
#######################################################
#                                                     #
#                        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       0.76    30.03
  LCS_AVERAGE:     57.96

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   149       1_A - 149_A       0.76    30.03
  LCS_AVERAGE:     57.96

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   149       1_A - 149_A       0.76    30.03
  LCS_AVERAGE:     56.24

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     75  130  143  146  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     75  133  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     70  135  143  146  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     65  135  143  146  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     74  135  143  146  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     25  125  143  146  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     20  124  143  146  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      3   39  119  146  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      7   32   89  142  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      3   12   60  118  146  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   89  143  146  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     85  135  143  146  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     88  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     29  130  143  146  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     60  135  143  146  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     75  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     73  135  143  146  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     47  135  143  146  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   87  141  146  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     60  135  143  146  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     60  135  143  146  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     89  135  143  146  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     87  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     87  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     86  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     71  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     80  135  143  146  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     89  135  143  146  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     89  135  143  146  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     80  135  143  146  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     89  135  143  146  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     89  135  143  146  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     87  135  143  146  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     85  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     83  135  143  146  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     78  135  143  146  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     78  135  143  146  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     80  135  143  146  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     89  135  143  146  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     80  135  143  146  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     60  135  143  146  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     80  135  143  146  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     60  135  143  146  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     60  135  143  146  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     58  135  143  146  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     79  135  143  146  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     89  135  143  146  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     89  135  143  146  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     89  135  143  146  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     83  135  143  146  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  135  143  146  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     65  135  143  146  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     73  135  143  146  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     60  135  143  146  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     60  132  143  146  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     49  103  143  146  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     49  114  143  146  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     60  135  143  146  