
#######################################################
#                                                     #
#                        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     11   95  129  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     44  125  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  125  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     84  125  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  125  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  125  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     76  125  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  125  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  125  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  125  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     83  125  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     10   55  118  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     79  125  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     21  125  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     55  125  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     84  125  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  125  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  125  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  125  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  125  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  125  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  125  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  125  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  125  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     26  125  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     31  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     56  125  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     21  125  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  125  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  125  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  125  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  125  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  125  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  125  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  125  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  125  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     84  125  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  125  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  125  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  125  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  125  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  125  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  125  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  125  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  125  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  125  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     63  125  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  125  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  125  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  125  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  125  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  125  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  125  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  125  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  125  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  125  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  125  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  125  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  125  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  125  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  125  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  125  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     77  125  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  125  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  125  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  125  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     71  125  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  125  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  125  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  125  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  125  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  125  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  125  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  125  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  125  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  125  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     70  125  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     56  118  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     56  125  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     82  125  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     46  125  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     46  125  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  125  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  125  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  125  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  125  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  125  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  125  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  125  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  125  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  125  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     82  125  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  125  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  125  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     64  125  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     50  116  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     14  123  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  125  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  125  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     82  125  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     37  125  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  125  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  125  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  125  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  125  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  125  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  125  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  125  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  125  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  125  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  125  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  125  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  125  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  125  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     85  125  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     85  125  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     76  125  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     80  125  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     76  125  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     80  125  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     85  125  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     83  125  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     76  125  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     83  125  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     71  125  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     61  125  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     61  125  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     46  125  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     61  125  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     76  125  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     63  125  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     63  125  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    125    130    132    132    132    132    132    132    132    132    132    132    132    132    132    132    132    132    132 
GDT PERCENT_AT  64.39  94.70  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    0.33   0.51   0.55   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   0.62   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:  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:  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     1.624     3    0.012   0.038     2.077   81.548   48.869
LGA    V     4_A      V     4_A     1.001     0    0.086   0.147     1.526   81.548   81.497
LGA    D     5_A      D     5_A     0.177     0    0.048   0.880     3.281  100.000   83.095
LGA    K     6_A      K     6_A     0.478     0    0.098   0.214     0.915   97.619   93.651
LGA    R     7_A      R     7_A     0.259     0    0.043   0.629     2.464  100.000   83.117
LGA    K     8_A      K     8_A     0.331     0    0.014   0.407     2.190   97.619   87.831
LGA    I     9_A      I     9_A     0.639     0    0.102   1.153     2.699   92.857   81.071
LGA    K    10_A      K    10_A     0.311     0    0.031   0.171     0.547  100.000   98.942
LGA    I    11_A      I    11_A     0.240     0    0.026   0.052     0.487  100.000  100.000
LGA    I    12_A      I    12_A     0.266     0    0.044   0.077     0.781   95.238   95.238
LGA    L    13_A      L    13_A     0.733     0    0.065   0.981     2.582   88.333   83.036
LGA    N    14_A      N    14_A     2.085     0    0.092   0.126     3.779   70.833   60.476
LGA    G    15_A      G    15_A     0.905     0    0.014   0.014     1.287   88.214   88.214
LGA    E    16_A      E    16_A     0.988     0    0.070   0.819     2.488   90.476   81.693
LGA    M    17_A      M    17_A     0.633     0    0.061   0.676     1.863   88.214   83.750
LGA    E    18_A      E    18_A     0.469     0    0.041   0.502     2.064  100.000   90.847
LGA    E    19_A      E    19_A     0.383     0    0.059   0.108     0.946   97.619   93.651
LGA    A    20_A      A    20_A     0.243     0    0.065   0.075     0.468  100.000  100.000
LGA    E    21_A      E    21_A     0.321     0    0.008   0.103     0.662  100.000   96.825
LGA    L    22_A      L    22_A     0.152     0    0.061   0.084     0.242  100.000  100.000
LGA    H    23_A      H    23_A     0.326     0    0.074   0.130     0.543   97.619   97.143
LGA    M    24_A      M    24_A     0.248     0    0.038   0.958     3.072  100.000   91.369
