
#######################################################
#                                                     #
#                        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       0.80    32.14
  LCS_AVERAGE:     51.26

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   149       1_A - 149_A       0.80    32.14
  LCS_AVERAGE:     49.85

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   149       1_A - 149_A       0.80    32.14
  LCS_AVERAGE:     49.67

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     17  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     87  129  144  145  148  148  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     92  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     83  129  144  145  148  148  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     18  126  144  145  148  148  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     18  124  144  145  148  148  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     18  124  144  145  148  148  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     17   60  144  145  148  148  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     17   76  144  145  148  148  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      3   24   70  143  148  148  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      3   27   82  143  148  148  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      3   27  101  143  148  148  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     19  116  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     86  129  144  145  148  148  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     87  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     23  110  143  145  148  148  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     23  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     52  126  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     88  129  144  145  148  148  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     92  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     85  129  144  145  148  148  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     29  127  144  145  148  148  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     87  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     83  129  144  145  148  148  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     87  129  144  145  148  148  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     91  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     88  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     70  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     88  129  144  145  148  148  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     74  129  144  145  148  148  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     76  129  144  145  148  148  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     42  123  144  145  148  148  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     35  126  144  145  148  148  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     76  129  144  145  148  148  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     41  129  144  145  148  148  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     92  129  144  145  148  148  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     93  129  144  145  148  148  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     92  129  144  145  148  148  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     60  129  144  145  148  148  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     71  129  144  145  148  148  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     60  129  144  145  148  148  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     54  124  144  145  148  148  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     40  124  144  145  148  148  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     35  124  144  145  148  148  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     35  112  144  145  148  148  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     35  116  144  145  148  148  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     57  129  144  145  148  148  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     60  129  144  145  148  148  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     42  129  144  145  148  148  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     64  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     92  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     70  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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     93  129  144  145  148  148  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    3   17   61  125  147  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     V   174_B     V   174_A     11   12   20     10   11   11   11   12   12   13   13   15   16   16   17   17   17   19   21   21   24   26   27 