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     60  135  143  146  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     60  135  143  146  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     60  135  143  146  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     73  135  143  146  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     78  135  143  146  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     71  135  143  146  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     78  135  143  146  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     89  135  143  146  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     83  135  143  146  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     65  135  143  146  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     83  135  143  146  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     89  135  143  146  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     89  135  143  146  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     18   73  141  146  148  149  149  149  149  149  149  149  149  149  149  149  149  149  149  149 
LCS_GDT     V   174_B     V   174_A     22   64   64     11   18   24   32   40   53   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     N   175_B     N   175_A     22   64   64     16   19   25   40   59   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     A   176_B     A   176_A     22   64   64     16   19   26   41   59   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     D   177_B     D   177_A     22   64   64     16   19   26   40   59   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     V   178_B     V   178_A     22   64   64     16   19   28   50   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     Q   179_B     Q   179_A     22   64   64     16   21   41   54   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     K   180_B     K   180_A     22   64   64     16   19   33   53   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     L   181_B     L   181_A     23   64   64     16   19   39   54   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     Q   182_B     Q   182_A     56   64   64     16   29   47   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     Q   183_B     Q   183_A     56   64   64     16   29   50   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     Q   184_B     Q   184_A     56   64   64     16   29   48   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     L   185_B     L   185_A     56   64   64     16   37   51   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     Q   186_B     Q   186_A     56   64   64     16   45   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     D   187_B     D   187_A     56   64   64     16   38   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     I   188_B     I   188_A     56   64   64     21   47   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     K   189_B     K   189_A     56   64   64     30   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     E   190_B     E   190_A     56   64   64     16   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     Q   191_B     Q   191_A     56   64   64      4   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     T   192_B     T   192_A     56   64   64     23   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     M   193_B     M   193_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     C   194_B     C   194_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     P   195_B     P   195_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     V   196_B     V   196_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     C   197_B     C   197_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     L   198_B     L   198_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     D   199_B     D   199_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     R   200_B     R   200_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     L   201_B     L   201_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     K   202_B     K   202_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     N   203_B     N   203_A     56   64   64     30   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     M   204_B     M   204_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     I   205_B     I   205_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     F   206_B     F   206_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     L   207_B     L   207_A     56   64   64     29   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     C   208_B     C   208_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     G   209_B     G   209_A     56   64   64     22   