
#######################################################
#                                                     #
#                        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  237 ( 1829),  selected  213 , name one
# Molecule2: number of CA atoms  213 ( 1696),  selected  213 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:B  -ch2:A  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   149       1_A - 149_A       0.77    25.73
  LCS_AVERAGE:     57.96

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   149       1_A - 149_A       0.77    25.73
  LCS_AVERAGE:     57.96

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   149       1_A - 149_A       0.77    25.73
  LCS_AVERAGE:     56.02

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  213
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_B     S     1_A    149  149  149     31  124  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     M     2_B     M     2_A    149  149  149     27  127  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     A     3_B     A     3_A    149  149  149     62  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     L     4_B     L     4_A    149  149  149     80  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     K     5_B     K     5_A    149  149  149     80  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     R     6_B     R     6_A    149  149  149     69  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     I     7_B     I     7_A    149  149  149     72  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     H     8_B     H     8_A    149  149  149     76  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     K     9_B     K     9_A    149  149  149     72  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     E    10_B     E    10_A    149  149  149     46  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     L    11_B     L    11_A    149  149  149     72  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     N    12_B     N    12_A    149  149  149     61  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     D    13_B     D    13_A    149  149  149     46  131  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     L    14_B     L    14_A    149  149  149     46  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     A    15_B     A    15_A    149  149  149     61  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     R    16_B     R    16_A    149  149  149     39  111  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     D    17_B     D    17_A    149  149  149     28  111  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     P    18_B     P    18_A    149  149  149     19   67  136  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     P    19_B     P    19_A    149  149  149      4   45  106  145  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     A    20_B     A    20_A    149  149  149      4   33   69  126  147  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     Q    21_B     Q    21_A    149  149  149     24   76  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     C    22_B     C    22_A    149  149  149     66  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     S    23_B     S    23_A    149  149  149     72  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     A    24_B     A    24_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     G    25_B     G    25_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     P    26_B     P    26_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     V    27_B     V    27_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     G    28_B     G    28_A    149  149  149     56  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     D    29_B     D    29_A    149  149  149     77  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     D    30_B     D    30_A    149  149  149     77  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     M    31_B     M    31_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     F    32_B     F    32_A    149  149  149     80  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     H    33_B     H    33_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     W    34_B     W    34_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     Q    35_B     Q    35_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     A    36_B     A    36_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     T    37_B     T    37_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     I    38_B     I    38_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     M    39_B     M    39_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     G    40_B     G    40_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     P    41_B     P    41_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     N    42_B     N    42_A    149  149  149     57  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     D    43_B     D    43_A    149  149  149     43   97  138  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     S    44_B     S    44_A    149  149  149     65  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     P    45_B     P    45_A    149  149  149     75  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     Y    46_B     Y    46_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     