
#######################################################
#                                                     #
#                        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       0.59     0.59
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   132       3_A - 134_A       0.59     0.59
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   132       3_A - 134_A       0.59     0.59
  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   59  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     42  120  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     88  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      6   50  129  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     12  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     41  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     76  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     89  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     92  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     92  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     92  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     92  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     92  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     92  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     88  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     92  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     77  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     43  115  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     53  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     50  116  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     25  117  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     88  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     27  116  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     88  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     86  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     88  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     74  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     74  124  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     74  124  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     54  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     20  120  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     39  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     89  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     92  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     92  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     92  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     88  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     92  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     92  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     92  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     92  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     92  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     92  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     74  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     92  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     88  124  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     83  124  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     92  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     88  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     92  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     92  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     89  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     89  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     92  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     92  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     92  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     92  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     92  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     92  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     88  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     88  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     92  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     83  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     83  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     88  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     88  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     92  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     92  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     92  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     92    124    130    132    132    132    132    132    132    132    132    132    132    132    132    132    132    132    132    132 
GDT PERCENT_AT  69.70  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    0.32   0.47   0.53   0.59   0.59   0.59   0.59   0.59   0.59   0.59   0.59   0.59   0.59   0.59   0.59   0.59   0.59   0.59   0.59   0.59
GDT RMS_ALL_AT   0.60   0.59   0.59   0.59   0.59   0.59   0.59   0.59   0.59   0.59   0.59   0.59   0.59   0.59   0.59   0.59   0.59   0.59   0.59   0.59

# Checking swapping
#   possible swapping detected:  E    16_A      E    16_A
#   possible swapping detected:  E    18_A      E    18_A
#   possible swapping detected:  E    45_A      E    45_A
#   possible swapping detected:  D    48_A      D    48_A
#   possible swapping detected:  D    50_A      D    50_A
#   possible swapping detected:  Y    51_A      Y    51_A
#   possible swapping detected:  D    57_A      D    57_A
#   possible swapping detected:  D    84_A      D    84_A
#   possible swapping detected:  E    93_A      E    93_A
#   possible swapping detected:  E   103_A      E   103_A
#   possible swapping detected:  F   109_A      F   109_A
#   possible swapping detected:  D   110_A      D   110_A
#   possible swapping detected:  E   112_A      E   112_A
#   possible swapping detected:  D   113_A      D   113_A
#   possible swapping detected:  Y   115_A      Y   115_A
#   possible swapping detected:  D   117_A      D   117_A
#   possible swapping detected:  E   122_A      E   122_A
#   possible swapping detected:  F   126_A      F   126_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     2.216     3    0.040   0.041     2.590   70.952   42.619
LGA    V     4_A      V     4_A     1.175     0    0.024   0.092     1.668   77.143   76.531
LGA    D     5_A      D     5_A     0.243     0    0.115   0.892     2.913  100.000   85.893
LGA    K     6_A      K     6_A     0.398     0    0.025   0.077     0.515  100.000   97.884
LGA    R     7_A      R     7_A     0.362     0    0.045   0.525     1.956  100.000   86.797
LGA    K     8_A      K     8_A     0.312     0    0.019   0.337     1.003  100.000   94.762
LGA    I     9_A      I     9_A     0.319     0    0.014   0.043     0.520  100.000   98.810
LGA    K    10_A      K    10_A     0.291     0    0.017   0.829     3.974  100.000   86.614
LGA    I    11_A      I    11_A     0.161     0    0.021   0.041     0.390  100.000  100.000
LGA    I    12_A      I    12_A     0.256     0    0.046   0.112     0.712   97.619   96.429
LGA    L    13_A      L    13_A     0.734     0    0.034   0.951     2.528   88.333   83.036
LGA    N    14_A      N    14_A     2.062     0    0.010   0.096     3.630   68.810   59.464
LGA    G    15_A      G    15_A     1.130     0    0.044   0.044     1.450   83.690   83.690
LGA    E    16_A      E    16_A     1.096     0    0.050   0.380     1.704   85.952   82.540
LGA    M    17_A      M    17_A     0.642     0    0.004   0.660     1.892   88.214   83.750
LGA    E    18_A      E    18_A     0.444     0    0.046   0.306     1.655  100.000   92.751
LGA    E    19_A      E    19_A     0.418     0    0.017   0.167     0.925  100.000   95.767
LGA    A    20_A      A    20_A     0.292     0    0.029   0.034     0.388  100.000  100.000
LGA    E    21_A      E    21_A     0.125     0    0.019   0.252     0.947  100.000   96.825
LGA    L    22_A      L    22_A     0.115     0    0.034   0.064     0.258  100.000  100.000
LGA    H    23_A      H    23_A     0.181     0    0.106   0.132     0.519  100.000   99.048
LGA    M    24_A      M    24_A     0.195     0    0.039   0.994     3.457  100.000   92.560
LGA    I    25_A      I    25_A     0.609     0    0.066   0.349     1.022   90.476   89.345
LGA    T    26_A      T    26_A     0.532     0    0.039   0.054     0.593   90.476   90.476
LGA    S    27_A      S    27_A     0.834     0    0.022   0.734     4.158   88.214   77.143
LGA    P    28_A      P    28_A     1.465     0    0.638   0.572     4.096   70.476   76.531
LGA    N    29_A      N    29_A     0.908     0    0.096   1.067     2.977   85.952   80.714
LGA    R    30_A      R    30_A     1.249     0    0.071   1.097     5.351   81.429   64.113
LGA    H    31_A      H    31_A     1.243     0    0.097   1.409     7.145   88.214   54.476
LGA    C    32_A      C    32_A     0.609     0    0.087   0.128     0.952   95.238   93.651
LGA    C    33_A      C    33_A     0.513     0    0.028   0.033     0.582   95.238   93.651
LGA    L    34_A      L    34_A     0.101     0    0.028   0.088     0.464  100.000  100.000
LGA    K    35_A      K    35_A     0.169     0    0.039   0.092     0.959  100.000   96.825
LGA    I    36_A      I    36_A     0.223     0    0.028   0.072     0.584  100.000   98.810
LGA    F    37_A      F    37_A     0.184     0    0.011   0.065     0.511  100.000   99.134
LGA    H    38_A      H    38_A     0.127     0    0.054   0.124     0.655  100.000   98.095
LGA    N    39_A      N    39_A     0.659     0    0.051   1.112     3.209   95.238   85.536