LCS_GDT     N   175_B     N   175_A     11   12   20     10   11   11   11   12   12   13   13   15   16   16   17   17   17   19   21   21   24   26   27 
LCS_GDT     A   176_B     A   176_A     11   12   20     10   11   11   11   12   12   13   13   15   16   16   17   17   17   19   21   23   24   27   29 
LCS_GDT     D   177_B     D   177_A     11   12   20     10   11   11   11   12   12   13   13   15   16   16   17   17   17   19   21   23   24   27   31 
LCS_GDT     V   178_B     V   178_A     11   12   20     10   11   11   11   12   12   13   13   15   16   16   17   17   17   19   21   23   24   26   31 
LCS_GDT     Q   179_B     Q   179_A     11   12   20     10   11   11   11   12   12   13   13   15   16   16   17   17   17   19   21   24   25   31   33 
LCS_GDT     K   180_B     K   180_A     11   12   20     10   11   11   11   12   12   13   13   15   16   16   17   17   17   19   22   26   28   31   33 
LCS_GDT     L   181_B     L   181_A     11   12   20     10   11   11   11   12   12   13   13   15   16   16   17   17   17   19   22   24   26   29   32 
LCS_GDT     Q   182_B     Q   182_A     11   12   20     10   11   11   11   12   12   13   13   15   16   16   17   17   17   19   22   26   28   31   33 
LCS_GDT     Q   183_B     Q   183_A     11   12   20     10   11   11   11   12   12   13   13   15   16   16   17   17   18   21   27   28   30   32   34 
LCS_GDT     Q   184_B     Q   184_A     11   12   20      6   11   11   11   12   12   13   13   15   16   16   17   17   17   19   22   26   30   32   33 
LCS_GDT     L   185_B     L   185_A      3   12   20      3    3    4    4   10   12   13   13   15   16   16   17   19   22   24   27   28   30   32   34 
LCS_GDT     Q   186_B     Q   186_A      3    4   20      3    3    4    4    4    7    8   13   14   14   15   17   19   22   24   27   28   30   32   34 
LCS_GDT     D   187_B     D   187_A      3    4   20      3    3    4   10   12   12   13   13   15   16   16   17   19   22   24   27   28   30   32   34 
LCS_GDT     I   188_B     I   188_A      3    5   20      3    3    4    5    5    8   11   12   15   16   16   17   19   22   24   27   28   30   32   34 
LCS_GDT     K   189_B     K   189_A      4    5   20      3    4    4    5    5    6    8   12   14   16   16   17   19   22   24   27   28   30   32   34 
LCS_GDT     E   190_B     E   190_A      4    5   20      3    4    4    4    5    8   11   12   15   16   16   17   18   21   24   27   28   30   32   34 
LCS_GDT     Q   191_B     Q   191_A      4    6   20      3    4    4    5    5    6    8    9   11   12   15   17   19   22   24   27   28   30   32   34 
LCS_GDT     T   192_B     T   192_A      6    6   20      3    6    6    6    8    8    9    9   11   12   13   15   16   20   24   27   28   30   32   34 
LCS_GDT     M   193_B     M   193_A      6    6   20      3    6    6    6    8    8    9    9   11   12   13   15   16   19   23   29   31   31   32   34 
LCS_GDT     C   194_B     C   194_A      6    6   15      3    6    6    6    8    8    9    9   11   12   13   17   19   22   24   29   31   31   32   34 
LCS_GDT     P   195_B     P   195_A      6    6   15      3    6    6    6    8    8    9    9   11   12   14   17   19   22   24   29   31   31   32   34 
LCS_GDT     V   196_B     V   196_A      6    6   15      3    6    6    6    8    8    9    9   11   12   14   17   19   22   24   29   31   31   32   34 
LCS_GDT     C   197_B     C   197_A      6    6   15      3    6    6    6    8    8    9    9   11   13   14   16   20   22   24   29   31   31   34   37 
LCS_GDT     L   198_B     L   198_A      3    6   15      3    3    4    5    5    6    7    9   11   13   14   16   19   22   24   29   31   31   34   37 
LCS_GDT     D   199_B     D   199_A      3    6   15      3    3    3    3    5    6    7    7   11   13   14   16   20   21   24   27   29   35   36   37 
LCS_GDT     R   200_B     R   200_A      3    6   14      3    3    4    5    5    6    7    7   11   13   16   18   20   21   24   27   29   35   36   37 
LCS_GDT     L   201_B     L   201_A      3    6   14      3    3    4    5    6    7    8   10   12   14   16   18   20   21   24   27   29   35   36   37 