Q    47_B     Q    47_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     G    48_B     G    48_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     G    49_B     G    49_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     V    50_B     V    50_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     F    51_B     F    51_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     F    52_B     F    52_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     L    53_B     L    53_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     T    54_B     T    54_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     I    55_B     I    55_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     H    56_B     H    56_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     F    57_B     F    57_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     P    58_B     P    58_A    149  149  149     80  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     T    59_B     T    59_A    149  149  149     80  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     D    60_B     D    60_A    149  149  149     72  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     Y    61_B     Y    61_A    149  149  149     80  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     P    62_B     P    62_A    149  149  149     78  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     F    63_B     F    63_A    149  149  149     72  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     K    64_B     K    64_A    149  149  149     77  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     P    65_B     P    65_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     P    66_B     P    66_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     K    67_B     K    67_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     V    68_B     V    68_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     A    69_B     A    69_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     F    70_B     F    70_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     T    71_B     T    71_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     T    72_B     T    72_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     R    73_B     R    73_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     I    74_B     I    74_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     Y    75_B     Y    75_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     H    76_B     H    76_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     P    77_B     P    77_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     N    78_B     N    78_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     I    79_B     I    79_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     N    80_B     N    80_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     S    81_B     S    81_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     N    82_B     N    82_A    149  149  149     78  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     G    83_B     G    83_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     S    84_B     S    84_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     I    85_B     I    85_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     C    86_B     C    86_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     L    87_B     L    87_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     D    88_B     D    88_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     I    89_B     I    89_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     L    90_B     L    90_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     R    91_B     R    91_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     S    92_B     S    92_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     Q    93_B     Q    93_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     W    94_B     W    94_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     S    95_B     S    95_A    149  149  149     80  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     P    96_B     P    96_A    149  149  149     80  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     A    97_B     A    97_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     L    98_B     L    98_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     T    99_B     T    99_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     I   100_B     I   100_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     S   101_B     S   101_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     K   102_B     K   102_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     V   103_B     V   103_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     L   104_B     L   104_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     L   105_B     L   105_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     S   106_B     S   106_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     I   107_B     I   107_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     C   108_B     C   108_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     S   109_B     S   109_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     L   110_B     L   110_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     