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     H   210_B     H   210_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     G   211_B     G   211_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     T   212_B     T   212_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     C   213_B     C   213_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     Q   214_B     Q   214_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     L   215_B     L   215_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     C   216_B     C   216_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     G   217_B     G   217_A     56   64   64     30   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     D   218_B     D   218_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     R   219_B     R   219_A     56   64   64     30   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     M   220_B     M   220_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     S   221_B     S   221_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     E   222_B     E   222_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     C   223_B     C   223_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     P   224_B     P   224_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     I   225_B     I   225_A     56   64   64     30   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     C   226_B     C   226_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     R   227_B     R   227_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     K   228_B     K   228_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     A   229_B     A   229_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     I   230_B     I   230_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     E   231_B     E   231_A     56   64   64     22   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     R   232_B     R   232_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     R   233_B     R   233_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     I   234_B     I   234_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     L   235_B     L   235_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     L   236_B     L   236_A     56   64   64     37   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_GDT     Y   237_B     Y   237_A     56   64   64      9   49   52   56   60   63   64   64   64   64   64   64   64   64   64   64   64   64   64   64 
LCS_AVERAGE  LCS_A:  57.39  (  56.24   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     89    135    143    146    148    149    149    149    149    149    149    149    149    149    149    149    149    149    149    149 
GDT PERCENT_AT  41.78  63.38  67.14  68.54  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    0.31   0.53   0.60   0.65   0.71   0.76   0.76   0.76   0.76   0.76   0.76   0.76   0.76   0.76   0.76   0.76   0.76   0.76   0.76   0.76
GDT RMS_ALL_AT  30.05  30.03  30.02  30.01  30.02  30.03  30.03  30.03  30.03  30.03  30.03  30.03  30.03  30.03  30.03  30.03  30.03  30.03  30.03  30.03

# 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:  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:  E   222_B      E   222_A
#   possible swapping detected:  E   231_B      E   231_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    S     1_B      S     1_A     1.157     0    0.037   0.108     1.274   83.690   84.444
LGA    M     2_B      M     2_A     0.975     0    0.024   0.636     2.746   88.214   79.762
LGA    A     3_B      A     3_A     0.615     0    0.048   0.050     0.692   92.857   92.381
LGA    L     4_B      L     4_A     0.447     0    0.039   0.066     0.622   97.619   97.619
LGA    K     5_B      K     5_A     0.331     0    0.040   0.603     1.517  100.000   92.804
LGA    R     6_B      R     6_A     0.479     0    0.058   0.149     0.923  100.000   93.939
LGA    I     7_B      I     7_A     0.357     0    0.042   0.068     0.420  100.000  100.000
LGA    H     8_B      H     8_A     0.415     0    0.013   0.882     3.046  100.000   81.048
LGA    K     9_B      K     9_A     0.333     0    0.010   0.874     3.962  100.000   85.873
LGA    E    10_B      E    10_A     0.391     0    0.025   0.076     0.787  100.000   96.825
LGA    L    11_B      L    11_A     0.431     0    0.026   0.075     0.503  100.000   98.810
LGA    N    12_B      N    12_A     0.366     0    0.027   0.162     0.456  100.000  100.000
LGA    D    13_B      D    13_A     0.659     0    0.047   0.222     1.140   92.857   90.536
LGA    L    14_B      L    14_A     0.630     0    0.018   0.064     0.735   90.476   90.476
LGA    A    15_B      A    15_A     0.548     0    0.074   0.070     0.666   92.857   94.286
LGA    R    16_B      R    16_A     1.144     0    0.094   1.180     3.034   83.690   71.212