LCS_GDT     K   202_B     K   202_A      4    5   14      3    3    4    4    6    7    8   10   13   14   15   18   20   21   24   27   29   35   36   37 
LCS_GDT     N   203_B     N   203_A      4    4   14      3    3    4    4    6    7    8   10   13   14   16   18   20   21   24   27   29   35   36   37 
LCS_GDT     M   204_B     M   204_A      4    4   14      3    3    4    4    6    7    9   10   13   14   16   18   19   21   24   25   26   35   36   37 
LCS_GDT     I   205_B     I   205_A      4    5   17      0    3    4    5    6    7    9   10   13   14   16   19   20   21   24   25   29   35   36   37 
LCS_GDT     F   206_B     F   206_A      4    5   17      3    4    4    6    6    8    8   12   13   15   16   19   21   22   24   27   29   35   36   37 
LCS_GDT     L   207_B     L   207_A      4    5   17      3    4    4    6    7    8    9   12   13   15   16   19   19   21   24   25   27   29   35   37 
LCS_GDT     C   208_B     C   208_A      4    5   17      3    4    4    6    6    8    9   12   13   15   16   19   19   21   24   25   27   29   35   37 
LCS_GDT     G   209_B     G   209_A      4    5   17      3    4    4    6    7    8    9   12   13   15   16   19   20   21   24   25   29   35   36   37 
LCS_GDT     H   210_B     H   210_A      3    5   17      3    3    3    5    6    7    8   10   10   13   16   19   20   21   24   27   29   35   36   37 
LCS_GDT     G   211_B     G   211_A      3    5   17      0    3    3    5    7    7    8   10   10   13   14   16   17   21   22   23   27   29   33   36 
LCS_GDT     T   212_B     T   212_A      5    5   17      3    3    5    5    7    7    8   10   10   13   14   16   17   21   22   23   26   27   28   29 
LCS_GDT     C   213_B     C   213_A      5    5   17      3    4    5    6    7    7    8   10   10   13   14   16   17   21   22   23   26   27   28   29 
LCS_GDT     Q   214_B     Q   214_A      5    5   17      3    4    5    5    7    7    8   10   10   12   14   16   17   21   22   23   25   26   27   29 
LCS_GDT     L   215_B     L   215_A      5    5   17      3    4    5    6    7    7    7   10   10   13   14   16   17   21   22   23   26   27   28   32 
LCS_GDT     C   216_B     C   216_A      5    6   17      3    4    5    6    7    7    8    9   10   13   14   16   17   21   22   23   26   27   29   33 
LCS_GDT     G   217_B     G   217_A      4    6   17      3    3    4    6    7    7    8   10   10   13   14   16   17   21   24   27   29   35   36   37 
LCS_GDT     D   218_B     D   218_A      4    6   17      3    4    5    6    7    7    7    8   10   13   14   16   17   21   24   27   29   35   36   37 
LCS_GDT     R   219_B     R   219_A      4    6   17      3    4    5    6    6    7    7   10   10   13   14   16   19   21   24   28   31   35   36   37 
LCS_GDT     M   220_B     M   220_A      4    6   17      3    4    5    6    6    7    8   10   10   13   14   16   19   21   22   29   31   35   36   37 
LCS_GDT     S   221_B     S   221_A      4    6   17      3    4    5    6    6    7    8    9   10   12   14   16   19   21   22   29   31   31   34   37 
LCS_GDT     E   222_B     E   222_A      4    6   13      0    4    5    6    6    7    8    9    9   11   13   15   17   21   21   23   26   28   31   33 
LCS_GDT     C   223_B     C   223_A      3    6   13      3    4    4    6    6    7    8    9    9   11   13   15   17   21   21   23   26   28   31   33 
LCS_GDT     P   224_B     P   224_A      4    6   13      3    4    5    6    6    7    8    9   11   13   14   18   19   21   23   25   27   28   31   33 
LCS_GDT     I   225_B     I   225_A      4    5   13      3    4    4    4    5    5    7    9   11   13   16   18   20   21   24   25   27   28   31   33 
LCS_GDT     C   226_B     C   226_A      4    5   13      3    4    4    5    6    7    8    9   11   13   16   18   20   21   24   29   31   31   33   36 
LCS_GDT     R   227_B     R   227_A      4    5   13      3    4    4    5    6    7    8    9   11   13   16   18   20   21   24   29   31   31   31   33 
LCS_GDT     K   228_B     K   228_A      3    5   13      4    4    4    5    6    7    8    9   11   13   16   18   20   21   24   29   31   33   35   37 
LCS_GDT     A   229_B     A   229_A      3    4   13      3    4    5    5    6    6    7   10   11   13   15   19   21   22   24   29   31   35   36   37 
LCS_GDT     I   230_B     I   230_A      3    4   13      3    4    5    5    7    7    8   10   11   13   16   19   21   22   24   28   31   35   36   37 