L   111_B     L   111_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     C   112_B     C   112_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     D   113_B     D   113_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     P   114_B     P   114_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     N   115_B     N   115_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     P   116_B     P   116_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     D   117_B     D   117_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     D   118_B     D   118_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     P   119_B     P   119_A    149  149  149     75  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     L   120_B     L   120_A    149  149  149     69  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     V   121_B     V   121_A    149  149  149     66  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     P   122_B     P   122_A    149  149  149     60  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     E   123_B     E   123_A    149  149  149     71  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     I   124_B     I   124_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     A   125_B     A   125_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     R   126_B     R   126_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     I   127_B     I   127_A    149  149  149     79  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     Y   128_B     Y   128_A    149  149  149     79  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     K   129_B     K   129_A    149  149  149     79  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     T   130_B     T   130_A    149  149  149     79  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     D   131_B     D   131_A    149  149  149     71  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     R   132_B     R   132_A    149  149  149     65  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     E   133_B     E   133_A    149  149  149     48  115  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     K   134_B     K   134_A    149  149  149     58  121  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     Y   135_B     Y   135_A    149  149  149     69  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     N   136_B     N   136_A    149  149  149     69  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     R   137_B     R   137_A    149  149  149     66  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     I   138_B     I   138_A    149  149  149     66  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     A   139_B     A   139_A    149  149  149     79  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     R   140_B     R   140_A    149  149  149     79  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     E   141_B     E   141_A    149  149  149     78  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     W   142_B     W   142_A    149  149  149     79  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     T   143_B     T   143_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     Q   144_B     Q   144_A    149  149  149     79  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     K   145_B     K   145_A    149  149  149     68  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     Y   146_B     Y   146_A    149  149  149     80  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     A   147_B     A   147_A    149  149  149     82  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     M   148_B     M   148_A    149  149  149     77  136  143  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     G   149_B     G   149_A    149  149  149      0   81  137  147  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     V   174_B     V   174_A     21   64   64     10   18   24   29   37   46   62   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     N   175_B     N   175_A     21   64   64     17   18   24   33   48   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     A   176_B     A   176_A     21   64   64     17   18   24   39   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     D   177_B     D   177_A     21   64   64     17   18   24   33   52   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     V   178_B     V   178_A     21   64   64     17   18   24   34   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     Q   179_B     Q   179_A     21   64   64     17   18   39   53   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     K   180_B     K   180_A     21   64   64     17   18   27   52   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     L   181_B     L   181_A     21   64   64     17   18   27   51   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     Q   182_B     Q   182_A     21   64   64     17   23   44   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     Q   183_B     Q   183_A     55   64   64     17   36   48   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     Q   184_B     Q   184_A     55   64   64     17   18   44   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     L   185_B     L   185_A     55   64   64     17   27   48   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     Q   186_B     Q   186_A     