LGA    I    25_A      I    25_A     0.388     0    0.010   0.410     1.138   97.619   95.298
LGA    T    26_A      T    26_A     0.368     0    0.041   0.086     0.560  100.000   98.639
LGA    S    27_A      S    27_A     0.777     0    0.054   0.751     3.748   90.476   81.111
LGA    P    28_A      P    28_A     1.407     0    0.676   0.587     4.209   68.214   75.238
LGA    N    29_A      N    29_A     0.661     0    0.059   1.005     2.537   88.214   82.976
LGA    R    30_A      R    30_A     0.788     0    0.024   1.092     3.376   90.476   78.009
LGA    H    31_A      H    31_A     0.930     0    0.043   1.545     6.589   90.476   58.667
LGA    C    32_A      C    32_A     0.314     0    0.037   0.092     0.566   97.619   98.413
LGA    C    33_A      C    33_A     0.159     0    0.027   0.056     0.283  100.000  100.000
LGA    L    34_A      L    34_A     0.198     0    0.025   0.088     0.315  100.000  100.000
LGA    K    35_A      K    35_A     0.294     0    0.032   0.391     1.907  100.000   94.868
LGA    I    36_A      I    36_A     0.223     0    0.012   0.118     0.617  100.000   98.810
LGA    F    37_A      F    37_A     0.155     0    0.028   0.068     0.212  100.000  100.000
LGA    H    38_A      H    38_A     0.248     0    0.023   0.059     0.584  100.000   98.095
LGA    N    39_A      N    39_A     0.601     0    0.038   1.104     3.297   92.857   84.345
LGA    N    40_A      N    40_A     0.363     0    0.056   1.039     2.262  100.000   91.190
LGA    N    41_A      N    41_A     0.441     0    0.030   0.988     4.636  100.000   77.798
LGA    Q    42_A      Q    42_A     0.390     0    0.045   0.130     0.793   97.619   97.884
LGA    L    43_A      L    43_A     0.288     0    0.053   0.289     1.560   97.619   93.036
LGA    A    44_A      A    44_A     0.376     0    0.035   0.044     0.417  100.000  100.000
LGA    E    45_A      E    45_A     0.465     0    0.035   0.322     1.241   97.619   94.762
LGA    S    46_A      S    46_A     0.415     0    0.017   0.040     0.521  100.000   96.825
LGA    N    47_A      N    47_A     0.087     0    0.022   0.058     0.268  100.000  100.000
LGA    D    48_A      D    48_A     0.351     0    0.051   0.206     0.893  100.000   97.619
LGA    T    49_A      T    49_A     0.765     0    0.114   0.110     1.755   95.238   88.095
LGA    D    50_A      D    50_A     0.308     0    0.041   0.368     0.808  100.000   97.619
LGA    Y    51_A      Y    51_A     0.327     0    0.036   0.093     1.162  100.000   96.071
LGA    F    52_A      F    52_A     0.480     0    0.027   0.050     0.580  100.000   94.805
LGA    S    53_A      S    53_A     0.516     0    0.037   0.079     0.579   90.476   93.651
LGA    C    54_A      C    54_A     0.531     0    0.025   0.080     0.655   95.238   93.651
LGA    F    55_A      F    55_A     0.353     0    0.016   0.284     1.380  100.000   94.935
LGA    A    56_A      A    56_A     0.428     0    0.021   0.030     0.534  100.000   98.095
LGA    D    57_A      D    57_A     0.461     0    0.034   0.434     1.221  100.000   92.976
LGA    L    58_A      L    58_A     0.395     0    0.014   1.278     3.259  100.000   88.036
LGA    R    59_A      R    59_A     0.470     0    0.018   0.689     2.541   95.238   83.723
LGA    N    60_A      N    60_A     0.610     0    0.029   0.879     3.032   92.857   81.190
LGA    Q    61_A      Q    61_A     0.403     0    0.111   0.157     0.496  100.000  100.000
LGA    L    62_A      L    62_A     0.296     0    0.091   0.081     0.395  100.000  100.000
LGA    K    63_A      K    63_A     0.230     0    0.026   0.612     2.022  100.000   93.968
LGA    N    64_A      N    64_A     0.413     0    0.013   0.052     0.769   95.238   94.048
LGA    I    65_A      I    65_A     0.659     0    0.052   0.068     0.779   90.476   90.476
LGA    I    66_A      I    66_A     0.535     0    0.021   0.040     0.696   95.238   92.857
LGA    F    67_A      F    67_A     0.220     0    0.021   0.080     0.970  100.000   95.671
LGA    L    68_A      L    68_A     0.282     0    0.036   0.070     0.476  100.000  100.000
LGA    C    69_A      C    69_A     0.533     0    0.050   0.794     2.554   95.238   88.095
LGA    K    70_A      K    70_A     0.459     0    0.024   0.055     0.887   97.619   94.709
LGA    G    71_A      G    71_A     0.310     0    0.043   0.043     0.390  100.000  100.000
LGA    A    72_A      A    72_A     0.387     0    0.044   0.058     0.387  100.000  100.000
LGA    K    73_A      K    73_A     0.340     0    0.026   0.106     0.582  100.000   98.942
LGA    I    74_A      I    74_A     0.283     0    0.025   0.421     1.977  100.000   96.607
LGA    N    75_A      N    75_A     0.298     0    0.020   0.137     0.976   97.619   95.238
LGA    V    76_A      V    76_A     0.328     0    0.074   0.102     0.655   97.619   97.279
LGA    Y    77_A      Y    77_A     0.345     0    0.047   0.208     0.587  100.000   99.206
LGA    P    78_A      P    78_A     0.438     0    0.056   0.284     1.164   92.976   93.265
LGA    S    79_A      S    79_A     1.012     0    0.043   0.051     1.081   88.214   87.460
LGA    A    80_A      A    80_A     1.261     0    0.019   0.027     1.560   83.690   81.524
LGA    M    81_A      M    81_A     1.055     0    0.013   0.064     1.706   85.952   81.548
LGA    S    82_A      S    82_A     0.760     0    0.032   0.039     0.881   92.857   92.063
LGA    R    83_A      R    83_A     0.856     0    0.025   0.756     1.411   90.476   87.186
