
#######################################################
#                                                     #
#                        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  249 ( 1930),  selected  230 , name one
# Molecule2: number of CA atoms  230 ( 1795),  selected  230 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:B  -ch2:B  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   230      15_B - 244_B       1.87     1.87
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   230      15_B - 244_B       1.87     1.87
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    87      29_B - 115_B       1.00     2.29
  LONGEST_CONTINUOUS_SEGMENT:    87      30_B - 116_B       0.98     2.31
  LCS_AVERAGE:     26.01

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  230
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     A    15_B     A    15_B     50  230  230     14   37  113  167  190  206  219  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     F    16_B     F    16_B     50  230  230     21   83  152  183  203  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     Y    17_B     Y    17_B     50  230  230     23  108  165  184  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     E    18_B     E    18_B     50  230  230     21   79  143  183  197  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L    19_B     L    19_B     50  230  230     13   79  144  183  198  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     E    20_B     E    20_B     62  230  230      6   62  126  180  194  214  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     F    21_B     F    21_B     63  230  230     15   85  147  183  202  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     G    22_B     G    22_B     63  230  230      4   81  153  183  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     P    23_B     P    23_B     63  230  230     13   66  145  183  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     R    24_B     R    24_B     63  230  230     10   92  163  183  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     T    25_B     T    25_B     63  230  230     14   57  137  183  203  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     I    26_B     I    26_B     63  230  230     14   34   94  178  203  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     M    27_B     M    27_B     63  230  230     13   30   94  178  198  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     T    28_B     T    28_B     84  230  230     21   84  152  183  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L    29_B     L    29_B     87  230  230     21   95  165  185  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     A    30_B     A    30_B     87  230  230     21  110  165  185  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     N    31_B     N    31_B     87  230  230     19  117  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     F    32_B     F    32_B     87  230  230     27  125  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     P    33_B     P    33_B     87  230  230     50  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     D    34_B     D    34_B     87  230  230     44  124  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     D    35_B     D    35_B     87  230  230     44  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     V    36_B     V    36_B     87  230  230     44  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L    37_B     L    37_B     87  230  230     44  129  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     P    38_B     P    38_B     87  230  230     44  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L    39_B     L    39_B     87  230  230     51  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L    40_B     L    40_B     87  230  230     49  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     Q    41_B     Q    41_B     87  230  230     51  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     M    42_B     M    42_B     87  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     E    43_B     E    43_B     87  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     S    44_B     S    44_B     87  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L    45_B     L    45_B     87  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     M    46_B     M    46_B     87  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     T    47_B     T    47_B     87  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     F    48_B     F    48_B     87  230  230     66  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     E    49_B     E    49_B     87  230  230     62  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     A    50_B     A    50_B     87  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     M    51_B     M    51_B     87  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     A    52_B     A    52_B     87  230  230     65  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     Y    53_B     Y    53_B     87  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L    54_B     L    54_B     87  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     R    55_B     R    55_B     87  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     C    56_B     C    56_B     87  230  230     57  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     D    57_B     D    57_B     87  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     A    58_B     A    58_B     87  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L    59_B     L    59_B     87  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     V    60_B     V    60_B     87  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     E    61_B     E    61_B     87  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L    62_B     L    62_B     87  230  230     67  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     G    63_B     G    63_B     87  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     C    64_B     C    64_B     87  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     Y    65_B     Y    65_B     87  230  230     48  