55   64   64     17   45   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     D   187_B     D   187_A     55   64   64     17   45   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     I   188_B     I   188_A     55   64   64     17   45   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     K   189_B     K   189_A     55   64   64     17   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     E   190_B     E   190_A     55   64   64     17   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     Q   191_B     Q   191_A     55   64   64      5   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     T   192_B     T   192_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     M   193_B     M   193_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     C   194_B     C   194_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     P   195_B     P   195_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     V   196_B     V   196_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     C   197_B     C   197_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     L   198_B     L   198_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     D   199_B     D   199_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     R   200_B     R   200_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     L   201_B     L   201_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     K   202_B     K   202_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     N   203_B     N   203_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     M   204_B     M   204_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     I   205_B     I   205_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     F   206_B     F   206_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     L   207_B     L   207_A     55   64   64     34   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     C   208_B     C   208_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     G   209_B     G   209_A     55   64   64     15   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     H   210_B     H   210_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     G   211_B     G   211_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     T   212_B     T   212_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     C   213_B     C   213_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     Q   214_B     Q   214_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     L   215_B     L   215_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     C   216_B     C   216_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     G   217_B     G   217_A     55   64   64     31   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     D   218_B     D   218_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     R   219_B     R   219_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     M   220_B     M   220_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     S   221_B     S   221_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     E   222_B     E   222_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     C   223_B     C   223_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     P   224_B     P   224_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     I   225_B     I   225_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     C   226_B     C   226_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     R   227_B     R   227_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     K   228_B     K   228_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     A   229_B     A   229_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     I   230_B     I   230_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     E   231_B     E   231_A     55   64   64     37   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     R   232_B     R   232_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     R   233_B     R   233_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     I   234_B     I   234_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     L   235_B     L   235_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     L   236_B     L   236_A     55   64   64     41   48   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     Y   237_B     Y   237_A     55   64   64     15   40   52   55   59   63   63   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_AVERAGE  LCS_A:  57.31  (  56.02   57.96   57.96 )

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     82    136    143    147    148    149    149    149    149    149    149    149    149    149    149    149    149    149    149    149 
GDT PERCENT_AT  38.50  63.85  67.14  69.01  69.48  69.95  69.95  69.95  69.95  69.95  69.95  69.95  69.95  69.95  69.95  69.95  69.95  69.95  69.95  69.95
GDT RMS_LOCAL    0.33   0.55   0.62   0.69   0.72   0.77   0.77   0.77   0.77   0.77   0.77   0.77   0.77   0.77   0.77   0.77   0.77   0.77   0.77   0.77
GDT RMS_ALL_AT  25.68  25.68  25.70  25.70  25.72  25.73  25.73  25.73  25.73  25.73  25.73  25.73  25.73  25.73  25.73  25.73  25.73  25.73  25.73  25.73