LGA    N    40_A      N    40_A     0.311     0    0.018   1.037     2.370  100.000   92.202
LGA    N    41_A      N    41_A     0.268     0    0.053   0.958     4.272  100.000   80.536
LGA    Q    42_A      Q    42_A     0.240     0    0.030   0.035     0.564  100.000   98.942
LGA    L    43_A      L    43_A     0.160     0    0.053   0.300     1.540  100.000   94.226
LGA    A    44_A      A    44_A     0.214     0    0.033   0.046     0.306  100.000  100.000
LGA    E    45_A      E    45_A     0.311     0    0.031   0.240     0.885  100.000   98.942
LGA    S    46_A      S    46_A     0.273     0    0.017   0.039     0.442  100.000  100.000
LGA    N    47_A      N    47_A     0.265     0    0.033   0.052     0.446  100.000  100.000
LGA    D    48_A      D    48_A     0.494     0    0.039   0.122     0.910   95.238   92.857
LGA    T    49_A      T    49_A     1.236     0    0.118   0.111     2.564   88.214   79.388
LGA    D    50_A      D    50_A     0.342     0    0.067   0.450     1.006   97.619   95.298
LGA    Y    51_A      Y    51_A     0.222     0    0.051   0.156     1.271  100.000   95.278
LGA    F    52_A      F    52_A     0.366     0    0.008   0.048     0.484  100.000  100.000
LGA    S    53_A      S    53_A     0.316     0    0.019   0.042     0.350  100.000  100.000
LGA    C    54_A      C    54_A     0.379     0    0.009   0.051     0.574  100.000   98.413
LGA    F    55_A      F    55_A     0.239     0    0.019   0.222     1.191  100.000   96.580
LGA    A    56_A      A    56_A     0.224     0    0.018   0.018     0.310  100.000  100.000
LGA    D    57_A      D    57_A     0.290     0    0.010   0.382     1.010  100.000   96.488
LGA    L    58_A      L    58_A     0.326     0    0.008   1.282     3.043  100.000   88.036
LGA    R    59_A      R    59_A     0.296     0    0.017   0.698     2.836  100.000   85.584
LGA    N    60_A      N    60_A     0.363     0    0.013   0.863     3.124  100.000   85.952
LGA    Q    61_A      Q    61_A     0.212     0    0.087   0.178     0.385  100.000  100.000
LGA    L    62_A      L    62_A     0.275     0    0.033   0.069     0.406  100.000  100.000
LGA    K    63_A      K    63_A     0.272     0    0.022   0.628     2.076  100.000   96.085
LGA    N    64_A      N    64_A     0.500     0    0.027   0.117     0.923   92.857   94.048
LGA    I    65_A      I    65_A     0.655     0    0.007   0.032     0.684   90.476   90.476
LGA    I    66_A      I    66_A     0.580     0    0.050   0.055     0.714   95.238   92.857
LGA    F    67_A      F    67_A     0.273     0    0.017   0.061     0.711   97.619   96.537
LGA    L    68_A      L    68_A     0.334     0    0.040   0.071     0.427  100.000  100.000
LGA    C    69_A      C    69_A     0.299     0    0.031   0.099     0.466  100.000  100.000
LGA    K    70_A      K    70_A     0.438     0    0.008   0.062     0.748  100.000   94.709
LGA    G    71_A      G    71_A     0.356     0    0.051   0.051     0.495  100.000  100.000
LGA    A    72_A      A    72_A     0.231     0    0.019   0.022     0.288  100.000  100.000
LGA    K    73_A      K    73_A     0.277     0    0.021   0.138     0.933  100.000   97.884
LGA    I    74_A      I    74_A     0.230     0    0.031   0.407     1.715  100.000   96.607
LGA    N    75_A      N    75_A     0.217     0    0.076   0.231     0.949   97.619   97.619
LGA    V    76_A      V    76_A     0.167     0    0.042   0.081     0.454  100.000  100.000
LGA    Y    77_A      Y    77_A     0.173     0    0.056   0.185     0.491  100.000  100.000
LGA    P    78_A      P    78_A     0.338     0    0.018   0.249     0.767   95.238   95.918
LGA    S    79_A      S    79_A     0.804     0    0.026   0.031     0.826   90.476   90.476
LGA    A    80_A      A    80_A     1.006     0    0.023   0.023     1.119   88.214   86.857
LGA    M    81_A      M    81_A     0.923     0    0.020   0.099     0.976   90.476   90.476
LGA    S    82_A      S    82_A     1.044     0    0.023   0.526     1.886   83.690   81.508
LGA    R    83_A      R    83_A     1.183     0    0.054   0.683     1.257   81.429   84.762
LGA    D    84_A      D    84_A     0.905     0    0.049   0.785     2.220   90.476   82.798
LGA    M    85_A      M    85_A     0.436     0    0.041   1.081     3.635   97.619   86.369
LGA    S    86_A      S    86_A     0.264     0    0.030   0.084     0.403  100.000  100.000
LGA    D    87_A      D    87_A     0.325     0    0.020   0.144     1.218  100.000   94.107
LGA    G    88_A      G    88_A     0.317     0    0.041   0.041     0.411  100.000  100.000
LGA    I    89_A      I    89_A     0.562     0    0.038   0.700     1.692   97.619   91.845
LGA    V    90_A      V    90_A     0.291     0    0.012   0.070     0.379  100.000  100.000
LGA    A    91_A      A    91_A     0.222     0    0.033   0.031     0.264  100.000  100.000