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     D    66_B     D    66_B     87  230  230     10   87  160  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     G    67_B     G    67_B     87  230  230     51  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     R    68_B     R    68_B     87  230  230     19  115  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     A    69_B     A    69_B     87  230  230     66  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L    70_B     L    70_B     87  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     E    71_B     E    71_B     87  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     I    72_B     I    72_B     87  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     A    73_B     A    73_B     87  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     R    74_B     R    74_B     87  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L    75_B     L    75_B     87  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L    76_B     L    76_B     87  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     N    77_B     N    77_B     87  230  230     66  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     A    78_B     A    78_B     87  230  230     66  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     R    79_B     R    79_B     87  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     Y    80_B     Y    80_B     87  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L    81_B     L    81_B     87  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     G    82_B     G    82_B     87  230  230     67  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     V    83_B     V    83_B     87  230  230     67  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     D    84_B     D    84_B     87  230  230     41  124  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L    85_B     L    85_B     87  230  230     29  101  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     D    86_B     D    86_B     87  230  230     28  111  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     Q    87_B     Q    87_B     87  230  230     28  111  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     R    88_B     R    88_B     87  230  230     28   90  159  188  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     A    89_B     A    89_B     87  230  230     27  111  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     I    90_B     I    90_B     87  230  230     27  120  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     E    91_B     E    91_B     87  230  230     27  120  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     T    92_B     T    92_B     87  230  230     27   90  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L    93_B     L    93_B     87  230  230     30  122  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     R    94_B     R    94_B     87  230  230     39  124  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     T    95_B     T    95_B     87  230  230     31  120  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     R    96_B     R    96_B     87  230  230     30  120  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     I    97_B     I    97_B     87  230  230     33  122  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     E    98_B     E    98_B     87  230  230     38  122  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     R    99_B     R    99_B     87  230  230     30  114  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     E   100_B     E   100_B     87  230  230     31  121  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     G   101_B     G   101_B     87  230  230     33  122  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     M   102_B     M   102_B     87  230  230     28  112  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     S   103_B     S   103_B     87  230  230     28  118  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     D   104_B     D   104_B     87  230  230     22  122  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     R   105_B     R   105_B     87  230  230     28  124  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     A   106_B     A   106_B     87  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     D   107_B     D   107_B     87  230  230     67  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     T   108_B     T   108_B     87  230  230     63  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     V   109_B     V   109_B     87  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     V   110_B     V   110_B     87  230  230     30  113  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     D   111_B     D   111_B     87  230  230     26  110  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     D   112_B     D   112_B     87  230  230     29  110  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     I   113_B     I   113_B     87  230  230     12   66  146  186  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L   114_B     L   114_B     87  230  230     12  101  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     N   115_B     N   115_B     87  230  230     12   65  146  186  202  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     H   116_B     H   116_B     87  230  230      5   92  150  188  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     T   117_B     T   117_B     49  230  230      3    4   10   14   26   53   72  144  201  226  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     R   118_B     R   118_B      4  230  230      3    4    7   22   32   91  163  188  220  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     R   119_B     R   119_B      4  230  230     14   26  102  143  174  193  213  222  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     G   120_B     G   120_B      4  230  230      3    4   39   78  122  199  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     A   121_B     A   121_B     30  230  230      1   19  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     S   122_B     S   122_B     30  230  230     16   62  154  