
#######################################################
#                                                     #
#                        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  142 ( 1166),  selected  132 , name one
# Molecule2: number of CA atoms  132 ( 1073),  selected  132 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:A  -ch2:A  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   132       3_A - 134_A       0.61     0.61
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   132       3_A - 134_A       0.61     0.61
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   132       3_A - 134_A       0.61     0.61
  LCS_AVERAGE:    100.00

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  132
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     D     3_A     D     3_A    132  132  132      3   61  119  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     V     4_A     V     4_A    132  132  132     24  108  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     D     5_A     D     5_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     K     6_A     K     6_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     R     7_A     R     7_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     K     8_A     K     8_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     I     9_A     I     9_A    132  132  132     70  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     K    10_A     K    10_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     I    11_A     I    11_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     I    12_A     I    12_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     L    13_A     L    13_A    132  132  132     80  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     N    14_A     N    14_A    132  132  132      7   31  119  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     G    15_A     G    15_A    132  132  132     75  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     E    16_A     E    16_A    132  132  132     20  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     M    17_A     M    17_A    132  132  132     63  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     E    18_A     E    18_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     E    19_A     E    19_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     A    20_A     A    20_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     E    21_A     E    21_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     L    22_A     L    22_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     H    23_A     H    23_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     M    24_A     M    24_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     I    25_A     I    25_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     T    26_A     T    26_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     S    27_A     S    27_A    132  132  132     62  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     P    28_A     P    28_A    132  132  132     37   99  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     N    29_A     N    29_A    132  132  132     34  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     R    30_A     R    30_A    132  132  132     37  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     H    31_A     H    31_A    132  132  132     26  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     C    32_A     C    32_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     C    33_A     C    33_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     L    34_A     L    34_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     K    35_A     K    35_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     I    36_A     I    36_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     F    37_A     F    37_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     H    38_A     H    38_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     N    39_A     N    39_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     N    40_A     N    40_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     N    41_A     N    41_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     Q    42_A     Q    42_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     L    43_A     L    43_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     A    44_A     A    44_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     E    45_A     E    45_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     S    46_A     S    46_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     N    47_A     N    47_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     D    48_A     D    48_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     T    49_A     T    49_A    132  132  132     52  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     D    50_A     D    50_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     Y    51_A     Y    51_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     F    52_A     F    52_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     S    53_A     S    53_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     C    54_A     C    54_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     F    55_A     F    55_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     A    56_A     A    56_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     D    57_A     D    57_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     