LGA    D    84_A      D    84_A     0.665     0    0.124   0.610     1.855   92.857   86.131
LGA    M    85_A      M    85_A     0.253     0    0.023   0.310     0.891   97.619   95.238
LGA    S    86_A      S    86_A     0.190     0    0.037   0.051     0.352  100.000  100.000
LGA    D    87_A      D    87_A     0.258     0    0.028   0.151     1.059  100.000   94.167
LGA    G    88_A      G    88_A     0.136     0    0.030   0.030     0.237  100.000  100.000
LGA    I    89_A      I    89_A     0.242     0    0.015   0.667     2.240  100.000   95.595
LGA    V    90_A      V    90_A     0.350     0    0.046   0.073     0.511  100.000   98.639
LGA    A    91_A      A    91_A     0.343     0    0.058   0.078     0.409  100.000  100.000
LGA    Y    92_A      Y    92_A     0.388     0    0.038   0.105     0.793  100.000   97.619
LGA    E    93_A      E    93_A     0.193     0    0.081   0.804     2.588   97.619   85.132
LGA    T    94_A      T    94_A     0.514     0    0.019   0.069     0.780   97.619   95.918
LGA    T    95_A      T    95_A     0.454     0    0.021   0.066     0.896   97.619   94.558
LGA    L    96_A      L    96_A     0.449     0    0.067   1.398     5.449   97.619   74.762
LGA    G    97_A      G    97_A     0.884     0    0.038   0.038     1.373   88.333   88.333
LGA    Q    98_A      Q    98_A     1.144     0    0.013   0.189     1.492   85.952   83.439
LGA    P    99_A      P    99_A     1.053     0    0.029   0.042     1.580   85.952   81.565
LGA    G   100_A      G   100_A     0.250     0    0.103   0.103     0.585   97.619   97.619
LGA    L   101_A      L   101_A     0.342     0    0.012   0.065     0.449  100.000  100.000
LGA    P   102_A      P   102_A     0.705     0    0.022   0.033     0.985   90.476   90.476
LGA    E   103_A      E   103_A     0.681     0    0.026   0.643     1.843   90.476   87.513
LGA    N   104_A      N   104_A     0.316     0    0.050   0.122     0.447  100.000  100.000
LGA    Q   105_A      Q   105_A     0.281     0    0.071   0.136     0.717  100.000   98.942
LGA    V   106_A      V   106_A     0.323     0    0.037   0.041     0.620   97.619   95.918
LGA    H   107_A      H   107_A     0.348     0    0.031   0.045     0.477  100.000  100.000
LGA    I   108_A      I   108_A     0.370     0    0.048   0.064     0.484  100.000  100.000
LGA    F   109_A      F   109_A     0.378     0    0.031   0.073     0.428  100.000  100.000
LGA    D   110_A      D   110_A     0.547     0    0.047   0.096     0.824   90.476   90.476
LGA    F   111_A      F   111_A     0.354     0    0.032   0.105     0.603   97.619   99.134
LGA    E   112_A      E   112_A     0.450     0    0.018   0.102     0.633  100.000   96.825
LGA    D   113_A      D   113_A     0.494     0    0.066   0.112     0.787   95.238   92.857
LGA    K   114_A      K   114_A     0.477     0    0.054   0.865     3.181  100.000   86.296
LGA    Y   115_A      Y   115_A     0.497     0    0.020   0.234     1.788  100.000   87.698
LGA    V   116_A      V   116_A     0.142     0    0.041   0.066     0.465  100.000  100.000
LGA    D   117_A      D   117_A     0.586     0    0.023   0.160     0.871   92.857   91.667
LGA    I   118_A      I   118_A     0.555     0    0.020   0.110     0.629   90.476   90.476
LGA    T   119_A      T   119_A     0.698     0    0.030   0.074     0.790   90.476   90.476
LGA    P   120_A      P   120_A     0.629     0    0.016   0.035     0.759   90.476   90.476
LGA    E   121_A      E   121_A     0.719     0    0.026   0.141     0.800   90.476   90.476
LGA    E   122_A      E   122_A     0.638     0    0.041   0.333     1.455   90.476   88.466
LGA    Q   123_A      Q   123_A     0.418     0    0.011   0.142     0.489  100.000  100.000
LGA    R   124_A      R   124_A     0.572     0    0.050   0.420     2.233   90.476   84.935
LGA    K   125_A      K   125_A     0.703     0    0.017   0.837     3.560   90.476   82.275
LGA    F   126_A      F   126_A     0.561     0    0.022   0.130     0.830   90.476   93.939
LGA    H   127_A      H   127_A     0.622     0    0.022   1.153     2.271   90.476   82.667
LGA    S   128_A      S   128_A     0.794     0    0.042   0.090     0.923   90.476   90.476
LGA    Q   129_A      Q   129_A     0.801     0    0.016   0.122     1.348   90.476   87.460
LGA    W   130_A      W   130_A     0.789     0    0.036   0.106     0.891   90.476   90.476
LGA    F   131_A      F   131_A     0.819     0    0.039   1.164     4.742   90.476   72.597
LGA    E   132_A      E   132_A     0.703     0    0.135   1.044     4.314   88.214   74.603
LGA    S   133_A      S   133_A     0.706     0    0.068   0.106     0.720   90.476   92.063
LGA    L   134_A      L   134_A     0.746     0    0.165   0.216     1.197   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):     0.593          0.616                  1.035           95.362   91.306

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  142  132    4.0    132    0.59    98.674    99.468    19.059

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 =  -0.240175 * X  +   0.806295 * Y  +  -0.540558 * Z  + -12.479910
  Y_new =   0.961607 * X  +   0.121455 * Y  +  -0.246089 * Z  +   9.940784
  Z_new =  -0.132767 * X  +  -0.578910 * Y  +  -0.804510 * Z  +   1.152346 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  1.815553  0.133160 -2.517846   [DEG:  104.0235    7.6295 -144.2620 ]
ZXZ: -1.143585  2.505647 -2.916152   [DEG:  -65.5226  143.5630 -167.0832 ]
 
# END of job