LCS_GDT     E   231_B     E   231_A      3    4   13      3    3    3    4    6    6    8   10   11   13   16   19   21   22   24   26   29   35   36   37 
LCS_GDT     R   232_B     R   232_A      3    4   13      3    3    3    4    6    6    8    9   11   13   16   19   21   22   24   27   29   35   36   37 
LCS_GDT     R   233_B     R   233_A      3    5   13      3    3    3    6    6    8    8   12   12   15   16   19   21   22   24   27   29   35   36   37 
LCS_GDT     I   234_B     I   234_A      4    5   13      4    4    4    4    5    8    8   12   12   15   16   19   21   22   24   27   29   35   36   37 
LCS_GDT     L   235_B     L   235_A      4    5   13      4    4    4    6    6    8    8   12   12   15   16   19   21   22   24   27   29   35   36   37 
LCS_GDT     L   236_B     L   236_A      4    5   13      4    4    4    4    4    7    8   12   12   15   16   19   21   22   24   27   29   35   36   37 
LCS_GDT     Y   237_B     Y   237_A      4    5   12      4    4    4    4    4    5    6   10   11   12   16   19   21   22   24   26   29   33   35   37 
LCS_AVERAGE  LCS_A:  50.26  (  49.67   49.85   51.26 )

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     93    129    144    145    148    148    149    149    149    149    149    149    149    149    149    149    149    149    149    149 
GDT PERCENT_AT  43.66  60.56  67.61  68.08  69.48  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
GDT RMS_LOCAL    0.30   0.48   0.64   0.65   0.74   0.74   0.80   0.80   0.80   0.80   0.80   0.80   0.80   0.80   0.80   0.80   0.80   0.80   0.80   0.80
GDT RMS_ALL_AT  32.21  32.18  32.14  32.13  32.13  32.13  32.14  32.14  32.14  32.14  32.14  32.14  32.14  32.14  32.14  32.14  32.14  32.14  32.14  32.14

# Checking swapping
#   possible swapping detected:  D    30_B      D    30_A
#   possible swapping detected:  F    51_B      F    51_A
#   possible swapping detected:  D    60_B      D    60_A
#   possible swapping detected:  F    63_B      F    63_A
#   possible swapping detected:  E   123_B      E   123_A
#   possible swapping detected:  Y   128_B      Y   128_A
#   possible swapping detected:  E   141_B      E   141_A
#   possible swapping detected:  E   190_B      E   190_A
#   possible swapping detected:  F   206_B      F   206_A
#   possible swapping detected:  Y   237_B      Y   237_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    S     1_B      S     1_A     0.706     0    0.515   0.977     5.170   84.048   68.730
LGA    M     2_B      M     2_A     0.348     0    0.041   0.943     3.674  100.000   89.405
LGA    A     3_B      A     3_A     0.610     0    0.027   0.046     0.697   90.476   90.476
LGA    L     4_B      L     4_A     0.562     0    0.040   1.193     4.400   95.238   82.857
LGA    K     5_B      K     5_A     0.341     0    0.026   0.865     3.623  100.000   78.360
LGA    R     6_B      R     6_A     0.242     0    0.034   0.358     0.896  100.000   96.537
LGA    I     7_B      I     7_A     0.359     0    0.047   0.591     1.353  100.000   96.488
LGA    H     8_B      H     8_A     0.194     0    0.027   1.081     5.122  100.000   72.381
LGA    K     9_B      K     9_A     0.237     0    0.040   0.642     1.964  100.000   89.841
LGA    E    10_B      E    10_A     0.523     0    0.023   0.561     1.444   92.857   91.640
LGA    L    11_B      L    11_A     0.468     0    0.041   0.929     3.759   97.619   87.143
LGA    N    12_B      N    12_A     0.579     0    0.026   1.108     4.826   92.857   76.905
LGA    D    13_B      D    13_A     1.106     0    0.055   1.004     4.540   83.690   67.619
LGA    L    14_B      L    14_A     1.180     0    0.033   1.061     2.601   81.429   76.310
LGA    A    15_B      A    15_A     1.157     0    0.023   0.030     1.567   79.286   81.524
LGA    R    16_B      R    16_A     1.559     0    0.171   1.453     4.897   72.976   62.944
LGA    D    17_B      D    17_A     1.569     0    0.078   0.820     1.735   72.857   75.060
LGA    P    18_B      P    18_A     2.609     0    0.100   0.136     3.209   62.857   58.367
LGA    P    19_B      P    19_A     2.583     0    0.055   0.139     2.919   57.143   57.143
LGA    A    20_B      A    20_A     2.572     0    0.085   0.082     2.742   60.952   60.190
LGA    Q    21_B      Q    21_A     1.297     0    0.421   1.165     3.673   75.119   73.439
LGA    C    22_B      C    22_A     0.225     0    0.042   0.217     1.350  100.000   96.905
LGA    S    23_B      S    23_A     0.511     0    0.067   0.495     1.457   95.238   92.143
LGA    A    24_B      A    24_A     0.628     0    0.088   0.099     1.015   88.214   88.667
