
#######################################################
#                                                     #
#                        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  134 ( 1091),  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       0.63     0.63
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   132       3_A - 134_A       0.63     0.63
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   132       3_A - 134_A       0.63     0.63
  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   84  125  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     36  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     82  122  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   60  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     57  118  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     38  120  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     71  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     41  122  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      4  114  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     58  122  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     45  122  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     41  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     71  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     84  122  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     86  122  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     86  122  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     86  122  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     45  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     57  122  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     24  120  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     37  122  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     57  122  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     25  121  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     16  122  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  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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  122  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     86  122  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     86  122  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     48  122  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     48  119  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     10  119  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     86  122  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     86  122  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     85  122  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     38  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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     86  122  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  122  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     86  122  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     75  122  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     82  122  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     67  122  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     75  122  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     86  122  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     80  122  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     58  122  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     75  122  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     58  122  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     58  122  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     58  122  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     54  122  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     58  122  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     67  122  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     58  122  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     40  114  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     86    122    130    132    132    132    132    132    132    132    132    132    132    132    132    132    132    132    132    132 
GDT PERCENT_AT  65.15  92.42  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   0.58   0.63   0.63   0.63   0.63   0.63   0.63   0.63   0.63   0.63   0.63   0.63   0.63   0.63   0.63   0.63   0.63   0.63
GDT RMS_ALL_AT   0.67   0.63   0.63   0.63   0.63   0.63   0.63   0.63   0.63   0.63   0.63   0.63   0.63   0.63   0.63   0.63   0.63   0.63   0.63   0.63

# 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   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:  F   131_A      F   131_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     1.646     3    0.021   0.060     1.973   79.405   48.810
LGA    V     4_A      V     4_A     0.958     0    0.141   0.172     1.813   83.810   84.082
LGA    D     5_A      D     5_A     0.178     0    0.017   0.862     3.011  100.000   85.000
LGA    K     6_A      K     6_A     0.266     0    0.076   0.249     0.931  100.000   97.884
LGA    R     7_A      R     7_A     0.326     0    0.034   0.570     2.099  100.000   89.264
LGA    K     8_A      K     8_A     0.415     0    0.016   0.444     1.476  100.000   94.762
LGA    I     9_A      I     9_A     0.388     0    0.042   0.072     0.528   97.619   97.619