L    58_A     L    58_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     R    59_A     R    59_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     N    60_A     N    60_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     Q    61_A     Q    61_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     L    62_A     L    62_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     K    63_A     K    63_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     N    64_A     N    64_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     I    65_A     I    65_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     I    66_A     I    66_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     F    67_A     F    67_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     L    68_A     L    68_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     C    69_A     C    69_A    132  132  132     62  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     K    70_A     K    70_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     G    71_A     G    71_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     A    72_A     A    72_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     K    73_A     K    73_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     I    74_A     I    74_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     N    75_A     N    75_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     V    76_A     V    76_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     Y    77_A     Y    77_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     P    78_A     P    78_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     S    79_A     S    79_A    132  132  132     63  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     A    80_A     A    80_A    132  132  132     61  115  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     M    81_A     M    81_A    132  132  132     63  117  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     S    82_A     S    82_A    132  132  132     63  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     R    83_A     R    83_A    132  132  132     47  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     D    84_A     D    84_A    132  132  132     47  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     M    85_A     M    85_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     S    86_A     S    86_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     D    87_A     D    87_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     G    88_A     G    88_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     I    89_A     I    89_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     V    90_A     V    90_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     A    91_A     A    91_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     Y    92_A     Y    92_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     E    93_A     E    93_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     T    94_A     T    94_A    132  132  132     75  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     T    95_A     T    95_A    132  132  132     84  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     L    96_A     L    96_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     G    97_A     G    97_A    132  132  132     61  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     Q    98_A     Q    98_A    132  132  132      9  120  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     P    99_A     P    99_A    132  132  132     11  122  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     G   100_A     G   100_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     L   101_A     L   101_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     P   102_A     P   102_A    132  132  132     83  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     E   103_A     E   103_A    132  132  132     47  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     N   104_A     N   104_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     Q   105_A     Q   105_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     V   106_A     V   106_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     H   107_A     H   107_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     I   108_A     I   108_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     F   109_A     F   109_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     D   110_A     D   110_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     F   111_A     F   111_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     E   112_A     E   112_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     D   113_A     D   113_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     K   114_A     K   114_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     Y   115_A     Y   115_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     V   116_A     V   116_A    132  132  132     85  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     D   117_A     D   117_A    132  132  132     47  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     I   118_A     I   118_A    132  132  132     62  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     T   119_A     T   119_A    132  132  132     62  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     P   120_A     P   120_A    132  132  132     62  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     E   121_A     E   121_A    