LGA    G    25_B      G    25_A     0.590     0    0.075   0.075     0.590   95.238   95.238
LGA    P    26_B      P    26_A     0.340     0    0.031   0.116     0.470  100.000  100.000
LGA    V    27_B      V    27_A     0.393     0    0.054   1.395     2.817   95.238   85.034
LGA    G    28_B      G    28_A     0.542     0    0.104   0.104     0.791   92.857   92.857
LGA    D    29_B      D    29_A     0.863     0    0.168   1.031     5.516   92.857   67.857
LGA    D    30_B      D    30_A     0.468     0    0.110   0.870     2.088  100.000   88.690
LGA    M    31_B      M    31_A     0.163     0    0.032   0.715     2.774  100.000   91.250
LGA    F    32_B      F    32_A     0.242     0    0.142   0.237     1.005   92.976   93.983
LGA    H    33_B      H    33_A     0.255     0    0.046   0.292     0.704  100.000   98.095
LGA    W    34_B      W    34_A     0.271     0    0.045   0.163     0.557  100.000   98.639
LGA    Q    35_B      Q    35_A     0.245     0    0.049   1.211     2.869  100.000   83.545
LGA    A    36_B      A    36_A     0.453     0    0.024   0.039     0.583  100.000   98.095
LGA    T    37_B      T    37_A     0.211     0    0.044   1.268     2.449  100.000   88.571
LGA    I    38_B      I    38_A     0.293     0    0.064   0.320     1.056  100.000   97.679
LGA    M    39_B      M    39_A     0.144     0    0.066   1.099     3.154  100.000   88.155
LGA    G    40_B      G    40_A     0.363     0    0.087   0.087     0.380  100.000  100.000
LGA    P    41_B      P    41_A     0.296     0    0.067   0.087     0.497  100.000  100.000
LGA    N    42_B      N    42_A     0.217     0    0.640   0.578     2.798   86.905   87.679
LGA    D    43_B      D    43_A     1.558     0    0.143   0.910     3.955   79.405   65.893
LGA    S    44_B      S    44_A     0.959     0    0.023   0.035     1.228   88.214   88.968
LGA    P    45_B      P    45_A     0.213     0    0.078   0.381     1.240  100.000   95.986
LGA    Y    46_B      Y    46_A     0.389     0    0.089   0.175     0.813  100.000   93.651
LGA    Q    47_B      Q    47_A     0.168     0    0.032   0.996     2.996  100.000   86.190
LGA    G    48_B      G    48_A     0.345     0    0.037   0.037     0.345  100.000  100.000
LGA    G    49_B      G    49_A     0.279     0    0.022   0.022     0.298  100.000  100.000
LGA    V    50_B      V    50_A     0.298     0    0.035   0.986     2.282  100.000   89.932
LGA    F    51_B      F    51_A     0.330     0    0.041   0.142     0.417  100.000  100.000
LGA    F    52_B      F    52_A     0.216     0    0.051   0.164     1.245  100.000   93.160
LGA    L    53_B      L    53_A     0.408     0    0.012   0.175     1.018  100.000   95.298
LGA    T    54_B      T    54_A     0.308     0    0.038   1.094     2.282  100.000   88.571
LGA    I    55_B      I    55_A     0.322     0    0.054   0.123     0.529  100.000   98.810
LGA    H    56_B      H    56_A     0.346     0    0.059   0.841     4.451   97.619   74.476
LGA    F    57_B      F    57_A     0.313     0    0.082   0.116     0.681   97.619   99.134
LGA    P    58_B      P    58_A     0.409     0    0.054   0.062     0.529   97.619   98.639
LGA    T    59_B      T    59_A     0.180     0    0.073   1.161     2.584   97.619   87.483
LGA    D    60_B      D    60_A     1.132     0    0.314   0.896     2.373   90.595   80.714
LGA    Y    61_B      Y    61_A     0.309     0    0.038   0.113     0.618   97.619   98.413
LGA    P    62_B      P    62_A     0.452     0    0.053   0.243     0.920   97.619   94.558
LGA    F    63_B      F    63_A     0.662     0    0.075   0.403     1.966   90.476   85.714
LGA    K    64_B      K    64_A     0.570     0    0.065   1.197     3.657   95.238   83.386
LGA    P    65_B      P    65_A     0.454     0    0.045   0.091     0.530   97.619   98.639
LGA    P    66_B      P    66_A     0.417     0    0.072   0.167     0.722  100.000   97.279
LGA    K    67_B      K    67_A     0.339     0    0.053   1.224     6.324  100.000   76.296
LGA    V    68_B      V    68_A     0.288     0    0.035   0.078     0.522  100.000   97.279
LGA    A    69_B      A    69_A     0.251     0    0.023   0.052     0.369  100.000  100.000
LGA    F    70_B      F    70_A     0.331     0    0.071   0.130     0.889   97.619   95.671
LGA    T    71_B      T    71_A     0.445     0    0.149   1.016     2.778   97.619   88.503
LGA    T    72_B      T    72_A     0.282     0    0.037   1.017     2.708  100.000   90.000
LGA    R    73_B      R    73_A     0.296     0    0.030   0.986     4.020  100.000   86.883
LGA    I    74_B      I    74_A     0.325     0    0.022   0.093     0.473  100.000  100.000