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     V   123_B     V   123_B     30  230  230     67  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     G   124_B     G   124_B     30  230  230     43  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     S   125_B     S   125_B     30  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     R   126_B     R   126_B     30  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     A   127_B     A   127_B     30  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L   128_B     L   128_B     30  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     Y   129_B     Y   129_B     30  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L   130_B     L   130_B     30  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L   131_B     L   131_B     30  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     P   132_B     P   132_B     30  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     F   133_B     F   133_B     30  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     N   134_B     N   134_B     30  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L   135_B     L   135_B     30  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L   136_B     L   136_B     30  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     G   137_B     G   137_B     30  230  230     64  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     N   138_B     N   138_B     30  230  230     61  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     F   139_B     F   139_B     30  230  230     52  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     R   140_B     R   140_B     30  230  230     39  124  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     E   141_B     E   141_B     30  230  230     47  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     P   142_B     P   142_B     30  230  230     51  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     K   143_B     K   143_B     30  230  230     51  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     R   144_B     R   144_B     30  230  230     55  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L   145_B     L   145_B     30  230  230     51  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L   146_B     L   146_B     30  230  230     51  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     D   147_B     D   147_B     30  230  230     51  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     S   148_B     S   148_B     30  230  230     51  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L   149_B     L   149_B     30  230  230     51  130  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     A   150_B     A   150_B     30  230  230      5   34  111  181  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     E   151_B     E   151_B     30  230  230      5    9   54  139  192  214  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     R   152_B     R   152_B     30  230  230      5   13   54  133  195  214  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     S   153_B     S   153_B     28  230  230      3    4   13   66  113  208  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     V   154_B     V   154_B     28  230  230     14   56  162  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     A   155_B     A   155_B     28  230  230     67  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     A   156_B     A   156_B     28  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     V   157_B     V   157_B     28  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     V   158_B     V   158_B     28  230  230     67  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     S   159_B     S   159_B     28  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     V   160_B     V   160_B     28  230  230     67  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     F   161_B     F   161_B     28  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     G   162_B     G   162_B     28  230  230     65  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     D   163_B     D   163_B     28  230  230     67  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     S   164_B     S   164_B     28  230  230     67  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     A   165_B     A   165_B     28  230  230     61  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     E   166_B     E   166_B     28  230  230     23  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     A   167_B     A   167_B     28  230  230     24  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     T   168_B     T   168_B     28  230  230     27  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     R   169_B     R   169_B     28  230  230     34  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     V   170_B     V   170_B     28  230  230     67  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     R   171_B     R   171_B     34  230  230     23  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     Q   172_B     Q   172_B     34  230  230     19  113  164  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     S   173_B     S   173_B     34  230  230     23  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     Y   174_B     Y   174_B     34  230  230     31  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     Y   175_B     Y   175_B     34  230  230     28  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     R   176_B     R   176_B     34  230  230     29  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     R   177_B     R   177_B     34  230  230     25  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     C   178_B     C   178_B     34  230  230     32  129  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     G   179_B     G   179_B     34  230  230     23  117  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     V   180_B     V   180_B     44  230  230     19  117  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     Q   181_B     Q   181_B     44  230  230      3   27   42  114  195  214  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     G   182_B     G   182_B     