# Checking swapping
#   possible swapping detected:  E    10_B      E    10_A
#   possible swapping detected:  F    32_B      F    32_A
#   possible swapping detected:  F    51_B      F    51_A
#   possible swapping detected:  F    52_B      F    52_A
#   possible swapping detected:  Y    61_B      Y    61_A
#   possible swapping detected:  F    70_B      F    70_A
#   possible swapping detected:  Y    75_B      Y    75_A
#   possible swapping detected:  E   123_B      E   123_A
#   possible swapping detected:  Y   128_B      Y   128_A
#   possible swapping detected:  E   133_B      E   133_A
#   possible swapping detected:  Y   135_B      Y   135_A
#   possible swapping detected:  E   141_B      E   141_A
#   possible swapping detected:  D   177_B      D   177_A
#   possible swapping detected:  E   190_B      E   190_A
#   possible swapping detected:  D   199_B      D   199_A
#   possible swapping detected:  F   206_B      F   206_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    S     1_B      S     1_A     1.411     0    0.043   0.112     1.521   79.286   80.000
LGA    M     2_B      M     2_A     1.239     0    0.022   0.445     1.319   81.429   83.750
LGA    A     3_B      A     3_A     0.796     0    0.047   0.049     0.921   90.476   90.476
LGA    L     4_B      L     4_A     0.547     0    0.026   0.063     0.694   95.238   92.857
LGA    K     5_B      K     5_A     0.462     0    0.039   0.614     1.471   97.619   92.698
LGA    R     6_B      R     6_A     0.694     0    0.052   0.190     1.238   90.476   89.654
LGA    I     7_B      I     7_A     0.580     0    0.034   0.069     0.631   90.476   90.476
LGA    H     8_B      H     8_A     0.469     0    0.010   1.087     4.200  100.000   75.333
LGA    K     9_B      K     9_A     0.592     0    0.017   0.859     4.694   92.857   78.624
LGA    E    10_B      E    10_A     0.920     0    0.043   0.706     1.556   90.476   85.503
LGA    L    11_B      L    11_A     0.498     0    0.018   0.073     0.614   92.857   96.429
LGA    N    12_B      N    12_A     0.644     0    0.031   0.154     0.813   90.476   91.667
LGA    D    13_B      D    13_A     1.055     0    0.059   0.156     1.468   88.214   84.821
LGA    L    14_B      L    14_A     0.766     0    0.059   0.099     0.902   90.476   90.476
LGA    A    15_B      A    15_A     0.657     0    0.012   0.021     0.889   90.476   90.476
LGA    R    16_B      R    16_A     1.475     0    0.110   1.217     3.570   81.429   69.048
LGA    D    17_B      D    17_A     1.503     0    0.059   0.207     1.681   75.000   77.143
LGA    P    18_B      P    18_A     2.004     0    0.052   0.058     2.173   68.810   68.231
LGA    P    19_B      P    19_A     2.585     0    0.115   0.335     3.311   57.262   59.388
LGA    A    20_B      A    20_A     3.327     0    0.622   0.593     5.849   42.976   43.048
LGA    Q    21_B      Q    21_A     1.663     0    0.237   0.465     2.522   70.833   70.212
LGA    C    22_B      C    22_A     0.649     0    0.067   0.190     0.880   90.476   90.476
LGA    S    23_B      S    23_A     0.614     0    0.030   0.585     2.089   97.619   90.952
LGA    A    24_B      A    24_A     0.133     0    0.063   0.096     0.447  100.000  100.000
LGA    G    25_B      G    25_A     0.387     0    0.034   0.034     0.387  100.000  100.000
LGA    P    26_B      P    26_A     0.263     0    0.021   0.319     1.333  100.000   95.986
LGA    V    27_B      V    27_A     0.368     0    0.595   0.902     3.150   85.119   80.340
LGA    G    28_B      G    28_A     0.935     0    0.097   0.097     1.271   88.214   88.214
LGA    D    29_B      D    29_A     0.787     0    0.030   0.191     1.366   90.476   88.214
LGA    D    30_B      D    30_A     0.748     0    0.067   0.170     0.848   92.857   91.667
LGA    M    31_B      M    31_A     0.402     0    0.016   0.943     3.602   97.619   91.726
LGA    F    32_B      F    32_A     0.469     0    0.044   0.048     0.639  100.000   93.939
LGA    H    33_B      H    33_A     0.466     0    0.029   0.140     0.565  100.000   95.238
LGA    W    34_B      W    34_A     0.297     0    0.031   0.061     0.578  100.000   97.959
LGA    Q    35_B      Q    35_A     0.339     0    0.028   0.143     0.516  100.000   98.942
LGA    A    36_B      A    36_A     0.310     0    0.046   0.055     0.405  100.000  100.000
LGA    T    37_B      T    37_A     0.365     0    0.037   0.245     0.726   97.619   97.279
LGA    I    38_B      I    38_A     0.263     0    0.031   0.092     0.481  100.000  100.000
LGA    M    39_B      M    39_A     0.368     0    0.048   0.748     2.550  100.000   90.238
LGA    G    40_B      G    40_A     0.237     0    0.022   0.022     0.484  100.000  100.000
LGA    P    41_B      P    41_A     0.565     0    0.029   0.054     0.624   92.857   93.197
LGA    N    42_B      N    42_A     0.710     0    0.645   0.632     2.493   84.048   82.798
LGA    D    43_B      D    43_A     1.826     0    0.022   0.934     3.545   75.119   64.464
LGA    S    44_B      S    44_A     0.924     0    0.061   0.106     1.211   88.214   88.968
LGA    P    45_B      P    45_A     0.694     0    0.023   0.034     0.694   90.476   91.837
LGA    Y    46_B      Y    46_A     0.166     0    0.050   0.123     0.373  100.000  100.000
LGA    Q    47_B      Q    47_A     0.376     0    0.015   0.997     2.212  100.000   92.011
LGA    G    48_B      G    48_A     0.338     0    0.023   0.023     0.338  100.000  100.000
LGA    G    49_B      G    49_A     0.180     0    0.039   0.039     0.378  100.000  100.000