LGA    Y    75_B      Y    75_A     0.320     0    0.080   0.100     0.600  100.000   98.413
LGA    H    76_B      H    76_A     0.481     0    0.040   0.077     0.673   95.238   92.381
LGA    P    77_B      P    77_A     0.417     0    0.034   0.330     1.371   95.238   93.265
LGA    N    78_B      N    78_A     0.886     0    0.136   0.257     1.208   92.857   87.143
LGA    I    79_B      I    79_A     0.587     0    0.039   0.102     0.771   90.476   94.048
LGA    N    80_B      N    80_A     0.698     0    0.028   0.533     1.600   90.476   88.274
LGA    S    81_B      S    81_A     0.791     0    0.081   0.081     1.130   90.476   88.968
LGA    N    82_B      N    82_A     1.160     0    0.648   1.352     5.012   72.024   61.131
LGA    G    83_B      G    83_A     0.573     0    0.026   0.026     0.803   90.476   90.476
LGA    S    84_B      S    84_A     0.398     0    0.069   0.666     2.571   97.619   91.270
LGA    I    85_B      I    85_A     0.411     0    0.046   0.056     0.504  100.000   98.810
LGA    C    86_B      C    86_A     0.490     0    0.021   0.055     0.574   97.619   96.825
LGA    L    87_B      L    87_A     0.400     0    0.056   0.101     0.901  100.000   96.429
LGA    D    88_B      D    88_A     0.404     0    0.015   0.382     1.453  100.000   96.488
LGA    I    89_B      I    89_A     0.318     0    0.021   0.721     2.749  100.000   91.071
LGA    L    90_B      L    90_A     0.256     0    0.067   0.141     0.642  100.000   98.810
LGA    R    91_B      R    91_A     0.617     0    0.169   1.048     7.446   92.857   60.476
LGA    S    92_B      S    92_A     0.710     0    0.091   0.656     3.420   92.857   85.317
LGA    Q    93_B      Q    93_A     0.481     0    0.205   1.051     2.867   90.595   84.868
LGA    W    94_B      W    94_A     0.258     0    0.034   0.124     0.588   97.619   99.320
LGA    S    95_B      S    95_A     0.474     0    0.034   0.537     1.574  100.000   93.889
LGA    P    96_B      P    96_A     0.460     0    0.039   0.100     0.803   97.619   94.558
LGA    A    97_B      A    97_A     0.106     0    0.163   0.164     0.840   97.619   98.095
LGA    L    98_B      L    98_A     0.155     0    0.022   0.359     1.495  100.000   95.298
LGA    T    99_B      T    99_A     0.100     0    0.035   0.052     0.276  100.000  100.000
LGA    I   100_B      I   100_A     0.348     0    0.032   0.945     2.637  100.000   86.845
LGA    S   101_B      S   101_A     0.272     0    0.035   0.062     0.306  100.000  100.000
LGA    K   102_B      K   102_A     0.432     0    0.028   0.870     4.519  100.000   74.815
LGA    V   103_B      V   103_A     0.279     0    0.023   0.113     0.516  100.000   98.639
LGA    L   104_B      L   104_A     0.329     0    0.027   0.183     0.557  100.000   98.810
LGA    L   105_B      L   105_A     0.549     0    0.036   1.381     3.362   92.857   81.190
LGA    S   106_B      S   106_A     0.437     0    0.053   0.052     0.671   95.238   96.825
LGA    I   107_B      I   107_A     0.449     0    0.032   0.131     0.868   97.619   96.429
LGA    C   108_B      C   108_A     0.657     0    0.045   0.098     0.790   90.476   90.476
LGA    S   109_B      S   109_A     0.757     0    0.059   0.173     0.781   90.476   90.476
LGA    L   110_B      L   110_A     0.716     0    0.044   0.071     0.860   90.476   90.476
LGA    L   111_B      L   111_A     0.593     0    0.068   0.164     0.679   92.857   92.857
LGA    C   112_B      C   112_A     0.784     0    0.051   0.086     0.790   90.476   90.476
LGA    D   113_B      D   113_A     0.734     0    0.127   1.182     4.250   90.476   77.381
LGA    P   114_B      P   114_A     0.681     0    0.062   0.258     0.840   90.476   90.476
LGA    N   115_B      N   115_A     0.831     0    0.052   0.864     3.074   90.476   78.036
LGA    P   116_B      P   116_A     0.788     0    0.064   0.092     0.887   90.476   90.476
LGA    D   117_B      D   117_A     1.181     0    0.108   1.180     4.889   83.690   70.238
LGA    D   118_B      D   118_A     1.197     0    0.037   0.195     1.245   81.429   82.560
LGA    P   119_B      P   119_A     1.085     0    0.053   0.278     1.596   81.429   81.497
LGA    L   120_B      L   120_A     1.305     0    0.115   1.327     3.237   79.286   76.488
LGA    V   121_B      V   121_A     1.148     0    0.040   0.111     1.160   83.690   84.014
LGA    P   122_B      P   122_A     0.827     0    0.031   0.348     1.017   88.214   90.544
LGA    E   123_B      E   123_A     0.843     0    0.061   1.526     7.368   90.476   61.746