LGA    D    17_B      D    17_A     1.282     0    0.053   0.192     1.587   77.143   80.417
LGA    P    18_B      P    18_A     2.246     0    0.029   0.043     2.613   66.786   63.741
LGA    P    19_B      P    19_A     2.771     0    0.109   0.305     3.541   51.905   54.218
LGA    A    20_B      A    20_A     3.417     0    0.622   0.595     5.936   41.190   41.619
LGA    Q    21_B      Q    21_A     1.748     0    0.252   0.528     2.802   68.929   68.466
LGA    C    22_B      C    22_A     0.579     0    0.084   0.191     0.835   90.476   90.476
LGA    S    23_B      S    23_A     0.464     0    0.014   0.527     1.702  100.000   93.889
LGA    A    24_B      A    24_A     0.199     0    0.052   0.082     0.393  100.000  100.000
LGA    G    25_B      G    25_A     0.290     0    0.032   0.032     0.325  100.000  100.000
LGA    P    26_B      P    26_A     0.263     0    0.022   0.305     1.314  100.000   97.347
LGA    V    27_B      V    27_A     0.428     0    0.585   0.919     3.061   85.119   78.980
LGA    G    28_B      G    28_A     1.083     0    0.082   0.082     1.357   81.429   81.429
LGA    D    29_B      D    29_A     0.991     0    0.016   0.266     1.965   88.214   83.750
LGA    D    30_B      D    30_A     0.910     0    0.057   0.194     1.052   90.476   89.345
LGA    M    31_B      M    31_A     0.375     0    0.021   0.504     0.986   97.619   94.048
LGA    F    32_B      F    32_A     0.381     0    0.034   0.041     0.568  100.000   96.537
LGA    H    33_B      H    33_A     0.377     0    0.033   0.108     0.459  100.000  100.000
LGA    W    34_B      W    34_A     0.244     0    0.022   0.066     0.463  100.000  100.000
LGA    Q    35_B      Q    35_A     0.303     0    0.019   0.171     0.729  100.000   97.884
LGA    A    36_B      A    36_A     0.310     0    0.032   0.039     0.405  100.000  100.000
LGA    T    37_B      T    37_A     0.347     0    0.000   0.309     0.696  100.000   97.279
LGA    I    38_B      I    38_A     0.344     0    0.029   0.098     0.589  100.000   98.810
LGA    M    39_B      M    39_A     0.303     0    0.033   0.724     2.528  100.000   91.250
LGA    G    40_B      G    40_A     0.154     0    0.017   0.017     0.423  100.000  100.000
LGA    P    41_B      P    41_A     0.585     0    0.026   0.051     0.668   92.857   93.197
LGA    N    42_B      N    42_A     0.780     0    0.643   0.625     2.422   84.048   82.798
LGA    D    43_B      D    43_A     1.975     0    0.017   0.926     3.539   75.119   64.464
LGA    S    44_B      S    44_A     1.094     0    0.061   0.113     1.396   83.690   85.952
LGA    P    45_B      P    45_A     0.794     0    0.015   0.040     0.822   90.476   90.476
LGA    Y    46_B      Y    46_A     0.165     0    0.066   0.114     0.404  100.000  100.000
LGA    Q    47_B      Q    47_A     0.355     0    0.015   0.964     2.111  100.000   92.011
LGA    G    48_B      G    48_A     0.395     0    0.040   0.040     0.395  100.000  100.000
LGA    G    49_B      G    49_A     0.121     0    0.046   0.046     0.240  100.000  100.000
LGA    V    50_B      V    50_A     0.318     0    0.075   0.097     0.440  100.000  100.000
LGA    F    51_B      F    51_A     0.424     0    0.061   0.116     0.467  100.000  100.000
LGA    F    52_B      F    52_A     0.314     0    0.060   0.159     0.715  100.000   97.403
LGA    L    53_B      L    53_A     0.422     0    0.031   0.062     0.473  100.000  100.000
LGA    T    54_B      T    54_A     0.413     0    0.022   1.066     2.274  100.000   89.932
LGA    I    55_B      I    55_A     0.312     0    0.086   0.096     0.667   97.619   98.810
LGA    H    56_B      H    56_A     0.206     0    0.011   1.374     6.165  100.000   72.333
LGA    F    57_B      F    57_A     0.213     0    0.023   0.143     0.548   97.619   98.268
LGA    P    58_B      P    58_A     0.369     0    0.018   0.097     0.480  100.000  100.000
LGA    T    59_B      T    59_A     0.394     0    0.024   0.215     1.057  100.000   94.626
LGA    D    60_B      D    60_A     0.520     0    0.135   0.331     1.461   97.619   92.917
LGA    Y    61_B      Y    61_A     0.420     0    0.077   0.136     0.605   95.238   97.619
LGA    P    62_B      P    62_A     0.548     0    0.025   0.035     0.677   90.476   90.476
LGA    F    63_B      F    63_A     0.696     0    0.033   0.100     1.201   90.476   87.186
LGA    K    64_B      K    64_A     0.394     0    0.008   0.683     1.439   97.619   90.635
LGA    P    65_B      P    65_A     0.294     0    0.023   0.030     0.373  100.000  100.000
LGA    P    66_B      P    66_A     0.326     0    0.028   0.068     0.462  100.000  100.000
LGA    K    67_B      K    67_A     0.081     0    0.023   0.683     1.984  100.000   87.937