LGA    V    50_B      V    50_A     0.376     0    0.079   0.095     0.547  100.000   98.639
LGA    F    51_B      F    51_A     0.423     0    0.032   0.092     0.478  100.000  100.000
LGA    F    52_B      F    52_A     0.324     0    0.043   0.204     0.955  100.000   96.537
LGA    L    53_B      L    53_A     0.401     0    0.028   0.077     0.559  100.000   98.810
LGA    T    54_B      T    54_A     0.352     0    0.019   1.077     2.344  100.000   89.932
LGA    I    55_B      I    55_A     0.322     0    0.100   0.105     0.707   97.619   98.810
LGA    H    56_B      H    56_A     0.265     0    0.019   0.980     5.422  100.000   70.381
LGA    F    57_B      F    57_A     0.250     0    0.024   0.151     0.613   97.619   97.403
LGA    P    58_B      P    58_A     0.442     0    0.018   0.089     0.561  100.000   98.639
LGA    T    59_B      T    59_A     0.490     0    0.024   0.214     1.281   92.857   90.544
LGA    D    60_B      D    60_A     0.701     0    0.137   0.329     1.676   92.857   86.071
LGA    Y    61_B      Y    61_A     0.458     0    0.079   0.122     0.735   92.857   96.825
LGA    P    62_B      P    62_A     0.557     0    0.026   0.044     0.700   90.476   90.476
LGA    F    63_B      F    63_A     0.727     0    0.040   0.103     1.440   92.857   86.407
LGA    K    64_B      K    64_A     0.443     0    0.010   0.686     1.256   97.619   90.635
LGA    P    65_B      P    65_A     0.331     0    0.027   0.034     0.468  100.000  100.000
LGA    P    66_B      P    66_A     0.395     0    0.032   0.045     0.561  100.000   97.279
LGA    K    67_B      K    67_A     0.177     0    0.021   0.684     1.977  100.000   87.937
LGA    V    68_B      V    68_A     0.300     0    0.015   0.042     0.384  100.000  100.000
LGA    A    69_B      A    69_A     0.322     0    0.055   0.067     0.322  100.000  100.000
LGA    F    70_B      F    70_A     0.348     0    0.071   0.073     0.496  100.000  100.000
LGA    T    71_B      T    71_A     0.439     0    0.138   0.140     0.904  100.000   95.918
LGA    T    72_B      T    72_A     0.322     0    0.044   0.047     0.488  100.000  100.000
LGA    R    73_B      R    73_A     0.314     0    0.044   1.278     6.146  100.000   73.160
LGA    I    74_B      I    74_A     0.201     0    0.018   0.083     0.292  100.000  100.000
LGA    Y    75_B      Y    75_A     0.295     0    0.046   0.099     0.849  100.000   94.444
LGA    H    76_B      H    76_A     0.168     0    0.015   0.056     0.357  100.000  100.000
LGA    P    77_B      P    77_A     0.192     0    0.048   0.321     1.058  100.000   97.347
LGA    N    78_B      N    78_A     0.655     0    0.037   0.067     0.873   90.476   90.476
LGA    I    79_B      I    79_A     0.605     0    0.010   0.107     0.618   90.476   90.476
LGA    N    80_B      N    80_A     0.700     0    0.040   0.044     1.049   90.476   89.345
LGA    S    81_B      S    81_A     0.659     0    0.020   0.114     1.244   90.476   88.968
LGA    N    82_B      N    82_A     0.851     0    0.010   0.116     1.513   90.476   86.012
LGA    G    83_B      G    83_A     0.690     0    0.015   0.015     0.734   90.476   90.476
LGA    S    84_B      S    84_A     0.750     0    0.048   0.199     0.769   90.476   92.063
LGA    I    85_B      I    85_A     0.641     0    0.044   0.121     0.902   92.857   91.667
LGA    C    86_B      C    86_A     0.737     0    0.016   0.221     0.877   90.476   90.476
LGA    L    87_B      L    87_A     0.681     0    0.017   0.092     0.893   92.857   91.667
LGA    D    88_B      D    88_A     0.540     0    0.020   0.091     0.678   90.476   94.048
LGA    I    89_B      I    89_A     0.722     0    0.052   1.597     3.632   90.476   77.083
LGA    L    90_B      L    90_A     0.680     0    0.058   0.077     1.159   92.857   89.405
LGA    R    91_B      R    91_A     0.546     0    0.102   0.914     8.262   95.238   57.879
LGA    S    92_B      S    92_A     0.280     0    0.100   0.153     0.521   97.619   98.413
LGA    Q    93_B      Q    93_A     0.596     0    0.019   1.159     3.736   92.857   81.481
LGA    W    94_B      W    94_A     0.372     0    0.053   0.099     0.627   97.619   97.279
LGA    S    95_B      S    95_A     0.499     0    0.058   0.067     0.567  100.000   96.825
LGA    P    96_B      P    96_A     0.604     0    0.022   0.028     0.812   95.238   93.197
LGA    A    97_B      A    97_A     0.377     0    0.053   0.074     0.528  100.000   98.095
LGA    L    98_B      L    98_A     0.212     0    0.038   0.116     0.678  100.000   96.429
LGA    T    99_B      T    99_A     0.672     0    0.031   0.059     0.837   90.476   90.476
LGA    I   100_B      I   100_A     0.635     0    0.022   0.088     0.866   90.476   90.476
LGA    S   101_B      S   101_A     0.569     0    0.028   0.047     0.596   92.857   92.063
LGA    K   102_B      K   102_A     0.394     0    0.026   1.018     4.764  100.000   84.392
LGA    V   103_B      V   103_A     0.373     0    0.040   0.053     0.504  100.000   98.639
LGA    L   104_B      L   104_A     0.351     0    0.028   0.057     0.358  100.000  100.000
LGA    L   105_B      L   105_A     0.357     0    0.021   0.091     0.533  100.000   98.810
LGA    S   106_B      S   106_A     0.359     0    0.026   0.065     0.403  100.000  100.000
LGA    I   107_B      I   107_A     0.315     0    0.033   0.114     0.619  100.000   98.810
LGA    C   108_B      C   108_A     0.410     0    0.028   0.087     0.444  100.000  100.000