132  132  132     62  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     E   122_A     E   122_A    132  132  132     70  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     Q   123_A     Q   123_A    132  132  132     84  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     R   124_A     R   124_A    132  132  132     70  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     K   125_A     K   125_A    132  132  132     62  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     F   126_A     F   126_A    132  132  132     79  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     H   127_A     H   127_A    132  132  132     62  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     S   128_A     S   128_A    132  132  132     62  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     Q   129_A     Q   129_A    132  132  132     62  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     W   130_A     W   130_A    132  132  132     44  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     F   131_A     F   131_A    132  132  132     62  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     E   132_A     E   132_A    132  132  132     62  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     S   133_A     S   133_A    132  132  132     62  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     L   134_A     L   134_A    132  132  132     62  124  130  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_AVERAGE  LCS_A: 100.00  ( 100.00  100.00  100.00 )

GLOBAL_DISTANCE_TEST (summary information about detected largest sets of residues (represented by selected AToms) that can fit under specified thresholds)
GDT DIST_CUTOFF  0.50   1.00   1.50   2.00   2.50   3.00   3.50   4.00   4.50   5.00   5.50   6.00   6.50   7.00   7.50   8.00   8.50   9.00   9.50  10.00
GDT NUMBER_AT     85    124    130    132    132    132    132    132    132    132    132    132    132    132    132    132    132    132    132    132 
GDT PERCENT_AT  64.39  93.94  98.48 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00
GDT RMS_LOCAL    0.31   0.50   0.56   0.61   0.61   0.61   0.61   0.61   0.61   0.61   0.61   0.61   0.61   0.61   0.61   0.61   0.61   0.61   0.61   0.61
GDT RMS_ALL_AT   0.64   0.61   0.61   0.61   0.61   0.61   0.61   0.61   0.61   0.61   0.61   0.61   0.61   0.61   0.61   0.61   0.61   0.61   0.61   0.61

# Checking swapping
#   possible swapping detected:  D     5_A      D     5_A
#   possible swapping detected:  E    16_A      E    16_A
#   possible swapping detected:  E    18_A      E    18_A
#   possible swapping detected:  E    21_A      E    21_A
#   possible swapping detected:  F    37_A      F    37_A
#   possible swapping detected:  E    45_A      E    45_A
#   possible swapping detected:  F    52_A      F    52_A
#   possible swapping detected:  F    55_A      F    55_A
#   possible swapping detected:  F    67_A      F    67_A
#   possible swapping detected:  Y    77_A      Y    77_A
#   possible swapping detected:  D    87_A      D    87_A
#   possible swapping detected:  Y    92_A      Y    92_A
#   possible swapping detected:  E    93_A      E    93_A
#   possible swapping detected:  E   103_A      E   103_A
#   possible swapping detected:  F   111_A      F   111_A
#   possible swapping detected:  E   112_A      E   112_A
#   possible swapping detected:  E   122_A      E   122_A
#   possible swapping detected:  E   132_A      E   132_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    D     3_A      D     3_A     2.048     3    0.018   0.033     2.734   75.119   44.702
LGA    V     4_A      V     4_A     1.101     0    0.076   0.138     1.662   77.143   78.980
LGA    D     5_A      D     5_A     0.184     0    0.043   0.875     3.227  100.000   83.095
LGA    K     6_A      K     6_A     0.402     0    0.092   0.207     0.852   97.619   96.825
LGA    R     7_A      R     7_A     0.231     0    0.034   0.602     2.017  100.000   87.706
LGA    K     8_A      K     8_A     0.341     0    0.019   0.409     2.205   97.619   87.831
LGA    I     9_A      I     9_A     0.646     0    0.106   1.141     2.750   92.857   81.071
LGA    K    10_A      K    10_A     0.264     0    0.027   0.146     0.562  100.000   98.942
LGA    I    11_A      I    11_A     0.234     0    0.022   0.052     0.514  100.000   98.810
LGA    I    12_A      I    12_A     0.246     0    0.047   0.073     0.728   97.619   96.429
LGA    L    13_A      L    13_A     0.730     0    0.079   1.005     2.502   88.333   83.214
LGA    N    14_A      N    14_A     2.015     0    0.095   0.139     3.685   70.833   60.476
LGA    G    15_A      G    15_A     0.857     0    0.020   0.020     1.224   88.214   88.214
LGA    E    16_A      E    16_A     0.965     0    0.066   0.816     2.529   90.476   79.947
LGA    M    17_A      M    17_A     0.591     0    0.067   0.679     1.846   88.214   83.750
LGA    E    18_A      E    18_A     0.433     0    0.056   0.815     2.249  100.000   91.852
LGA    E    19_A      E    19_A     0.374     0    0.053   0.088     0.975   97.619   93.651
LGA    A    20_A      A    20_A     0.230     0    0.053   0.061     0.424  100.000  100.000
LGA    E    21_A      E    21_A     0.285     0    0.009   0.111     0.708  100.000   97.884
LGA    L    22_A      L    22_A     0.125     0    0.054   0.064     0.210  100.000  100.000
LGA    H    23_A      H    23_A     0.277     0    0.067   0.076     0.538   97.619   98.095
LGA    M    24_A      M    24_A     0.190     0    0.043   0.963     3.200  100.000   91.369
LGA    I    25_A      I    25_A     0.411     0    0.017   0.418     1.193  100.000   97.679
