    0.083   0.316     9.394   39.405   26.726
LGA    R   154_A      R   154_A     3.587     0    0.092   1.281     7.643   26.190   44.805
LGA    C   155_A      C   155_A     9.877     0    0.014   0.111    14.021    2.619    1.746
LGA    I   156_A      I   156_A    15.252     0    0.017   0.265    20.860    0.000    0.000
LGA    C   157_A      C   157_A    14.427     0    0.191   0.295    15.594    0.000    0.000
LGA    G   158_A      G   158_A    10.815     0    0.125   0.125    11.427    0.476    0.476
LGA    L   159_A      L   159_A     6.716     0    0.628   1.119    10.164   18.929   11.667
LGA    Y   160_A      Y   160_A     0.474     0    0.110   1.519     9.285   70.000   39.960
LGA    K   161_A      K   161_A     4.266     0    0.104   1.146     7.698   28.690   41.429
LGA    D   162_A      D   162_A    11.052     0    0.209   0.653    16.229    0.714    0.357
LGA    E   163_A      E   163_A    14.295     0    0.167   0.912    17.668    0.000    0.000
LGA    G   164_A      G   164_A    21.727     0    0.667   0.667    23.363    0.000    0.000
LGA    L   165_A      L   165_A    24.045     0    0.144   1.103    29.174    0.000    0.000
LGA    M   166_A      M   166_A    20.705     0    0.035   0.705    23.117    0.000    0.000
LGA    I   167_A      I   167_A    21.833     0    0.106   1.123    25.592    0.000    0.000
LGA    Q   168_A      Q   168_A    18.831     0    0.027   1.108    20.513    0.000    0.000
LGA    C   169_A      C   169_A    16.027     0    0.022   0.047    16.754    0.000    0.000
LGA    D   170_A      D   170_A    19.405     0    0.037   1.070    21.440    0.000    0.000
LGA    K   171_A      K   171_A    13.516     0    0.109   0.945    15.340    0.000    0.000
LGA    C   172_A      C   172_A     9.403     0    0.753   1.099    10.766    0.714    4.524
LGA    M   173_A      M   173_A    14.165     0    0.057   0.729    17.217    0.000    0.000
LGA    V   174_A      V   174_A     9.492     0    0.039   1.170    12.565    0.357    7.619
LGA    W   175_A      W   175_A    12.244     0    0.074   0.249    22.008    0.357    0.102
LGA    Q   176_A      Q   176_A    13.705     0    0.136   0.253    17.669    0.000    0.000
LGA    H   177_A      H   177_A    17.618     0    0.061   0.080    20.334    0.000    0.000
LGA    C   178_A      C   178_A    24.345     0    0.023   0.229    29.252    0.000    0.000
LGA    D   179_A      D   179_A    26.674     0    0.020   0.822    28.616    0.000    0.000
LGA    C   180_A      C   180_A    23.145     0    0.075   0.816    25.037    0.000    0.000
LGA    M   181_A      M   181_A    24.482     0    0.081   0.173    28.178    0.000    0.000
LGA    G   182_A      G   182_A    30.771     0    0.112   0.112    33.509    0.000    0.000
LGA    V   183_A      V   183_A    31.007     0    0.179   0.332    32.389    0.000    0.000
LGA    N   184_A      N   184_A    35.417     0    0.598   1.276    38.836    0.000    0.000
LGA    T   185_A      T   185_A    33.841     0    0.291   0.294    36.624    0.000    0.000
LGA    D   186_A      D   186_A    36.614     0    0.408   0.966    40.161    0.000    0.000
LGA    V   187_A      V   187_A    33.984     0    0.076   1.046    34.516    0.000    0.000
LGA    E   188_A      E   188_A    34.103     0    0.084   1.163    41.120    0.000    0.000
LGA    H   189_A      H   189_A    28.403     0    0.369   0.849    30.704    0.000    0.000
LGA    Y   190_A      Y   190_A    24.498     0    0.042   1.388    25.758    0.000    0.000
LGA    L   191_A      L   191_A    18.968     0    0.042   0.141    21.344    0.000    0.000
LGA    C   192_A      C   192_A    15.239     0    0.023   0.064    16.146    0.000    0.000
LGA    E   193_A      E   193_A    17.331     0    0.271   1.189    18.238    0.000    0.000
LGA    Q   194_A      Q   194_A    12.261     0    0.144   0.781    13.650    0.000    5.450
LGA    C   195_A      C   195_A    11.524     0    0.141   0.162    14.246    0.000    0.476
LGA    D   196_A      D   196_A    17.849     0    0.038   0.292    23.011    0.000    0.000
LGA    P   197_A      P   197_A    20.471     0    0.083   0.396    24.479    0.000    0.000
LGA    R   198_A      R   198_A    25.314     0    0.190   1.188    27.431    0.000    0.000
LGA    P   199_A      P   199_A    30.161     0    0.053   0.227    32.438    0.000    0.000
LGA    V   200_A      V   200_A    31.854     0    0.282   1.070    32.920    0.000    0.000
LGA    D   201_A      D   201_A    35.958     0    0.165   0.937    38.194    0.000    0.000
LGA    R   202_A      R   202_A    33.144     0    0.562   1.627    34.612    0.000    0.000
LGA    E   203_A      E   203_A    37.723     0    0.474   0.983    39.204    0.000    0.000
LGA    V   204_A      V   204_A    41.345     0    0.595   1.444    42.846    0.000    0.000
LGA    P   205_A      P   205_A    42.786     0    0.243   0.468    42.786    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):    10.263         10.270                 10.662           52.053   47.384

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  205  205    4.0    125    1.53    55.976    55.150     7.675

LGA_LOCAL      RMSD:   1.529  Number of atoms:  125  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  12.553  Number of assigned atoms:  205 
Std_ASGN_ATOMS RMSD:  10.263  Standard rmsd on all 205 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.153709 * X  +   0.987972 * Y  +   0.016881 * Z  +   1.986989
  Y_new =  -0.128701 * X  +   0.003079 * Y  +   0.991679 * Z  +  -2.982588
  Z_new =   0.979699 * X  +  -0.154603 * Y  +   0.127626 * Z  +  35.663483 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -0.697076 -1.368953 -0.880692   [DEG:  -39.9395  -78.4352  -50.4599 ]
ZXZ:  3.124572  1.442821  1.727312   [DEG:  179.0248   82.6675   98.9677 ]
 
# END of job