LGA    S   109_B      S   109_A     0.403     0    0.015   0.065     0.531   97.619   98.413
LGA    L   110_B      L   110_A     0.434     0    0.024   0.050     0.636  100.000   97.619
LGA    L   111_B      L   111_A     0.446     0    0.018   0.230     0.810  100.000   97.619
LGA    C   112_B      C   112_A     0.578     0    0.031   0.080     0.603   90.476   92.063
LGA    D   113_B      D   113_A     0.559     0    0.026   0.414     1.016   90.476   90.536
LGA    P   114_B      P   114_A     0.563     0    0.069   0.093     0.694   90.476   90.476
LGA    N   115_B      N   115_A     0.693     0    0.049   1.014     3.343   90.476   79.048
LGA    P   116_B      P   116_A     0.639     0    0.050   0.170     0.925   90.476   90.476
LGA    D   117_B      D   117_A     0.882     0    0.118   0.228     1.519   90.476   84.881
LGA    D   118_B      D   118_A     0.960     0    0.041   0.149     1.019   88.214   89.345
LGA    P   119_B      P   119_A     0.946     0    0.067   0.325     1.284   90.476   87.891
LGA    L   120_B      L   120_A     0.875     0    0.025   0.227     1.427   88.214   87.083
LGA    V   121_B      V   121_A     0.916     0    0.066   0.069     0.969   90.476   90.476
LGA    P   122_B      P   122_A     0.992     0    0.018   0.030     1.444   88.214   85.306
LGA    E   123_B      E   123_A     0.733     0    0.046   0.127     0.978   90.476   90.476
LGA    I   124_B      I   124_A     0.283     0    0.013   0.076     0.461  100.000  100.000
LGA    A   125_B      A   125_A     0.302     0    0.027   0.039     0.409  100.000  100.000
LGA    R   126_B      R   126_A     0.289     0    0.074   1.563     6.522  100.000   76.320
LGA    I   127_B      I   127_A     0.301     0    0.017   0.707     2.728  100.000   92.262
LGA    Y   128_B      Y   128_A     0.319     0    0.040   0.111     0.533  100.000   99.206
LGA    K   129_B      K   129_A     0.449     0    0.066   0.635     1.640   95.238   90.688
LGA    T   130_B      T   130_A     0.416     0    0.103   0.126     1.180   92.976   94.626
LGA    D   131_B      D   131_A     0.831     0    0.033   0.094     1.746   90.476   84.940
LGA    R   132_B      R   132_A     0.997     0    0.043   0.211     1.067   85.952   86.364
LGA    E   133_B      E   133_A     1.408     0    0.018   0.622     1.581   81.429   85.556
LGA    K   134_B      K   134_A     1.278     0    0.041   1.186     7.060   81.429   63.862
LGA    Y   135_B      Y   135_A     0.788     0    0.046   0.107     0.966   90.476   92.063
LGA    N   136_B      N   136_A     0.799     0    0.023   0.095     0.856   90.476   90.476
LGA    R   137_B      R   137_A     1.012     0    0.044   1.645     9.805   88.214   51.991
LGA    I   138_B      I   138_A     0.978     0    0.026   0.108     1.304   88.214   87.083
LGA    A   139_B      A   139_A     0.628     0    0.017   0.019     0.788   92.857   92.381
LGA    R   140_B      R   140_A     0.627     0    0.025   0.722     2.311   90.476   85.714
LGA    E   141_B      E   141_A     0.791     0    0.020   0.056     1.089   90.476   86.455
LGA    W   142_B      W   142_A     0.642     0    0.032   0.099     1.307   90.476   87.245
LGA    T   143_B      T   143_A     0.367     0    0.007   0.034     0.483  100.000  100.000
LGA    Q   144_B      Q   144_A     0.515     0    0.119   0.142     1.110   90.595   90.529
LGA    K   145_B      K   145_A     0.749     0    0.061   0.374     1.646   90.476   86.508
LGA    Y   146_B      Y   146_A     0.521     0    0.010   0.134     0.758   90.476   93.651
LGA    A   147_B      A   147_A     0.470     0    0.151   0.156     0.654   97.619   98.095
LGA    M   148_B      M   148_A     0.715     0    0.652   0.579     2.865   82.143   86.310
LGA    G   149_B      G   149_A     1.833     0    0.474   0.474     3.946   65.476   65.476
LGA    V   174_B      V   174_A    68.822     0    0.109   0.975    70.653    0.000    0.000
LGA    N   175_B      N   175_A    64.133     0    0.037   0.956    66.262    0.000    0.000
LGA    A   176_B      A   176_A    62.889     0    0.023   0.036    64.549    0.000    0.000
LGA    D   177_B      D   177_A    62.770     0    0.048   1.044    67.496    0.000    0.000
LGA    V   178_B      V   178_A    59.588     0    0.037   0.065    62.274    0.000    0.000
LGA    Q   179_B      Q   179_A    55.696     0    0.182   0.869    57.468    0.000    0.000
LGA    K   180_B      K   180_A    55.569     0    0.008   0.059    60.176    0.000    0.000
LGA    L   181_B      L   181_A    55.303     0    0.025   0.254    60.612    0.000    0.000
LGA    Q   182_B      Q   182_A    51.441     0    0.030   0.265    53.319    0.000    0.000
LGA    Q   183_B      Q   183_A    48.775     0    0.062   1.064    50.062    0.000    0.000
LGA    Q   184_B      Q   184_A    49.427     0    0.039   0.250    55.176    0.000    0.000
LGA    L   185_B      L   185_A    48.835     0    0.009   0.102    52.856    0.000    0.000
LGA    Q   186_B      Q   186_A    44.598     0    0.053   0.885    46.309    0.000    0.000
LGA    D   187_B      D   187_A    43.197     0    0.145   1.227    46.555    0.000    0.000
LGA    I   188_B      I   188_A    44.899     0    0.016   0.176    49.971    0.000    0.000
LGA    K   189_B      K   189_A    43.496     0    0.045   0.854    47.708    0.000    0.000
LGA    E   190_B      E   190_A    39.761     0    0.059   0.146    41.143    0.000    0.000