LGA    Y    92_A      Y    92_A     0.270     0    0.022   0.100     0.599  100.000   99.206
LGA    E    93_A      E    93_A     0.099     0    0.104   0.737     2.490   97.619   86.931
LGA    T    94_A      T    94_A     0.330     0    0.017   0.029     0.764  100.000   95.918
LGA    T    95_A      T    95_A     0.243     0    0.010   0.050     0.784  100.000   95.918
LGA    L    96_A      L    96_A     0.673     0    0.056   1.403     5.473   95.238   73.393
LGA    G    97_A      G    97_A     0.544     0    0.053   0.053     0.903   92.857   92.857
LGA    Q    98_A      Q    98_A     0.716     0    0.025   0.180     0.944   92.857   91.534
LGA    P    99_A      P    99_A     0.785     0    0.019   0.040     1.267   90.476   86.599
LGA    G   100_A      G   100_A     0.212     0    0.072   0.072     0.401  100.000  100.000
LGA    L   101_A      L   101_A     0.274     0    0.009   0.042     0.400  100.000  100.000
LGA    P   102_A      P   102_A     0.350     0    0.022   0.057     0.509  100.000   98.639
LGA    E   103_A      E   103_A     0.251     0    0.020   0.166     0.985  100.000   96.825
LGA    N   104_A      N   104_A     0.103     0    0.038   0.111     0.516  100.000   98.810
LGA    Q   105_A      Q   105_A     0.141     0    0.027   0.114     0.453  100.000  100.000
LGA    V   106_A      V   106_A     0.246     0    0.008   0.055     0.453  100.000  100.000
LGA    H   107_A      H   107_A     0.303     0    0.045   0.068     0.587  100.000   99.048
LGA    I   108_A      I   108_A     0.461     0    0.032   0.072     0.461  100.000  100.000
LGA    F   109_A      F   109_A     0.412     0    0.024   0.105     0.509  100.000   99.134
LGA    D   110_A      D   110_A     0.410     0    0.044   0.101     0.771  100.000   95.238
LGA    F   111_A      F   111_A     0.271     0    0.016   0.069     0.389  100.000  100.000
LGA    E   112_A      E   112_A     0.344     0    0.042   0.091     1.011  100.000   95.820
LGA    D   113_A      D   113_A     0.488     0    0.040   0.062     0.595   95.238   96.429
LGA    K   114_A      K   114_A     0.598     0    0.010   0.909     3.010   92.857   84.021
LGA    Y   115_A      Y   115_A     0.381     0    0.065   0.150     1.270  100.000   92.937
LGA    V   116_A      V   116_A     0.154     0    0.038   0.073     0.603  100.000   97.279
LGA    D   117_A      D   117_A     0.577     0    0.057   0.222     0.965   92.857   91.667
LGA    I   118_A      I   118_A     0.576     0    0.026   0.252     0.854   92.857   91.667
LGA    T   119_A      T   119_A     0.570     0    0.005   0.031     0.614   95.238   93.197
LGA    P   120_A      P   120_A     0.497     0    0.012   0.050     0.554   92.857   93.197
LGA    E   121_A      E   121_A     0.529     0    0.007   0.201     0.730   90.476   93.651
LGA    E   122_A      E   122_A     0.546     0    0.029   0.368     1.325   90.476   89.471
LGA    Q   123_A      Q   123_A     0.358     0    0.009   0.138     0.721  100.000   98.942
LGA    R   124_A      R   124_A     0.472     0    0.024   0.098     0.888   95.238   95.671
LGA    K   125_A      K   125_A     0.675     0    0.006   1.238     5.265   90.476   72.381
LGA    F   126_A      F   126_A     0.610     0    0.021   0.121     0.914   90.476   92.208
LGA    H   127_A      H   127_A     0.533     0    0.023   0.059     0.599   90.476   90.476
LGA    S   128_A      S   128_A     0.749     0    0.011   0.094     0.814   90.476   90.476
LGA    Q   129_A      Q   129_A     0.709     0    0.011   0.197     1.585   90.476   86.508
LGA    W   130_A      W   130_A     0.582     0    0.024   0.068     0.815   90.476   91.156
LGA    F   131_A      F   131_A     0.685     0    0.018   0.036     1.097   90.476   88.831
LGA    E   132_A      E   132_A     0.625     0    0.059   0.993     3.970   90.476   77.037
LGA    S   133_A      S   133_A     0.472     0    0.043   0.069     0.519   97.619   98.413
LGA    L   134_A      L   134_A     0.587     0    0.133   0.191     0.832   90.476   90.476

# 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):     0.593          0.607                  1.024           95.688   92.098

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  142  132    4.0    132    0.59    98.485    99.409    19.046

LGA_LOCAL      RMSD:   0.593  Number of atoms:  132  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   0.593  Number of assigned atoms:  132 
Std_ASGN_ATOMS RMSD:   0.593  Standard rmsd on all 132 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.031904 * X  +   0.313058 * Y  +   0.949198 * Z  + -13.948249
  Y_new =  -0.619901 * X  +  -0.751156 * Y  +   0.226906 * Z  +  10.290463
  Z_new =   0.784031 * X  +  -0.581170 * Y  +   0.218030 * Z  +  -1.066577 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -1.622217 -0.901133 -1.211888   [DEG:  -92.9462  -51.6311  -69.4361 ]
ZXZ:  1.805443  1.351001  2.208680   [DEG:  103.4443   77.4066  126.5480 ]
 
# END of job