LGA    I   124_B      I   124_A     0.311     0    0.038   1.059     2.544   97.619   85.655
LGA    A   125_B      A   125_A     0.221     0    0.032   0.040     0.469  100.000  100.000
LGA    R   126_B      R   126_A     0.329     0    0.029   1.238     6.092  100.000   67.186
LGA    I   127_B      I   127_A     0.782     0    0.045   0.719     3.308   88.214   83.155
LGA    Y   128_B      Y   128_A     0.716     0    0.037   0.324     1.746   88.214   85.278
LGA    K   129_B      K   129_A     0.667     0    0.112   1.230     2.772   88.214   79.048
LGA    T   130_B      T   130_A     1.217     0    0.057   1.016     2.488   83.690   77.959
LGA    D   131_B      D   131_A     1.208     0    0.105   0.130     1.406   81.429   84.821
LGA    R   132_B      R   132_A     1.315     0    0.042   1.606     5.592   81.429   69.307
LGA    E   133_B      E   133_A     1.522     0    0.036   0.542     1.791   77.143   81.587
LGA    K   134_B      K   134_A     1.399     0    0.041   0.776     2.257   81.429   76.720
LGA    Y   135_B      Y   135_A     0.803     0    0.022   0.098     0.969   90.476   93.651
LGA    N   136_B      N   136_A     0.720     0    0.028   0.300     1.769   92.857   88.333
LGA    R   137_B      R   137_A     0.858     0    0.025   1.937     9.644   90.476   54.978
LGA    I   138_B      I   138_A     0.728     0    0.051   0.117     1.348   92.857   88.274
LGA    A   139_B      A   139_A     0.218     0    0.028   0.050     0.390  100.000  100.000
LGA    R   140_B      R   140_A     0.193     0    0.043   0.801     2.028  100.000   90.866
LGA    E   141_B      E   141_A     0.404     0    0.037   1.278     5.287   97.619   73.069
LGA    W   142_B      W   142_A     0.440     0    0.033   0.198     1.421  100.000   89.966
LGA    T   143_B      T   143_A     0.339     0    0.051   1.058     2.436  100.000   89.728
LGA    Q   144_B      Q   144_A     0.531     0    0.091   1.204     4.091   90.595   76.720
LGA    K   145_B      K   145_A     0.806     0    0.024   0.887     5.628   90.595   72.434
LGA    Y   146_B      Y   146_A     0.343     0    0.089   0.219     1.275  100.000   91.389
LGA    A   147_B      A   147_A     0.409     0    0.120   0.111     0.738  100.000   98.095
LGA    M   148_B      M   148_A     0.235     0    0.579   0.928     9.839   77.500   53.512
LGA    G   149_B      G   149_A     3.702     0    0.480   0.480     3.702   59.524   59.524
LGA    V   174_B      V   174_A    63.102     0    0.093   1.005    63.181    0.000    0.000
LGA    N   175_B      N   175_A    58.466     0    0.037   1.228    59.947    0.000    0.000
LGA    A   176_B      A   176_A    61.766     0    0.039   0.040    63.169    0.000    0.000
LGA    D   177_B      D   177_A    65.288     0    0.056   0.550    68.808    0.000    0.000
LGA    V   178_B      V   178_A    60.956     0    0.037   1.240    62.257    0.000    0.000
LGA    Q   179_B      Q   179_A    59.234     0    0.163   0.419    61.033    0.000    0.000
LGA    K   180_B      K   180_A    64.807     0    0.057   0.712    71.418    0.000    0.000
LGA    L   181_B      L   181_A    65.700     0    0.055   0.116    69.990    0.000    0.000
LGA    Q   182_B      Q   182_A    60.289     0    0.023   0.736    62.058    0.000    0.000
LGA    Q   183_B      Q   183_A    62.231     0    0.048   1.374    63.919    0.000    0.000
LGA    Q   184_B      Q   184_A    66.956     0    0.444   0.842    73.440    0.000    0.000
LGA    L   185_B      L   185_A    69.800     0    0.621   0.630    73.153    0.000    0.000
LGA    Q   186_B      Q   186_A    67.896     0    0.605   0.790    68.956    0.000    0.000
LGA    D   187_B      D   187_A    68.682     0    0.729   1.304    72.070    0.000    0.000
LGA    I   188_B      I   188_A    72.567     0    0.617   1.595    79.495    0.000    0.000
LGA    K   189_B      K   189_A    67.530     0    0.594   1.413    69.330    0.000    0.000
LGA    E   190_B      E   190_A    67.058     0    0.093   1.150    68.647    0.000    0.000
LGA    Q   191_B      Q   191_A    66.960     0    0.623   1.315    72.042    0.000    0.000
LGA    T   192_B      T   192_A    65.368     0    0.725   1.392    65.556    0.000    0.000
LGA    M   193_B      M   193_A    60.783     0    0.108   0.716    61.966    0.000    0.000
LGA    C   194_B      C   194_A    58.482     0    0.021   0.858    60.031    0.000    0.000
LGA    P   195_B      P   195_A    51.770     0    0.125   0.136    55.831    0.000    0.000
LGA    V   196_B      V   196_A    50.312     0    0.575   1.385    52.844    0.000    0.000
LGA    C   197_B      C   197_A    51.915     0    0.638   0.932    56.704    0.000    0.000