56  230  230      6   98  148  185  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L   183_B     L   183_B     56  230  230     57  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     E   184_B     E   184_B     56  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L   185_B     L   185_B     56  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     H   186_B     H   186_B     56  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     T   187_B     T   187_B     56  230  230     33  125  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     R   188_B     R   188_B     56  230  230     35  115  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     D   189_B     D   189_B     56  230  230     15   84  146  182  202  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     D   190_B     D   190_B     56  230  230     33  115  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     G   191_B     G   191_B     56  230  230     55  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     T   192_B     T   192_B     56  230  230     63  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     V   193_B     V   193_B     56  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     F   194_B     F   194_B     56  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     T   195_B     T   195_B     56  230  230     58  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     G   196_B     G   196_B     56  230  230     39  117  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     S   197_B     S   197_B     56  230  230      5   88  148  183  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     D   198_B     D   198_B     56  230  230     28  101  165  185  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     G   199_B     G   199_B     56  230  230     15   98  165  185  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     F   200_B     F   200_B     56  230  230     44  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     Y   201_B     Y   201_B     56  230  230     41  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     S   202_B     S   202_B     56  230  230     66  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     R   203_B     R   203_B     56  230  230     61  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     S   204_B     S   204_B     56  230  230     67  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     Y   205_B     Y   205_B     56  230  230     57  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     S   206_B     S   206_B     56  230  230     57  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     R   207_B     R   207_B     56  230  230     46  128  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     A   208_B     A   208_B     56  230  230     61  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     C   209_B     C   209_B     56  230  230     64  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L   210_B     L   210_B     56  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     H   211_B     H   211_B     56  230  230     67  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     A   212_B     A   212_B     56  230  230     66  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L   213_B     L   213_B     56  230  230     19  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L   214_B     L   214_B     56  230  230     64  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     A   215_B     A   215_B     56  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     E   216_B     E   216_B     56  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     C   217_B     C   217_B     56  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     G   218_B     G   218_B     56  230  230     57  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L   219_B     L   219_B     56  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     T   220_B     T   220_B     56  230  230     44  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     V   221_B     V   221_B     56  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     V   222_B     V   222_B     56  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     R   223_B     R   223_B     56  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     S   224_B     S   224_B     56  230  230     21  105  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     A   225_B     A   225_B     56  230  230     51  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     S   226_B     S   226_B     56  230  230     43  121  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     N   227_B     N   227_B     56  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L   228_B     L   228_B     56  230  230     67  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     F   229_B     F   229_B     56  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     A   230_B     A   230_B     56  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     H   231_B     H   231_B     56  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     C   232_B     C   232_B     56  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     V   233_B     V   233_B     56  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     T   234_B     T   234_B     56  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     V   235_B     V   235_B     56  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     L   236_B     L   236_B     56  230  230     68  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     P   237_B     P   237_B     56  230  230     67  132  165  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     E   238_B     E   238_B     56  230  230     19   76  161  189  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     G   239_B     G   239_B     50  230  230     20   93  161  188  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     A   240_B     A   240_B     43  230  230      5   50  134  180  204  215  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     D   241_B     D   241_B     42  230  230      5   16   47  109  169  205  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     Q   242_B     Q   242_B      9  230  230      3    8   13   99  169  205  220  225  226  227  228  228  229  229  230  230  230  230  230  230 