LGA    V    68_B      V    68_A     0.187     0    0.019   0.048     0.283  100.000  100.000
LGA    A    69_B      A    69_A     0.282     0    0.058   0.072     0.282  100.000  100.000
LGA    F    70_B      F    70_A     0.349     0    0.077   0.079     0.491  100.000  100.000
LGA    T    71_B      T    71_A     0.447     0    0.117   0.123     0.984  100.000   95.918
LGA    T    72_B      T    72_A     0.312     0    0.031   0.058     0.425  100.000  100.000
LGA    R    73_B      R    73_A     0.323     0    0.034   1.409     6.151  100.000   71.861
LGA    I    74_B      I    74_A     0.190     0    0.014   0.088     0.345  100.000  100.000
LGA    Y    75_B      Y    75_A     0.285     0    0.025   0.054     0.722  100.000   96.032
LGA    H    76_B      H    76_A     0.171     0    0.012   0.047     0.373  100.000  100.000
LGA    P    77_B      P    77_A     0.367     0    0.072   0.079     0.411  100.000  100.000
LGA    N    78_B      N    78_A     0.695     0    0.026   0.077     0.961   90.476   90.476
LGA    I    79_B      I    79_A     0.627     0    0.014   0.104     0.675   90.476   90.476
LGA    N    80_B      N    80_A     0.642     0    0.045   0.050     0.899   90.476   90.476
LGA    S    81_B      S    81_A     0.560     0    0.025   0.155     1.136   90.476   88.968
LGA    N    82_B      N    82_A     0.678     0    0.010   0.095     1.217   90.476   89.345
LGA    G    83_B      G    83_A     0.608     0    0.020   0.020     0.635   90.476   90.476
LGA    S    84_B      S    84_A     0.623     0    0.043   0.195     0.645   90.476   92.063
LGA    I    85_B      I    85_A     0.579     0    0.040   0.121     0.774   90.476   90.476
LGA    C    86_B      C    86_A     0.728     0    0.016   0.448     1.025   90.476   90.556
LGA    L    87_B      L    87_A     0.548     0    0.015   0.120     0.712   95.238   92.857
LGA    D    88_B      D    88_A     0.528     0    0.011   0.065     1.027   90.476   89.345
LGA    I    89_B      I    89_A     0.694     0    0.059   1.597     3.531   92.857   78.274
LGA    L    90_B      L    90_A     0.393     0    0.063   0.102     0.651  100.000   95.238
LGA    R    91_B      R    91_A     0.214     0    0.103   0.955     7.527  100.000   63.810
LGA    S    92_B      S    92_A     0.621     0    0.090   0.174     0.810   90.476   90.476
LGA    Q    93_B      Q    93_A     0.725     0    0.029   0.486     1.350   90.476   88.466
LGA    W    94_B      W    94_A     0.520     0    0.049   0.080     0.789   90.476   93.878
LGA    S    95_B      S    95_A     0.639     0    0.043   0.055     0.805   92.857   92.063
LGA    P    96_B      P    96_A     0.611     0    0.028   0.032     0.879   95.238   93.197
LGA    A    97_B      A    97_A     0.303     0    0.046   0.068     0.455  100.000  100.000
LGA    L    98_B      L    98_A     0.270     0    0.021   0.139     0.844  100.000   96.429
LGA    T    99_B      T    99_A     0.283     0    0.023   0.053     0.430  100.000  100.000
LGA    I   100_B      I   100_A     0.320     0    0.040   0.109     0.534  100.000   98.810
LGA    S   101_B      S   101_A     0.397     0    0.024   0.036     0.400  100.000  100.000
LGA    K   102_B      K   102_A     0.383     0    0.026   1.026     4.925   97.619   82.434
LGA    V   103_B      V   103_A     0.309     0    0.048   0.058     0.398  100.000  100.000
LGA    L   104_B      L   104_A     0.341     0    0.042   0.064     0.364  100.000  100.000
LGA    L   105_B      L   105_A     0.382     0    0.017   0.086     0.691  100.000   97.619
LGA    S   106_B      S   106_A     0.297     0    0.030   0.027     0.355  100.000  100.000
LGA    I   107_B      I   107_A     0.282     0    0.031   0.118     0.562  100.000   98.810
LGA    C   108_B      C   108_A     0.472     0    0.037   0.076     0.569  100.000   98.413
LGA    S   109_B      S   109_A     0.366     0    0.018   0.069     0.469  100.000  100.000
LGA    L   110_B      L   110_A     0.385     0    0.019   0.052     0.587  100.000   98.810
LGA    L   111_B      L   111_A     0.474     0    0.044   0.209     0.825  100.000   97.619
LGA    C   112_B      C   112_A     0.637     0    0.046   0.087     0.702   90.476   92.063
LGA    D   113_B      D   113_A     0.632     0    0.035   0.410     1.134   90.476   89.345
LGA    P   114_B      P   114_A     0.603     0    0.072   0.100     0.729   90.476   90.476
LGA    N   115_B      N   115_A     0.758     0    0.040   1.013     3.308   90.476   79.048
LGA    P   116_B      P   116_A     0.749     0    0.033   0.110     1.029   88.214   89.184
LGA    D   117_B      D   117_A     1.046     0    0.129   0.234     1.714   85.952   82.619
LGA    D   118_B      D   118_A     1.088     0    0.040   0.231     1.144   81.429   82.560
LGA    P   119_B      P   119_A     1.023     0    0.074   0.325     1.324   85.952   85.306