LGA    K    10_A      K    10_A     0.239     0    0.013   0.940     4.470  100.000   86.085
LGA    I    11_A      I    11_A     0.152     0    0.020   0.043     0.358  100.000  100.000
LGA    I    12_A      I    12_A     0.282     0    0.062   0.077     0.759   95.238   95.238
LGA    L    13_A      L    13_A     0.759     0    0.086   1.006     2.577   85.952   80.833
LGA    N    14_A      N    14_A     2.114     0    0.113   0.128     3.833   70.833   60.476
LGA    G    15_A      G    15_A     1.079     0    0.011   0.011     1.389   85.952   85.952
LGA    E    16_A      E    16_A     1.105     0    0.081   0.825     2.561   85.952   76.984
LGA    M    17_A      M    17_A     0.648     0    0.057   0.693     2.058   86.071   81.726
LGA    E    18_A      E    18_A     0.479     0    0.051   0.569     1.742  100.000   92.804
LGA    E    19_A      E    19_A     0.363     0    0.049   0.284     1.132   97.619   96.878
LGA    A    20_A      A    20_A     0.362     0    0.076   0.115     0.708   97.619   98.095
LGA    E    21_A      E    21_A     0.218     0    0.022   0.327     0.966  100.000   97.884
LGA    L    22_A      L    22_A     0.183     0    0.049   0.077     0.342  100.000  100.000
LGA    H    23_A      H    23_A     0.271     0    0.042   0.163     0.507  100.000   99.048
LGA    M    24_A      M    24_A     0.123     0    0.049   0.326     0.955  100.000   97.619
LGA    I    25_A      I    25_A     0.432     0    0.015   0.386     1.023   97.619   92.917
LGA    T    26_A      T    26_A     0.470     0    0.034   0.073     0.656   95.238   93.197
LGA    S    27_A      S    27_A     0.978     0    0.033   0.738     4.238   85.952   75.635
LGA    P    28_A      P    28_A     1.722     0    0.671   0.605     4.579   62.619   69.456
LGA    N    29_A      N    29_A     0.867     0    0.097   1.038     2.341   83.810   81.726
LGA    R    30_A      R    30_A     0.928     0    0.018   0.645     3.619   90.476   71.732
LGA    H    31_A      H    31_A     0.879     0    0.043   1.176     6.832   90.476   59.762
LGA    C    32_A      C    32_A     0.272     0    0.040   0.047     0.489  100.000  100.000
LGA    C    33_A      C    33_A     0.310     0    0.048   0.082     0.486  100.000  100.000
LGA    L    34_A      L    34_A     0.197     0    0.010   0.049     0.224  100.000  100.000
LGA    K    35_A      K    35_A     0.249     0    0.016   0.407     2.164  100.000   93.968
LGA    I    36_A      I    36_A     0.255     0    0.019   0.089     0.668  100.000   98.810
LGA    F    37_A      F    37_A     0.099     0    0.013   0.065     0.386  100.000  100.000
LGA    H    38_A      H    38_A     0.191     0    0.020   0.074     0.540   97.619   97.143
LGA    N    39_A      N    39_A     0.690     0    0.020   1.122     3.403   92.857   84.345
LGA    N    40_A      N    40_A     0.466     0    0.065   1.032     2.311   95.238   86.429
LGA    N    41_A      N    41_A     0.451     0    0.022   0.982     4.717  100.000   79.821
LGA    Q    42_A      Q    42_A     0.378     0    0.033   0.098     0.694   97.619   98.942
LGA    L    43_A      L    43_A     0.288     0    0.061   0.326     1.700   97.619   93.036
LGA    A    44_A      A    44_A     0.473     0    0.022   0.030     0.557  100.000   98.095
LGA    E    45_A      E    45_A     0.344     0    0.042   0.476     2.031  100.000   89.947
LGA    S    46_A      S    46_A     0.459     0    0.051   0.075     0.555  100.000   98.413
LGA    N    47_A      N    47_A     0.167     0    0.010   0.102     0.456  100.000  100.000
LGA    D    48_A      D    48_A     0.371     0    0.043   0.115     0.597   97.619   97.619
LGA    T    49_A      T    49_A     0.740     0    0.112   0.100     1.645   95.238   88.095
LGA    D    50_A      D    50_A     0.385     0    0.038   0.215     0.588  100.000   98.810
LGA    Y    51_A      Y    51_A     0.321     0    0.056   0.110     1.051   97.619   96.071
LGA    F    52_A      F    52_A     0.498     0    0.008   0.046     0.566   97.619   93.939
LGA    S    53_A      S    53_A     0.381     0    0.022   0.061     0.479  100.000  100.000
LGA    C    54_A      C    54_A     0.526     0    0.027   0.077     0.602   90.476   90.476
LGA    F    55_A      F    55_A     0.429     0    0.022   0.260     1.211   97.619   95.714
LGA    A    56_A      A    56_A     0.374     0    0.030   0.034     0.454  100.000  100.000
LGA    D    57_A      D    57_A     0.437     0    0.025   0.426     1.233  100.000   94.167
LGA    L    58_A      L    58_A     0.453     0    0.018   1.284     3.327  100.000   86.845
LGA    R    59_A      R    59_A     0.447     0    0.028   0.691     2.502   97.619   85.281
LGA    N    60_A      N    60_A     0.527     0    0.051   0.903     3.018   97.619   83.571
LGA    Q    61_A      Q    61_A     0.400     0    0.139   0.194     0.723   95.238   97.884
LGA    L    62_A      L    62_A     0.303     0    0.047   0.061     0.442  100.000  100.000
LGA    K    63_A      K    63_A     0.293     0    0.038   0.627     2.096  100.000   95.026
LGA    N    64_A      N    64_A     0.494     0    0.020   0.115     0.702   95.238   92.857
LGA    I    65_A      I    65_A     0.647     0    0.065   0.094     0.733   90.476   90.476
LGA    I    66_A      I    66_A     0.499     0    0.027   0.049     0.714   97.619   95.238
LGA    F    67_A      F    67_A     0.247     0    0.012   0.079     0.642  100.000   97.403
LGA    L    68_A      L    68_A     0.363     0    0.045   0.079     0.566  100.000   98.810