LCS_GDT     G   243_B     G   243_B      5  230  230      3    5    9   16   30   52  164  188  220  224  227  228  229  229  230  230  230  230  230  230 
LCS_GDT     F   244_B     F   244_B      4  230  230      0    5    7    9   10   23   25   85  106  132  146  222  225  227  230  230  230  230  230  230 
LCS_AVERAGE  LCS_A:  75.34  (  26.01  100.00  100.00 )

GLOBAL_DISTANCE_TEST (summary information about detected largest sets of residues (represented by selected AToms) that can fit under specified thresholds)
GDT DIST_CUTOFF  0.50   1.00   1.50   2.00   2.50   3.00   3.50   4.00   4.50   5.00   5.50   6.00   6.50   7.00   7.50   8.00   8.50   9.00   9.50  10.00
GDT NUMBER_AT     68    132    165    189    204    215    220    225    226    227    228    228    229    229    230    230    230    230    230    230 
GDT PERCENT_AT  29.57  57.39  71.74  82.17  88.70  93.48  95.65  97.83  98.26  98.70  99.13  99.13  99.57  99.57 100.00 100.00 100.00 100.00 100.00 100.00
GDT RMS_LOCAL    0.35   0.64   0.84   1.01   1.18   1.33   1.42   1.54   1.57   1.62   1.67   1.67   1.74   1.74   1.87   1.87   1.87   1.87   1.87   1.87
GDT RMS_ALL_AT   1.95   1.89   2.02   1.93   1.89   1.88   1.88   1.88   1.88   1.88   1.88   1.88   1.87   1.87   1.87   1.87   1.87   1.87   1.87   1.87

# Checking swapping
#   possible swapping detected:  Y    17_B      Y    17_B
#   possible swapping detected:  E    43_B      E    43_B
#   possible swapping detected:  F    48_B      F    48_B
#   possible swapping detected:  Y    53_B      Y    53_B
#   possible swapping detected:  E    71_B      E    71_B
#   possible swapping detected:  D    84_B      D    84_B
#   possible swapping detected:  E    98_B      E    98_B
#   possible swapping detected:  Y   129_B      Y   129_B
#   possible swapping detected:  F   139_B      F   139_B
#   possible swapping detected:  E   151_B      E   151_B
#   possible swapping detected:  Y   175_B      Y   175_B
#   possible swapping detected:  D   189_B      D   189_B
#   possible swapping detected:  D   190_B      D   190_B
#   possible swapping detected:  F   194_B      F   194_B
#   possible swapping detected:  D   198_B      D   198_B
#   possible swapping detected:  Y   201_B      Y   201_B
#   possible swapping detected:  Y   205_B      Y   205_B
#   possible swapping detected:  E   216_B      E   216_B

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    A    15_B      A    15_B     4.110     0    0.039   0.041     4.872   41.786   39.714
LGA    F    16_B      F    16_B     2.680     0    0.049   0.106     3.037   57.262   64.329
LGA    Y    17_B      Y    17_B     1.982     0    0.138   0.214     2.818   62.976   71.706
LGA    E    18_B      E    18_B     3.257     0    0.057   0.445     4.445   48.571   44.974
LGA    L    19_B      L    19_B     3.219     0    0.039   0.146     3.816   50.000   50.060
LGA    E    20_B      E    20_B     3.774     0    0.090   0.115     5.020   43.333   37.407
LGA    F    21_B      F    21_B     2.700     0    0.112   0.385     5.289   60.952   49.134
LGA    G    22_B      G    22_B     2.394     0    0.351   0.351     3.050   59.167   59.167
LGA    P    23_B      P    23_B     2.532     0    0.025   0.073     2.700   60.952   62.585
LGA    R    24_B      R    24_B     2.162     0    0.085   0.305     2.569   62.857   70.043
LGA    T    25_B      T    25_B     2.767     0    0.079   0.180     2.960   59.048   58.231
LGA    I    26_B      I    26_B     2.852     0    0.063   0.667     4.331   57.143   51.964
LGA    M    27_B      M    27_B     2.984     0    0.092   1.229     7.725   57.143   39.226
LGA    T    28_B      T    28_B     2.323     0    0.059   0.072     2.475   66.786   65.918
LGA    L    29_B      L    29_B     1.935     0    0.032   1.052     4.279   70.833   66.369
LGA    A    30_B      A    30_B     1.914     0    0.054   0.059     2.182   75.000   72.952
LGA    N    31_B      N    31_B     1.445     0    0.023   0.183     1.846   79.286   76.071
LGA    F    32_B      F    32_B     1.139     0    0.019   0.502     2.076   81.429   78.398
LGA    P    33_B      P    33_B     0.834     0    0.056   0.065     1.274   85.952   87.891
LGA    D    34_B      D    34_B     1.196     0    0.023   0.221     1.939   83.690   79.345
LGA    D    35_B      D    35_B     0.903     0    0.021   0.165     0.960   90.476   90.476
LGA    V    36_B      V    36_B     0.981     0    0.019   0.108     1.324   85.952   86.599
LGA    L    37_B      L    37_B     1.068     0    0.045   0.268     1.924   88.214   81.607
LGA    P    38_B      P    38_B     0.814     0    0.079   0.080     1.015   90.476   89.184
LGA    L    39_B      L    39_B     0.766     0    0.066   0.936     3.654   90.476   83.452
LGA    L    40_B      L    40_B     0.957     0    0.036   0.039     1.399   90.476   85.952
LGA    Q    41_B      Q    41_B     0.626     0    0.018   0.752     2.692   95.238   83.968
LGA    M    42_B      M    42_B     0.189     0    0.020   0.078     0.513  100.000   98.810
LGA    E    43_B      E    43_B     0.493     0    0.041   0.200     0.704   97.619   97.884
LGA    S    44_B      S    44_B     0.382     0    0.029   0.053     0.630  100.000   98.413
LGA    L    45_B      L    45_B     0.228     0    0.033   0.076     0.681   97.619   97.619
LGA    M    46_B      M    46_B     0.557     0    0.033   0.599     1.511   92.857   90.655
LGA    T    47_B      T    47_B     0.562     0    0.020   0.076     0.878   92.857   91.837
LGA    F    48_B      F    48_B     0.308     0    0.015   1.159     5.110  100.000   74.372
LGA    E    49_B      E    49_B     0.494     0    0.051   0.628     2.811   97.619   83.175
LGA    A    50_B      A    50_B     0.579     0    0.031   0.033     0.744   92.857   92.381
LGA    M    51_B      M    51_B     0.706     0    0.024   0.218     1.568   90.476   88.274
LGA    A    52_B      A    52_B     0.701     0    0.058   0.059     0.827   90.476   90.476
LGA    Y    53_B      Y    53_B     0.444     0    0.072   1.207     7.680  100.000   62.976
LGA    L    54_B      L    54_B     0.709     0    0.031   0.063     0.975   90.476   90.476