LGA    L   198_B      L   198_A    51.665     0    0.556   0.954    52.093    0.000    0.000
LGA    D   199_B      D   199_A    50.435     0    0.582   1.236    52.641    0.000    0.000
LGA    R   200_B      R   200_A    52.484     0    0.589   1.302    52.632    0.000    0.000
LGA    L   201_B      L   201_A    51.122     0    0.580   1.564    51.928    0.000    0.000
LGA    K   202_B      K   202_A    52.772     0    0.579   1.069    55.274    0.000    0.000
LGA    N   203_B      N   203_A    57.833     0    0.322   1.375    60.734    0.000    0.000
LGA    M   204_B      M   204_A    54.080     0    0.608   0.843    54.904    0.000    0.000
LGA    I   205_B      I   205_A    51.264     0    0.617   1.289    52.825    0.000    0.000
LGA    F   206_B      F   206_A    52.637     0    0.560   1.125    53.431    0.000    0.000
LGA    L   207_B      L   207_A    55.106     0    0.120   0.918    61.281    0.000    0.000
LGA    C   208_B      C   208_A    48.371     0    0.134   0.130    50.524    0.000    0.000
LGA    G   209_B      G   209_A    49.254     0    0.140   0.140    49.865    0.000    0.000
LGA    H   210_B      H   210_A    50.403     0    0.502   1.450    51.285    0.000    0.000
LGA    G   211_B      G   211_A    51.054     0    0.345   0.345    51.320    0.000    0.000
LGA    T   212_B      T   212_A    51.237     0    0.256   1.069    55.058    0.000    0.000
LGA    C   213_B      C   213_A    57.607     0    0.188   0.754    59.218    0.000    0.000
LGA    Q   214_B      Q   214_A    61.784     0    0.086   1.619    67.381    0.000    0.000
LGA    L   215_B      L   215_A    59.215     0    0.588   1.293    61.143    0.000    0.000
LGA    C   216_B      C   216_A    52.237     0    0.605   0.909    54.861    0.000    0.000
LGA    G   217_B      G   217_A    52.906     0    0.142   0.142    54.659    0.000    0.000
LGA    D   218_B      D   218_A    58.103     0    0.296   0.670    63.412    0.000    0.000
LGA    R   219_B      R   219_A    55.307     0    0.285   1.275    58.140    0.000    0.000
LGA    M   220_B      M   220_A    56.838     0    0.054   1.175    58.714    0.000    0.000
LGA    S   221_B      S   221_A    59.710     0    0.731   0.857    61.240    0.000    0.000
LGA    E   222_B      E   222_A    61.190     0    0.263   1.270    61.680    0.000    0.000
LGA    C   223_B      C   223_A    61.277     0    0.214   0.700    61.332    0.000    0.000
LGA    P   224_B      P   224_A    57.180     0    0.086   0.345    61.515    0.000    0.000
LGA    I   225_B      I   225_A    53.341     0    0.583   1.455    56.990    0.000    0.000
LGA    C   226_B      C   226_A    50.794     0    0.099   0.762    53.721    0.000    0.000
LGA    R   227_B      R   227_A    51.322     0    0.207   0.397    51.706    0.000    0.000
LGA    K   228_B      K   228_A    51.050     0    0.585   0.884    54.204    0.000    0.000
LGA    A   229_B      A   229_A    50.797     0    0.608   0.576    52.826    0.000    0.000
LGA    I   230_B      I   230_A    56.414     0    0.584   0.494    59.899    0.000    0.000
LGA    E   231_B      E   231_A    58.859     0    0.055   0.068    60.042    0.000    0.000
LGA    R   232_B      R   232_A    58.001     0    0.628   0.988    62.391    0.000    0.000
LGA    R   233_B      R   233_A    59.462     0    0.596   1.288    61.852    0.000    0.000
LGA    I   234_B      I   234_A    65.122     0    0.639   1.676    67.681    0.000    0.000
LGA    L   235_B      L   235_A    63.862     0    0.051   0.488    64.676    0.000    0.000
LGA    L   236_B      L   236_A    65.283     0    0.060   0.309    66.940    0.000    0.000
LGA    Y   237_B      Y   237_A    65.309     0    0.538   1.170    66.624    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):    22.885         22.743                 23.660           65.181   60.820

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  237  213    4.0    149    0.80    67.136    63.820    16.556

LGA_LOCAL      RMSD:   0.800  Number of atoms:  149  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  32.140  Number of assigned atoms:  213 
Std_ASGN_ATOMS RMSD:  22.885  Standard rmsd on all 213 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.929053 * X  +   0.248522 * Y  +   0.274039 * Z  + -15.443583
  Y_new =  -0.364143 * X  +  -0.745021 * Y  +  -0.558877 * Z  +  13.011535
  Z_new =   0.065272 * X  +  -0.619015 * Y  +   0.782662 * Z  +  60.013405 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -2.768044 -0.065318 -0.669174   [DEG: -158.5972   -3.7425  -38.3408 ]
ZXZ:  0.455889  0.671866  3.036536   [DEG:   26.1205   38.4951  173.9807 ]
 
# END of job