LGA    T    26_A      T    26_A     0.445     0    0.022   0.067     0.668  100.000   98.639
LGA    S    27_A      S    27_A     0.739     0    0.066   0.761     3.875   90.476   81.111
LGA    P    28_A      P    28_A     1.590     0    0.670   0.596     4.304   64.048   71.565
LGA    N    29_A      N    29_A     0.771     0    0.089   0.994     2.541   88.214   82.976
LGA    R    30_A      R    30_A     0.884     0    0.049   1.087     4.023   90.476   73.160
LGA    H    31_A      H    31_A     0.907     0    0.050   1.529     6.736   92.857   58.714
LGA    C    32_A      C    32_A     0.306     0    0.047   0.102     0.565   97.619   98.413
LGA    C    33_A      C    33_A     0.162     0    0.021   0.061     0.318  100.000  100.000
LGA    L    34_A      L    34_A     0.172     0    0.031   0.069     0.284  100.000  100.000
LGA    K    35_A      K    35_A     0.243     0    0.035   0.184     1.264  100.000   96.878
LGA    I    36_A      I    36_A     0.190     0    0.016   0.051     0.202  100.000  100.000
LGA    F    37_A      F    37_A     0.108     0    0.027   0.050     0.227  100.000  100.000
LGA    H    38_A      H    38_A     0.190     0    0.025   0.087     0.632  100.000   98.095
LGA    N    39_A      N    39_A     0.588     0    0.036   1.111     3.359   92.857   84.345
LGA    N    40_A      N    40_A     0.328     0    0.048   1.035     2.207  100.000   91.190
LGA    N    41_A      N    41_A     0.376     0    0.026   1.000     4.644  100.000   79.821
LGA    Q    42_A      Q    42_A     0.337     0    0.039   0.108     0.743   97.619   98.942
LGA    L    43_A      L    43_A     0.310     0    0.063   0.272     1.556  100.000   94.226
LGA    A    44_A      A    44_A     0.329     0    0.034   0.047     0.355  100.000  100.000
LGA    E    45_A      E    45_A     0.406     0    0.024   0.423     1.342  100.000   96.878
LGA    S    46_A      S    46_A     0.407     0    0.038   0.116     0.756  100.000   96.825
LGA    N    47_A      N    47_A     0.033     0    0.028   0.110     0.331  100.000  100.000
LGA    D    48_A      D    48_A     0.279     0    0.056   0.191     0.829  100.000   97.619
LGA    T    49_A      T    49_A     0.727     0    0.106   0.104     1.732   95.238   88.095
LGA    D    50_A      D    50_A     0.316     0    0.040   0.282     0.662  100.000   97.619
LGA    Y    51_A      Y    51_A     0.369     0    0.036   0.092     1.091   97.619   95.278
LGA    F    52_A      F    52_A     0.516     0    0.024   0.040     0.599   95.238   92.208
LGA    S    53_A      S    53_A     0.542     0    0.041   0.069     0.610   90.476   93.651
LGA    C    54_A      C    54_A     0.599     0    0.015   0.090     0.646   90.476   92.063
LGA    F    55_A      F    55_A     0.432     0    0.017   0.261     1.262   97.619   95.714
LGA    A    56_A      A    56_A     0.410     0    0.018   0.028     0.506  100.000   98.095
LGA    D    57_A      D    57_A     0.452     0    0.035   0.330     0.975  100.000   96.429
LGA    L    58_A      L    58_A     0.411     0    0.014   1.265     3.216  100.000   88.036
LGA    R    59_A      R    59_A     0.441     0    0.017   0.736     2.689   97.619   84.589
LGA    N    60_A      N    60_A     0.566     0    0.022   0.888     3.089   97.619   83.571
LGA    Q    61_A      Q    61_A     0.381     0    0.118   0.190     0.537   97.619   98.942
LGA    L    62_A      L    62_A     0.235     0    0.086   0.079     0.329  100.000  100.000
LGA    K    63_A      K    63_A     0.210     0    0.026   0.605     2.023  100.000   93.968
LGA    N    64_A      N    64_A     0.342     0    0.013   0.050     0.757   97.619   95.238
LGA    I    65_A      I    65_A     0.597     0    0.049   0.073     0.699   90.476   90.476
LGA    I    66_A      I    66_A     0.490     0    0.029   0.046     0.645   97.619   95.238
LGA    F    67_A      F    67_A     0.243     0    0.025   0.068     0.807  100.000   96.537
LGA    L    68_A      L    68_A     0.244     0    0.057   0.067     0.432  100.000  100.000
LGA    C    69_A      C    69_A     0.518     0    0.049   0.791     2.521   97.619   89.683
LGA    K    70_A      K    70_A     0.447     0    0.026   0.059     0.835  100.000   95.767
LGA    G    71_A      G    71_A     0.304     0    0.044   0.044     0.408  100.000  100.000
LGA    A    72_A      A    72_A     0.383     0    0.054   0.067     0.383  100.000  100.000
LGA    K    73_A      K    73_A     0.324     0    0.023   0.104     0.510  100.000   98.942
LGA    I    74_A      I    74_A     0.263     0    0.024   0.411     1.893  100.000   96.607
LGA    N    75_A      N    75_A     0.289     0    0.016   0.146     0.980  100.000   97.619
LGA    V    76_A      V    76_A     0.304     0    0.070   0.096     0.582   97.619   97.279
LGA    Y    77_A      Y    77_A     0.327     0    0.048   0.193     0.525  100.000   99.206
LGA    P    78_A      P    78_A     0.404     0    0.073   0.291     1.219   92.976   93.265
LGA    S    79_A      S    79_A     1.038     0    0.050   0.056     1.140   88.214   85.952
LGA    A    80_A      A    80_A     1.306     0    0.024   0.037     1.633   81.429   79.714
LGA    M    81_A      M    81_A     1.190     0    0.010   0.153     1.780   85.952   81.548
LGA    S    82_A      S    82_A     0.874     0    0.017   0.572     1.438   90.476   87.460
LGA    R    83_A      R    83_A     0.860     0    0.023   0.718     1.476   90.476   87.229
LGA    D    84_A      D    84_A     0.674     0    0.125   0.747     2.292   92.857   85.119
LGA    M    85_A      M    85_A     0.213     0    0.015   0.173     0.914   97.619   96.429