LGA    R    55_B      R    55_B     0.793     0    0.023   0.163     1.065   90.476   89.654
LGA    C    56_B      C    56_B     0.960     0    0.093   0.159     1.319   88.214   85.952
LGA    D    57_B      D    57_B     0.577     0    0.025   0.181     0.671   92.857   94.048
LGA    A    58_B      A    58_B     0.299     0    0.038   0.052     0.391  100.000  100.000
LGA    L    59_B      L    59_B     0.132     0    0.026   0.045     0.324  100.000  100.000
LGA    V    60_B      V    60_B     0.154     0    0.179   0.177     0.717   97.619   98.639
LGA    E    61_B      E    61_B     0.512     0    0.066   0.086     0.735   90.476   90.476
LGA    L    62_B      L    62_B     0.466     0    0.045   0.110     0.602   95.238   96.429
LGA    G    63_B      G    63_B     0.632     0    0.054   0.054     0.632   92.857   92.857
LGA    C    64_B      C    64_B     0.808     0    0.046   0.084     1.069   90.476   88.968
LGA    Y    65_B      Y    65_B     0.844     0    0.248   1.073    10.102   81.786   46.865
LGA    D    66_B      D    66_B     1.756     0    0.172   0.421     4.202   79.286   65.774
LGA    G    67_B      G    67_B     0.663     0    0.252   0.252     1.050   88.214   88.214
LGA    R    68_B      R    68_B     1.497     0    0.072   0.765     4.378   79.286   58.528
LGA    A    69_B      A    69_B     0.423     0    0.119   0.121     0.673   95.238   94.286
LGA    L    70_B      L    70_B     0.431     0    0.032   0.086     0.759   97.619   96.429
LGA    E    71_B      E    71_B     0.473     0    0.046   0.609     2.264   95.238   84.921
LGA    I    72_B      I    72_B     0.530     0    0.031   0.064     0.683   92.857   95.238
LGA    A    73_B      A    73_B     0.485     0    0.048   0.057     0.539   97.619   96.190
LGA    R    74_B      R    74_B     0.473     0    0.055   0.655     3.241   97.619   84.026
LGA    L    75_B      L    75_B     0.558     0    0.106   0.115     0.927   90.476   92.857
LGA    L    76_B      L    76_B     0.505     0    0.068   0.150     1.102   92.857   91.726
LGA    N    77_B      N    77_B     0.541     0    0.040   0.063     0.788   92.857   91.667
LGA    A    78_B      A    78_B     0.747     0    0.039   0.048     0.799   90.476   90.476
LGA    R    79_B      R    79_B     0.766     0    0.125   1.277     5.547   88.214   63.203
LGA    Y    80_B      Y    80_B     0.461     0    0.071   0.187     0.998   95.238   92.063
LGA    L    81_B      L    81_B     0.292     0    0.053   0.216     0.823  100.000   96.429
LGA    G    82_B      G    82_B     0.628     0    0.081   0.081     1.118   90.595   90.595
LGA    V    83_B      V    83_B     0.734     0    0.039   0.084     0.894   90.476   90.476
LGA    D    84_B      D    84_B     1.373     0    0.114   0.150     2.821   73.214   77.321
LGA    L    85_B      L    85_B     2.168     0    0.057   0.341     3.258   64.881   62.976
LGA    D    86_B      D    86_B     2.480     0    0.084   0.659     3.589   66.786   61.190
LGA    Q    87_B      Q    87_B     2.397     0    0.079   1.148     5.200   62.857   54.550
LGA    R    88_B      R    88_B     2.715     0    0.062   0.959     3.303   57.143   56.537
LGA    A    89_B      A    89_B     2.256     0    0.025   0.029     2.413   64.762   64.762
LGA    I    90_B      I    90_B     2.015     0    0.075   0.123     2.193   68.810   70.833
LGA    E    91_B      E    91_B     2.212     0    0.020   0.305     3.125   64.762   60.582
LGA    T    92_B      T    92_B     2.523     0    0.024   0.040     2.927   62.857   60.408
LGA    L    93_B      L    93_B     1.811     0    0.034   1.347     4.898   70.833   61.845
LGA    R    94_B      R    94_B     1.491     0    0.034   0.242     2.360   75.000   75.281
LGA    T    95_B      T    95_B     2.036     0    0.046   0.090     2.233   66.786   65.918
LGA    R    96_B      R    96_B     2.047     0    0.033   0.363     2.078   68.810   72.164
LGA    I    97_B      I    97_B     1.556     0    0.035   0.059     1.719   72.857   78.274
LGA    E    98_B      E    98_B     1.555     0    0.026   1.142     5.205   72.857   58.836
LGA    R    99_B      R    99_B     2.254     0    0.022   0.155     3.546   64.762   58.052
LGA    E   100_B      E   100_B     2.008     0    0.025   0.069     2.155   68.810   69.259
LGA    G   101_B      G   101_B     1.650     0    0.187   0.187     1.749   72.857   72.857
LGA    M   102_B      M   102_B     1.748     0    0.083   0.663     1.850   75.000   79.524
LGA    S   103_B      S   103_B     1.360     0    0.058   0.661     1.655   81.548   81.587
LGA    D   104_B      D   104_B     1.560     0    0.135   0.990     4.043   77.143   64.881
LGA    R   105_B      R   105_B     1.365     0    0.297   1.354     5.242   77.262   67.792
LGA    A   106_B      A   106_B     0.761     0    0.083   0.098     1.281   88.214   88.667
LGA    D   107_B      D   107_B     0.695     0    0.066   0.765     2.411   90.476   83.929
LGA    T   108_B      T   108_B     0.685     0    0.028   0.034     1.450   90.476   86.599
LGA    V   109_B      V   109_B     0.524     0    0.061   0.108     1.004   88.214   93.265
LGA    V   110_B      V   110_B     1.838     0    0.197   0.190     3.147   69.048   64.014
LGA    D   111_B      D   111_B     1.994     0    0.100   0.192     2.441   68.810   67.798
LGA    D   112_B      D   112_B     2.063     0    0.102   0.423     2.646   62.857   66.964
LGA    I   113_B      I   113_B     2.591     0    0.076   1.444     6.445   60.952   48.333
LGA    L   114_B      L   114_B     2.157     0    0.108   0.373     2.573   62.857   74.464
LGA    N   115_B      N   115_B     2.856     0    0.378   0.660     4.904   62.976   49.405
LGA    H   116_B      H   116_B     2.408     0    0.212   1.200     6.153   57.262   43.429
LGA    T   117_B      T   117_B     6.113     0    0.034   0.227     9.842   18.929   12.585
LGA    R   118_B      R   118_B     6.671     0    0.162   1.218     9.559   14.762    9.957
LGA    R   119_B      R   119_B     5.032     0    0.025   0.730     9.732   32.976   15.974
LGA    G   120_B      G   120_B     4.092     0    0.534   0.534     4.092   52.500   52.500
LGA    A   121_B      A   121_B     1.462     0    0.460   0.497     3.726   79.524   72.286