LGA    L   120_B      L   120_A     0.986     0    0.026   0.167     1.183   83.690   83.690
LGA    V   121_B      V   121_A     0.964     0    0.064   0.066     1.012   90.476   89.184
LGA    P   122_B      P   122_A     0.991     0    0.017   0.031     1.463   88.214   85.306
LGA    E   123_B      E   123_A     0.654     0    0.050   0.111     0.884   95.238   93.651
LGA    I   124_B      I   124_A     0.166     0    0.018   0.076     0.354  100.000  100.000
LGA    A   125_B      A   125_A     0.364     0    0.028   0.039     0.450  100.000  100.000
LGA    R   126_B      R   126_A     0.234     0    0.044   1.589     6.669  100.000   76.623
LGA    I   127_B      I   127_A     0.314     0    0.030   0.709     2.768   97.619   91.071
LGA    Y   128_B      Y   128_A     0.454     0    0.046   0.111     0.767   95.238   94.444
LGA    K   129_B      K   129_A     0.635     0    0.047   0.598     1.655   90.476   87.513
LGA    T   130_B      T   130_A     0.570     0    0.087   0.095     1.360   90.595   93.265
LGA    D   131_B      D   131_A     0.978     0    0.036   0.083     1.797   85.952   81.548
LGA    R   132_B      R   132_A     1.146     0    0.027   0.254     1.564   81.429   80.649
LGA    E   133_B      E   133_A     1.508     0    0.024   1.269     4.548   79.286   69.841
LGA    K   134_B      K   134_A     1.335     0    0.030   1.183     6.958   81.429   64.815
LGA    Y   135_B      Y   135_A     0.840     0    0.043   0.104     1.019   88.214   90.516
LGA    N   136_B      N   136_A     0.891     0    0.000   0.076     1.059   90.476   89.345
LGA    R   137_B      R   137_A     1.092     0    0.041   1.663     9.962   83.690   48.961
LGA    I   138_B      I   138_A     0.985     0    0.026   0.111     1.317   88.214   87.083
LGA    A   139_B      A   139_A     0.611     0    0.045   0.049     0.785   90.476   90.476
LGA    R   140_B      R   140_A     0.602     0    0.021   0.714     2.122   90.476   85.714
LGA    E   141_B      E   141_A     0.775     0    0.009   0.055     1.186   90.476   86.455
LGA    W   142_B      W   142_A     0.557     0    0.046   0.122     1.350   95.238   89.286
LGA    T   143_B      T   143_A     0.337     0    0.015   0.028     0.449  100.000  100.000
LGA    Q   144_B      Q   144_A     0.523     0    0.109   0.173     1.120   90.595   90.529
LGA    K   145_B      K   145_A     0.704     0    0.044   0.415     1.812   90.476   86.508
LGA    Y   146_B      Y   146_A     0.563     0    0.017   0.130     0.621   90.476   96.825
LGA    A   147_B      A   147_A     0.514     0    0.135   0.142     0.677   92.857   94.286
LGA    M   148_B      M   148_A     0.614     0    0.706   0.630     2.852   82.143   86.310
LGA    G   149_B      G   149_A     1.747     0    0.554   0.554     2.588   73.333   73.333
LGA    V   174_B      V   174_A    70.501     0    0.117   0.976    71.575    0.000    0.000
LGA    N   175_B      N   175_A    68.647     0    0.022   0.915    69.617    0.000    0.000
LGA    A   176_B      A   176_A    67.343     0    0.019   0.030    68.291    0.000    0.000
LGA    D   177_B      D   177_A    66.158     0    0.051   1.051    69.049    0.000    0.000
LGA    V   178_B      V   178_A    64.791     0    0.037   0.061    66.660    0.000    0.000
LGA    Q   179_B      Q   179_A    63.056     0    0.167   0.877    65.835    0.000    0.000
LGA    K   180_B      K   180_A    62.178     0    0.010   0.416    66.069    0.000    0.000
LGA    L   181_B      L   181_A    61.261     0    0.036   0.286    64.081    0.000    0.000
LGA    Q   182_B      Q   182_A    59.949     0    0.031   0.239    62.563    0.000    0.000
LGA    Q   183_B      Q   183_A    58.515     0    0.031   1.062    59.575    0.000    0.000
LGA    Q   184_B      Q   184_A    57.740     0    0.026   0.172    60.230    0.000    0.000
LGA    L   185_B      L   185_A    57.273     0    0.006   0.067    59.764    0.000    0.000
LGA    Q   186_B      Q   186_A    55.844     0    0.050   0.862    56.538    0.000    0.000
LGA    D   187_B      D   187_A    54.545     0    0.131   1.202    59.058    0.000    0.000
LGA    I   188_B      I   188_A    54.202     0    0.011   0.162    56.325    0.000    0.000
LGA    K   189_B      K   189_A    53.989     0    0.048   0.825    60.217    0.000    0.000
LGA    E   190_B      E   190_A    52.525     0    0.030   0.104    53.953    0.000    0.000
LGA    Q   191_B      Q   191_A    51.730     0    0.053   0.438    53.251    0.000    0.000
LGA    T   192_B      T   192_A    52.409     0    0.074   0.157    53.984    0.000    0.000
LGA    M   193_B      M   193_A    52.761     0    0.075   0.669    56.013    0.000    0.000
LGA    C   194_B      C   194_A    51.995     0    0.082   0.093    52.334    0.000    0.000
LGA    P   195_B      P   195_A    50.976     0    0.022   0.036    51.255    0.000    0.000