LGA    S    86_A      S    86_A     0.231     0    0.026   0.050     0.391  100.000  100.000
LGA    D    87_A      D    87_A     0.253     0    0.022   0.172     0.984  100.000   96.429
LGA    G    88_A      G    88_A     0.189     0    0.027   0.027     0.282  100.000  100.000
LGA    I    89_A      I    89_A     0.280     0    0.014   0.669     2.181  100.000   95.595
LGA    V    90_A      V    90_A     0.374     0    0.023   0.073     0.571  100.000   98.639
LGA    A    91_A      A    91_A     0.356     0    0.056   0.078     0.389  100.000  100.000
LGA    Y    92_A      Y    92_A     0.399     0    0.045   0.099     0.809  100.000   97.619
LGA    E    93_A      E    93_A     0.186     0    0.095   0.838     2.564   97.619   85.132
LGA    T    94_A      T    94_A     0.544     0    0.024   0.074     0.851   97.619   94.558
LGA    T    95_A      T    95_A     0.453     0    0.020   0.064     0.912   97.619   94.558
LGA    L    96_A      L    96_A     0.473     0    0.070   1.395     5.499   95.357   73.631
LGA    G    97_A      G    97_A     0.894     0    0.024   0.024     1.453   88.333   88.333
LGA    Q    98_A      Q    98_A     1.147     0    0.009   0.154     1.487   83.690   82.434
LGA    P    99_A      P    99_A     1.049     0    0.019   0.028     1.550   85.952   81.565
LGA    G   100_A      G   100_A     0.258     0    0.100   0.100     0.570   97.619   97.619
LGA    L   101_A      L   101_A     0.382     0    0.010   0.099     0.613  100.000   98.810
LGA    P   102_A      P   102_A     0.689     0    0.009   0.026     0.925   90.476   90.476
LGA    E   103_A      E   103_A     0.614     0    0.025   0.111     0.852   92.857   92.593
LGA    N   104_A      N   104_A     0.335     0    0.026   0.229     0.527  100.000   98.810
LGA    Q   105_A      Q   105_A     0.289     0    0.066   0.172     0.933  100.000   97.884
LGA    V   106_A      V   106_A     0.289     0    0.035   0.041     0.537  100.000   98.639
LGA    H   107_A      H   107_A     0.313     0    0.031   0.040     0.374  100.000  100.000
LGA    I   108_A      I   108_A     0.378     0    0.073   0.097     0.575   97.619   98.810
LGA    F   109_A      F   109_A     0.344     0    0.063   0.086     0.379  100.000  100.000
LGA    D   110_A      D   110_A     0.515     0    0.049   0.114     1.093   95.238   91.726
LGA    F   111_A      F   111_A     0.241     0    0.029   0.114     0.534   97.619   99.134
LGA    E   112_A      E   112_A     0.387     0    0.013   0.103     0.672  100.000   97.884
LGA    D   113_A      D   113_A     0.460     0    0.057   0.119     0.727   95.238   96.429
LGA    K   114_A      K   114_A     0.436     0    0.053   0.862     2.915  100.000   89.101
LGA    Y   115_A      Y   115_A     0.492     0    0.023   0.244     1.940  100.000   86.984
LGA    V   116_A      V   116_A     0.195     0    0.043   0.061     0.510   97.619   98.639
LGA    D   117_A      D   117_A     0.658     0    0.015   0.152     1.025   90.476   88.214
LGA    I   118_A      I   118_A     0.612     0    0.020   0.141     0.694   90.476   90.476
LGA    T   119_A      T   119_A     0.726     0    0.035   0.070     0.783   90.476   90.476
LGA    P   120_A      P   120_A     0.674     0    0.024   0.044     0.768   90.476   90.476
LGA    E   121_A      E   121_A     0.732     0    0.018   0.134     0.841   90.476   90.476
LGA    E   122_A      E   122_A     0.688     0    0.047   0.367     1.479   90.476   88.466
LGA    Q   123_A      Q   123_A     0.513     0    0.010   0.153     0.565   90.476   95.767
LGA    R   124_A      R   124_A     0.659     0    0.024   0.118     1.045   90.476   89.654
LGA    K   125_A      K   125_A     0.745     0    0.035   1.291     5.537   90.476   71.164
LGA    F   126_A      F   126_A     0.578     0    0.019   0.165     0.935   90.476   92.208
LGA    H   127_A      H   127_A     0.638     0    0.011   1.154     2.253   90.476   82.667
LGA    S   128_A      S   128_A     0.795     0    0.046   0.173     0.938   90.476   90.476
LGA    Q   129_A      Q   129_A     0.826     0    0.017   0.150     1.470   90.476   87.460
LGA    W   130_A      W   130_A     0.786     0    0.037   0.078     0.835   90.476   90.476
LGA    F   131_A      F   131_A     0.834     0    0.039   1.178     4.712   90.476   73.896
LGA    E   132_A      E   132_A     0.771     0    0.133   1.039     4.327   88.214   74.603
LGA    S   133_A      S   133_A     0.747     0    0.080   0.126     0.747   90.476   92.063
LGA    L   134_A      L   134_A     0.796     0    0.151   0.186     1.182   90.476   87.083

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      132     528    528  100.00    1073   1073  100.00               132
SUMMARY(RMSD_GDC):     0.610          0.629                  1.058           95.233   91.330

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  142  132    4.0    132    0.61    98.485    99.409    18.602

LGA_LOCAL      RMSD:   0.610  Number of atoms:  132  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   0.610  Number of assigned atoms:  132 
Std_ASGN_ATOMS RMSD:   0.610  Standard rmsd on all 132 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.021811 * X  +   0.933946 * Y  +  -0.356747 * Z  + -12.960197
  Y_new =   0.949785 * X  +  -0.092052 * Y  +  -0.299058 * Z  +  10.638561
  Z_new =  -0.312143 * X  +  -0.345356 * Y  +  -0.885040 * Z  +  -0.802542 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  1.593757  0.317448 -2.769550   [DEG:   91.3155   18.1884 -158.6835 ]
ZXZ: -0.873140  2.657377 -2.406665   [DEG:  -50.0272  152.2565 -137.8917 ]
 
# END of job