LGA    S   122_B      S   122_B     1.974     0    0.674   0.764     5.359   73.214   61.508
LGA    V   123_B      V   123_B     0.463     0    0.608   0.748     2.813   82.262   75.986
LGA    G   124_B      G   124_B     0.727     0    0.046   0.046     1.023   85.952   85.952
LGA    S   125_B      S   125_B     0.340     0    0.129   0.238     1.276   92.976   95.317
LGA    R   126_B      R   126_B     0.664     0    0.078   0.076     1.529   92.857   86.450
LGA    A   127_B      A   127_B     0.457     0    0.053   0.064     0.951   95.238   96.190
LGA    L   128_B      L   128_B     0.475     0    0.016   0.567     1.317  100.000   94.107
LGA    Y   129_B      Y   129_B     0.429     0    0.058   0.134     0.781   97.619   94.444
LGA    L   130_B      L   130_B     0.259     0    0.033   0.061     0.405  100.000  100.000
LGA    L   131_B      L   131_B     0.206     0    0.023   0.083     0.684  100.000   96.429
LGA    P   132_B      P   132_B     0.101     0    0.017   0.031     0.374  100.000  100.000
LGA    F   133_B      F   133_B     0.280     0    0.052   0.507     1.349  100.000   93.203
LGA    N   134_B      N   134_B     0.472     0    0.157   0.297     1.094   92.976   91.786
LGA    L   135_B      L   135_B     0.500     0    0.033   0.137     0.776   95.238   92.857
LGA    L   136_B      L   136_B     0.216     0    0.026   0.085     0.802   95.238   94.048
LGA    G   137_B      G   137_B     0.854     0    0.132   0.132     1.126   88.214   88.214
LGA    N   138_B      N   138_B     0.880     0    0.102   0.904     2.409   90.476   85.060
LGA    F   139_B      F   139_B     1.085     0    0.092   0.100     1.351   81.429   85.541
LGA    R   140_B      R   140_B     1.586     0    0.165   1.051     3.088   75.000   73.117
LGA    E   141_B      E   141_B     1.002     0    0.079   0.615     2.991   85.952   75.238
LGA    P   142_B      P   142_B     0.478     0    0.062   0.085     0.864   95.238   93.197
LGA    K   143_B      K   143_B     0.823     0    0.047   0.975     4.362   88.214   78.836
LGA    R   144_B      R   144_B     0.847     0    0.071   1.061     5.380   90.476   73.939
LGA    L   145_B      L   145_B     0.696     0    0.050   0.076     0.746   90.476   90.476
LGA    L   146_B      L   146_B     0.614     0    0.019   0.165     0.851   90.476   90.476
LGA    D   147_B      D   147_B     0.833     0    0.040   0.238     1.318   90.476   89.345
LGA    S   148_B      S   148_B     0.832     0    0.093   0.598     2.046   88.214   84.683
LGA    L   149_B      L   149_B     0.926     0    0.106   1.351     3.130   85.952   77.738
LGA    A   150_B      A   150_B     2.414     0    0.058   0.069     3.078   62.976   60.381
LGA    E   151_B      E   151_B     3.462     0    0.219   0.626     7.841   50.119   34.603
LGA    R   152_B      R   152_B     3.401     0    0.647   1.124     8.225   41.190   35.411
LGA    S   153_B      S   153_B     4.030     0    0.398   0.741     7.401   54.286   40.079
LGA    V   154_B      V   154_B     2.043     0    0.691   0.652     5.865   66.905   50.272
LGA    A   155_B      A   155_B     0.692     0    0.040   0.054     0.913   90.476   90.476
LGA    A   156_B      A   156_B     0.429     0    0.054   0.056     0.630   97.619   98.095
LGA    V   157_B      V   157_B     0.436     0    0.024   0.067     0.447  100.000  100.000
LGA    V   158_B      V   158_B     0.531     0    0.091   0.124     0.811   95.238   93.197
LGA    S   159_B      S   159_B     0.155     0    0.153   0.258     0.617   97.619   98.413
LGA    V   160_B      V   160_B     0.702     0    0.083   1.001     2.815   90.476   82.041
LGA    F   161_B      F   161_B     0.780     0    0.031   0.760     3.701   90.476   80.216
LGA    G   162_B      G   162_B     1.050     0    0.050   0.050     1.144   83.690   83.690
LGA    D   163_B      D   163_B     0.957     0    0.098   1.192     3.918   90.476   79.048
LGA    S   164_B      S   164_B     1.058     0    0.026   0.033     1.075   85.952   87.460
LGA    A   165_B      A   165_B     1.252     0    0.020   0.019     1.413   81.429   81.429
LGA    E   166_B      E   166_B     1.378     0    0.020   1.202     4.574   79.286   67.989
LGA    A   167_B      A   167_B     1.331     0    0.074   0.081     1.604   79.286   79.714
LGA    T   168_B      T   168_B     1.240     0    0.047   1.061     3.038   81.429   75.714
LGA    R   169_B      R   169_B     1.137     0    0.025   1.225     6.593   81.429   60.346
LGA    V   170_B      V   170_B     0.700     0    0.021   0.067     0.874   90.476   93.197
LGA    R   171_B      R   171_B     1.082     0    0.027   1.070     2.519   83.690   75.498
LGA    Q   172_B      Q   172_B     1.512     0    0.029   0.511     2.845   79.286   72.169
LGA    S   173_B      S   173_B     1.046     0    0.018   0.699     2.488   85.952   83.175
LGA    Y   174_B      Y   174_B     0.848     0    0.025   0.357     2.118   90.476   80.952
LGA    Y   175_B      Y   175_B     1.013     0    0.068   0.190     2.275   83.690   77.937
LGA    R   176_B      R   176_B     1.007     0    0.028   1.039     4.281   85.952   76.840
LGA    R   177_B      R   177_B     0.915     0    0.023   1.091     2.847   88.214   84.242
LGA    C   178_B      C   178_B     1.061     0    0.243   0.240     1.553   83.690   81.508
LGA    G   179_B      G   179_B     1.421     0    0.266   0.266     1.421   83.690   83.690
LGA    V   180_B      V   180_B     1.428     0    0.178   0.209     2.713   71.190   74.354
LGA    Q   181_B      Q   181_B     3.782     0    0.124   0.534     8.717   53.690   31.587
LGA    G   182_B      G   182_B     2.192     0    0.157   0.157     2.914   71.190   71.190
LGA    L   183_B      L   183_B     0.946     0    0.045   1.364     3.215   85.952   78.750
LGA    E   184_B      E   184_B     0.752     0    0.042   0.834     2.757   90.476   77.354
LGA    L   185_B      L   185_B     0.943     0    0.031   0.899     3.617   90.476   78.214
LGA    H   186_B      H   186_B     0.759     0    0.056   1.447     6.960   88.214   58.714
LGA    T   187_B      T   187_B     1.608     0    0.033   0.134     2.430   77.143   72.993
LGA    R   188_B      R   188_B     2.096     0    0.052   1.282     6.229   62.976   56.537