LGA    V   196_B      V   196_A    51.105     0    0.015   0.066    51.460    0.000    0.000
LGA    C   197_B      C   197_A    52.355     0    0.041   0.076    53.173    0.000    0.000
LGA    L   198_B      L   198_A    52.697     0    0.050   0.665    53.974    0.000    0.000
LGA    D   199_B      D   199_A    54.261     0    0.074   0.361    56.258    0.000    0.000
LGA    R   200_B      R   200_A    54.397     0    0.064   1.198    56.125    0.000    0.000
LGA    L   201_B      L   201_A    53.604     0    0.045   0.216    54.737    0.000    0.000
LGA    K   202_B      K   202_A    52.283     0    0.012   0.581    52.920    0.000    0.000
LGA    N   203_B      N   203_A    53.128     0    0.083   0.095    54.464    0.000    0.000
LGA    M   204_B      M   204_A    52.645     0    0.017   0.096    54.161    0.000    0.000
LGA    I   205_B      I   205_A    51.317     0    0.033   0.085    52.028    0.000    0.000
LGA    F   206_B      F   206_A    51.559     0    0.020   0.113    52.274    0.000    0.000
LGA    L   207_B      L   207_A    51.504     0    0.040   0.099    53.244    0.000    0.000
LGA    C   208_B      C   208_A    50.595     0    0.033   0.043    50.946    0.000    0.000
LGA    G   209_B      G   209_A    49.718     0    0.022   0.022    50.017    0.000    0.000
LGA    H   210_B      H   210_A    49.884     0    0.072   0.144    50.810    0.000    0.000
LGA    G   211_B      G   211_A    50.707     0    0.067   0.067    50.845    0.000    0.000
LGA    T   212_B      T   212_A    51.470     0    0.023   0.127    52.132    0.000    0.000
LGA    C   213_B      C   213_A    52.962     0    0.055   0.093    53.428    0.000    0.000
LGA    Q   214_B      Q   214_A    54.073     0    0.078   0.171    56.911    0.000    0.000
LGA    L   215_B      L   215_A    54.523     0    0.101   1.289    57.244    0.000    0.000
LGA    C   216_B      C   216_A    52.590     0    0.069   0.117    53.188    0.000    0.000
LGA    G   217_B      G   217_A    52.265     0    0.022   0.022    52.781    0.000    0.000
LGA    D   218_B      D   218_A    54.148     0    0.062   0.076    56.076    0.000    0.000
LGA    R   219_B      R   219_A    53.672     0    0.043   1.137    56.032    0.000    0.000
LGA    M   220_B      M   220_A    52.831     0    0.056   0.598    53.123    0.000    0.000
LGA    S   221_B      S   221_A    53.611     0    0.035   0.087    54.327    0.000    0.000
LGA    E   222_B      E   222_A    52.287     0    0.039   0.842    52.699    0.000    0.000
LGA    C   223_B      C   223_A    50.874     0    0.041   0.060    51.368    0.000    0.000
LGA    P   224_B      P   224_A    50.242     0    0.037   0.177    50.432    0.000    0.000
LGA    I   225_B      I   225_A    49.466     0    0.043   0.526    49.789    0.000    0.000
LGA    C   226_B      C   226_A    50.035     0    0.053   0.054    50.460    0.000    0.000
LGA    R   227_B      R   227_A    50.920     0    0.086   1.056    51.590    0.000    0.000
LGA    K   228_B      K   228_A    51.700     0    0.040   0.524    52.065    0.000    0.000
LGA    A   229_B      A   229_A    52.987     0    0.012   0.024    53.577    0.000    0.000
LGA    I   230_B      I   230_A    53.018     0    0.035   0.071    54.500    0.000    0.000
LGA    E   231_B      E   231_A    54.302     0    0.027   0.149    55.218    0.000    0.000
LGA    R   232_B      R   232_A    53.808     0    0.022   0.266    54.641    0.000    0.000
LGA    R   233_B      R   233_A    53.466     0    0.057   1.071    55.193    0.000    0.000
LGA    I   234_B      I   234_A    53.309     0    0.044   1.038    53.421    0.000    0.000
LGA    L   235_B      L   235_A    54.168     0    0.044   1.139    57.986    0.000    0.000
LGA    L   236_B      L   236_A    53.552     0    0.060   0.180    55.206    0.000    0.000
LGA    Y   237_B      Y   237_A    55.787     0    0.076   0.186    57.049    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):    19.975         19.958                 20.447           65.280   63.183

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  237  213    4.0    149    0.76    67.958    66.097    17.260

LGA_LOCAL      RMSD:   0.763  Number of atoms:  149  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  30.028  Number of assigned atoms:  213 
Std_ASGN_ATOMS RMSD:  19.975  Standard rmsd on all 213 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.743374 * X  +   0.564621 * Y  +  -0.358606 * Z  +   5.122772
  Y_new =   0.616104 * X  +  -0.786725 * Y  +   0.038466 * Z  +   5.200761
  Z_new =  -0.260405 * X  +  -0.249533 * Y  +  -0.932696 * Z  +  66.157059 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  0.692053  0.263442 -2.880175   [DEG:   39.6517   15.0941 -165.0219 ]
ZXZ: -1.677653  2.772614 -2.334877   [DEG:  -96.1225  158.8591 -133.7786 ]
 
# END of job