LGA    Q   191_B      Q   191_A    39.986     0    0.011   0.445    42.008    0.000    0.000
LGA    T   192_B      T   192_A    42.812     0    0.029   0.163    45.239    0.000    0.000
LGA    M   193_B      M   193_A    41.200     0    0.065   0.643    42.990    0.000    0.000
LGA    C   194_B      C   194_A    40.019     0    0.091   0.107    41.105    0.000    0.000
LGA    P   195_B      P   195_A    36.290     0    0.021   0.048    37.690    0.000    0.000
LGA    V   196_B      V   196_A    37.427     0    0.042   0.068    39.034    0.000    0.000
LGA    C   197_B      C   197_A    39.162     0    0.058   0.110    42.049    0.000    0.000
LGA    L   198_B      L   198_A    38.456     0    0.064   0.681    40.175    0.000    0.000
LGA    D   199_B      D   199_A    42.495     0    0.047   1.015    45.122    0.000    0.000
LGA    R   200_B      R   200_A    45.644     0    0.061   0.223    48.601    0.000    0.000
LGA    L   201_B      L   201_A    46.086     0    0.036   0.252    50.062    0.000    0.000
LGA    K   202_B      K   202_A    44.473     0    0.041   0.557    47.053    0.000    0.000
LGA    N   203_B      N   203_A    49.103     0    0.083   0.094    52.646    0.000    0.000
LGA    M   204_B      M   204_A    47.489     0    0.015   0.126    51.204    0.000    0.000
LGA    I   205_B      I   205_A    44.161     0    0.035   0.069    45.854    0.000    0.000
LGA    F   206_B      F   206_A    43.034     0    0.020   1.274    43.034    0.000    0.000
LGA    L   207_B      L   207_A    42.233     0    0.070   1.341    44.490    0.000    0.000
LGA    C   208_B      C   208_A    38.010     0    0.059   0.068    39.535    0.000    0.000
LGA    G   209_B      G   209_A    37.987     0    0.048   0.048    38.293    0.000    0.000
LGA    H   210_B      H   210_A    37.386     0    0.080   0.122    40.099    0.000    0.000
LGA    G   211_B      G   211_A    40.423     0    0.071   0.071    40.423    0.000    0.000
LGA    T   212_B      T   212_A    41.654     0    0.038   0.094    44.424    0.000    0.000
LGA    C   213_B      C   213_A    45.649     0    0.050   0.077    46.713    0.000    0.000
LGA    Q   214_B      Q   214_A    49.897     0    0.079   0.110    57.556    0.000    0.000
LGA    L   215_B      L   215_A    49.693     0    0.114   1.301    53.067    0.000    0.000
LGA    C   216_B      C   216_A    44.735     0    0.031   0.102    46.184    0.000    0.000
LGA    G   217_B      G   217_A    45.514     0    0.013   0.013    47.262    0.000    0.000
LGA    D   218_B      D   218_A    50.827     0    0.049   0.078    54.762    0.000    0.000
LGA    R   219_B      R   219_A    49.265     0    0.040   1.126    50.752    0.000    0.000
LGA    M   220_B      M   220_A    46.503     0    0.034   0.594    47.777    0.000    0.000
LGA    S   221_B      S   221_A    47.761     0    0.033   0.094    49.334    0.000    0.000
LGA    E   222_B      E   222_A    43.117     0    0.042   0.937    44.578    0.000    0.000
LGA    C   223_B      C   223_A    39.122     0    0.042   0.066    40.450    0.000    0.000
LGA    P   224_B      P   224_A    36.969     0    0.056   0.084    38.146    0.000    0.000
LGA    I   225_B      I   225_A    34.263     0    0.069   0.527    35.349    0.000    0.000
LGA    C   226_B      C   226_A    34.912     0    0.060   0.060    36.234    0.000    0.000
LGA    R   227_B      R   227_A    38.189     0    0.043   0.810    41.223    0.000    0.000
LGA    K   228_B      K   228_A    39.797     0    0.040   0.519    41.197    0.000    0.000
LGA    A   229_B      A   229_A    44.176     0    0.008   0.017    45.746    0.000    0.000
LGA    I   230_B      I   230_A    45.134     0    0.051   0.128    48.655    0.000    0.000
LGA    E   231_B      E   231_A    47.804     0    0.021   1.020    50.678    0.000    0.000
LGA    R   232_B      R   232_A    49.160     0    0.032   0.183    54.753    0.000    0.000
LGA    R   233_B      R   233_A    49.625     0    0.078   1.075    52.246    0.000    0.000
LGA    I   234_B      I   234_A    51.197     0    0.052   1.059    51.875    0.000    0.000
LGA    L   235_B      L   235_A    53.743     0    0.047   1.195    57.458    0.000    0.000
LGA    L   236_B      L   236_A    53.806     0    0.068   0.182    56.000    0.000    0.000
LGA    Y   237_B      Y   237_A    59.460     0    0.156   0.309    62.465    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      213     852    852  100.00    1696   1696  100.00               213
SUMMARY(RMSD_GDC):    16.212         16.200                 16.776           65.074   62.892

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  237  213    4.0    149    0.77    68.192    66.167    17.164

LGA_LOCAL      RMSD:   0.768  Number of atoms:  149  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  25.733  Number of assigned atoms:  213 
Std_ASGN_ATOMS RMSD:  16.212  Standard rmsd on all 213 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.989261 * X  +   0.146148 * Y  +  -0.001865 * Z  +   6.939937
  Y_new =  -0.145011 * X  +  -0.979808 * Y  +   0.137650 * Z  +   0.957358
  Z_new =   0.018290 * X  +   0.136442 * Y  +   0.990479 * Z  +  64.233490 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -2.996043 -0.018291  0.136892   [DEG: -171.6606   -1.0480    7.8433 ]
ZXZ: -3.128044  0.138101  0.133255   [DEG: -179.2237    7.9126    7.6349 ]
 
# END of job