LGA    D   189_B      D   189_B     2.985     0    0.045   0.297     4.342   57.143   49.524
LGA    D   190_B      D   190_B     1.822     0    0.258   0.318     2.253   68.810   69.821
LGA    G   191_B      G   191_B     1.342     0    0.037   0.037     1.489   81.429   81.429
LGA    T   192_B      T   192_B     1.402     0    0.050   0.111     1.548   81.429   80.204
LGA    V   193_B      V   193_B     0.821     0    0.039   0.113     1.170   88.214   87.891
LGA    F   194_B      F   194_B     0.765     0    0.055   0.638     1.888   90.476   84.848
LGA    T   195_B      T   195_B     0.379     0    0.104   1.072     3.285   97.619   85.102
LGA    G   196_B      G   196_B     1.314     0    0.033   0.033     1.766   79.405   79.405
LGA    S   197_B      S   197_B     2.614     0    0.022   0.050     3.098   60.952   58.492
LGA    D   198_B      D   198_B     1.878     0    0.125   0.956     3.658   70.833   68.155
LGA    G   199_B      G   199_B     1.735     0    0.087   0.087     1.771   77.143   77.143
LGA    F   200_B      F   200_B     0.900     0    0.057   0.166     1.619   85.952   79.957
LGA    Y   201_B      Y   201_B     0.854     0    0.033   1.304     9.569   90.476   52.698
LGA    S   202_B      S   202_B     0.516     0    0.045   0.057     0.621   90.476   93.651
LGA    R   203_B      R   203_B     1.051     0    0.105   0.787     3.032   88.214   78.182
LGA    S   204_B      S   204_B     0.867     0    0.096   0.574     2.238   90.476   86.190
LGA    Y   205_B      Y   205_B     1.117     0    0.040   0.236     1.769   83.690   80.794
LGA    S   206_B      S   206_B     1.170     0    0.049   0.071     1.194   81.429   82.937
LGA    R   207_B      R   207_B     1.194     0    0.033   1.227     4.444   81.429   74.329
LGA    A   208_B      A   208_B     0.779     0    0.045   0.046     0.889   90.476   90.476
LGA    C   209_B      C   209_B     0.826     0    0.042   0.042     1.362   90.476   87.460
LGA    L   210_B      L   210_B     0.515     0    0.053   0.101     0.731   95.238   92.857
LGA    H   211_B      H   211_B     0.375     0    0.017   1.053     2.139  100.000   89.238
LGA    A   212_B      A   212_B     0.766     0    0.021   0.021     1.052   90.476   88.667
LGA    L   213_B      L   213_B     1.072     0    0.064   1.396     2.851   83.690   77.440
LGA    L   214_B      L   214_B     0.851     0    0.482   0.497     2.858   79.881   86.369
LGA    A   215_B      A   215_B     0.458     0    0.031   0.032     0.688   95.238   96.190
LGA    E   216_B      E   216_B     0.694     0    0.179   0.246     1.225   88.214   88.466
LGA    C   217_B      C   217_B     0.536     0    0.064   0.731     3.455   90.476   83.730
LGA    G   218_B      G   218_B     0.929     0    0.231   0.231     0.929   90.476   90.476
LGA    L   219_B      L   219_B     0.553     0    0.210   0.244     1.536   86.071   88.274
LGA    T   220_B      T   220_B     0.711     0    0.084   1.136     2.805   90.476   82.041
LGA    V   221_B      V   221_B     0.508     0    0.037   0.074     1.055   95.238   91.905
LGA    V   222_B      V   222_B     0.415     0    0.166   1.137     2.822   92.976   84.626
LGA    R   223_B      R   223_B     0.617     0    0.034   0.694     4.319   92.857   74.286
LGA    S   224_B      S   224_B     1.553     0    0.236   0.574     2.694   71.071   69.048
LGA    A   225_B      A   225_B     0.896     0    0.043   0.053     0.902   90.476   90.476
LGA    S   226_B      S   226_B     1.110     0    0.166   0.635     2.874   79.286   75.952
LGA    N   227_B      N   227_B     0.662     0    0.026   0.283     0.780   92.857   91.667
LGA    L   228_B      L   228_B     1.034     0    0.082   1.374     3.387   85.952   78.690
LGA    F   229_B      F   229_B     0.747     0    0.042   1.275     7.779   90.476   55.584
LGA    A   230_B      A   230_B     0.554     0    0.029   0.028     1.191   92.857   90.571
LGA    H   231_B      H   231_B     0.459     0    0.051   0.938     2.890  100.000   87.476
LGA    C   232_B      C   232_B     0.230     0    0.042   0.073     0.426  100.000  100.000
LGA    V   233_B      V   233_B     0.561     0    0.057   0.065     0.753   92.857   91.837
LGA    T   234_B      T   234_B     0.406     0    0.054   0.062     0.494  100.000  100.000
LGA    V   235_B      V   235_B     0.548     0    0.050   0.090     0.556   95.238   93.197
LGA    L   236_B      L   236_B     0.491     0    0.140   0.180     1.244   95.238   91.726
LGA    P   237_B      P   237_B     0.765     0    0.052   0.077     1.614   86.190   85.442
LGA    E   238_B      E   238_B     2.058     0    0.619   1.192     5.179   57.381   61.852
LGA    G   239_B      G   239_B     1.993     0    0.039   0.039     2.819   66.905   66.905
LGA    A   240_B      A   240_B     2.749     0    0.035   0.049     3.222   55.476   55.810
LGA    D   241_B      D   241_B     4.284     0    0.240   0.480     6.453   41.786   31.667
LGA    Q   242_B      Q   242_B     4.316     0    0.328   0.884     8.508   32.976   26.878
LGA    G   243_B      G   243_B     7.429     0    0.176   0.176     9.647    7.619    7.619
LGA    F   244_B      F   244_B    10.845     0    0.307   1.624    14.543    0.119    0.043

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      230     920    920  100.00    1795   1795  100.00               230
SUMMARY(RMSD_GDC):     1.872          1.933                  2.512           80.728   76.365

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  249  230    4.0    225    1.54    84.348    91.541    13.760

LGA_LOCAL      RMSD:   1.535  Number of atoms:  225  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   1.877  Number of assigned atoms:  230 
Std_ASGN_ATOMS RMSD:   1.872  Standard rmsd on all 230 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.778002 * X  +   0.580778 * Y  +  -0.239605 * Z  +  28.851950
  Y_new =   0.144511 * X  +  -0.205722 * Y  +  -0.967882 * Z  +  39.624741
  Z_new =  -0.611416 * X  +  -0.787639 * Y  +   0.076123 * Z  +  -4.529922 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  2.957939  0.657849 -1.474448   [DEG:  169.4774   37.6919  -84.4797 ]
ZXZ: -0.242677  1.494600 -2.481494   [DEG:  -13.9044   85.6342 -142.1791 ]
 
# END of job