LGA    C    69_A      C    69_A     0.569     0    0.052   0.725     2.273   92.857   87.778
LGA    K    70_A      K    70_A     0.479     0    0.016   0.080     0.987   97.619   94.709
LGA    G    71_A      G    71_A     0.417     0    0.014   0.014     0.467  100.000  100.000
LGA    A    72_A      A    72_A     0.410     0    0.061   0.066     0.444  100.000  100.000
LGA    K    73_A      K    73_A     0.361     0    0.028   0.103     0.752  100.000   96.825
LGA    I    74_A      I    74_A     0.275     0    0.021   0.417     1.971  100.000   96.607
LGA    N    75_A      N    75_A     0.186     0    0.026   0.120     0.998  100.000   96.429
LGA    V    76_A      V    76_A     0.288     0    0.065   0.095     0.612   97.619   97.279
LGA    Y    77_A      Y    77_A     0.372     0    0.018   0.183     0.524  100.000   98.413
LGA    P    78_A      P    78_A     0.420     0    0.045   0.292     1.149   92.976   93.265
LGA    S    79_A      S    79_A     0.896     0    0.032   0.073     0.925   90.476   90.476
LGA    A    80_A      A    80_A     1.184     0    0.017   0.025     1.386   83.690   83.238
LGA    M    81_A      M    81_A     0.859     0    0.012   0.820     2.252   88.214   86.131
LGA    S    82_A      S    82_A     0.813     0    0.016   0.668     1.347   90.476   87.460
LGA    R    83_A      R    83_A     1.066     0    0.021   0.661     1.272   88.214   88.009
LGA    D    84_A      D    84_A     0.855     0    0.155   0.773     2.002   88.214   82.798
LGA    M    85_A      M    85_A     0.432     0    0.059   1.106     3.417   97.619   88.155
LGA    S    86_A      S    86_A     0.372     0    0.023   0.052     0.394  100.000  100.000
LGA    D    87_A      D    87_A     0.299     0    0.039   0.125     0.701  100.000   96.429
LGA    G    88_A      G    88_A     0.185     0    0.021   0.021     0.298  100.000  100.000
LGA    I    89_A      I    89_A     0.320     0    0.014   0.605     1.819  100.000   96.607
LGA    V    90_A      V    90_A     0.318     0    0.011   0.059     0.479  100.000  100.000
LGA    A    91_A      A    91_A     0.317     0    0.035   0.062     0.411  100.000  100.000
LGA    Y    92_A      Y    92_A     0.329     0    0.034   0.114     0.733  100.000   99.206
LGA    E    93_A      E    93_A     0.111     0    0.051   0.884     3.306   97.619   86.296
LGA    T    94_A      T    94_A     0.471     0    0.035   0.059     0.815  100.000   95.918
LGA    T    95_A      T    95_A     0.415     0    0.037   0.050     0.932  100.000   95.918
LGA    L    96_A      L    96_A     0.435     0    0.052   1.395     5.425   97.619   75.655
LGA    G    97_A      G    97_A     0.921     0    0.025   0.025     1.628   86.190   86.190
LGA    Q    98_A      Q    98_A     1.038     0    0.014   0.920     2.647   88.214   81.799
LGA    P    99_A      P    99_A     1.093     0    0.030   0.035     1.697   85.952   81.565
LGA    G   100_A      G   100_A     0.360     0    0.110   0.110     0.590   97.619   97.619
LGA    L   101_A      L   101_A     0.573     0    0.022   0.077     0.830   92.857   91.667
LGA    P   102_A      P   102_A     0.712     0    0.028   0.037     0.989   90.476   90.476
LGA    E   103_A      E   103_A     0.666     0    0.013   0.109     0.898   90.476   90.476
LGA    N   104_A      N   104_A     0.389     0    0.040   0.077     0.562  100.000   98.810
LGA    Q   105_A      Q   105_A     0.262     0    0.070   0.101     0.615  100.000   97.884
LGA    V   106_A      V   106_A     0.420     0    0.011   0.021     0.626   97.619   94.558
LGA    H   107_A      H   107_A     0.477     0    0.028   0.160     0.629   97.619   96.190
LGA    I   108_A      I   108_A     0.440     0    0.017   0.034     0.473  100.000  100.000
LGA    F   109_A      F   109_A     0.484     0    0.054   0.080     0.516   97.619   98.268
LGA    D   110_A      D   110_A     0.567     0    0.044   0.164     1.299   92.857   90.536
LGA    F   111_A      F   111_A     0.404     0    0.037   0.066     0.640   95.238   98.268
LGA    E   112_A      E   112_A     0.485     0    0.025   0.157     0.683  100.000   96.825
LGA    D   113_A      D   113_A     0.532     0    0.071   0.155     0.876   90.476   90.476
LGA    K   114_A      K   114_A     0.519     0    0.067   0.858     2.920   92.857   83.915
LGA    Y   115_A      Y   115_A     0.628     0    0.012   0.237     2.109   95.238   83.254
LGA    V   116_A      V   116_A     0.183     0    0.056   0.067     0.467  100.000  100.000
LGA    D   117_A      D   117_A     0.615     0    0.044   0.209     1.107   92.857   90.536
LGA    I   118_A      I   118_A     0.453     0    0.020   0.075     0.564   92.857   96.429
LGA    T   119_A      T   119_A     0.716     0    0.015   0.122     0.867   90.476   90.476
LGA    P   120_A      P   120_A     0.553     0    0.033   0.041     0.694   90.476   90.476
LGA    E   121_A      E   121_A     0.718     0    0.025   0.241     1.210   90.476   89.471
LGA    E   122_A      E   122_A     0.687     0    0.041   0.360     1.605   90.476   86.508
LGA    Q   123_A      Q   123_A     0.430     0    0.018   0.167     0.606   92.857   95.767
LGA    R   124_A      R   124_A     0.569     0    0.047   0.707     3.532   90.476   74.719
LGA    K   125_A      K   125_A     0.830     0    0.021   1.290     5.624   90.476   70.317
LGA    F   126_A      F   126_A     0.648     0    0.026   0.159     1.025   90.476   91.385
LGA    H   127_A      H   127_A     0.677     0    0.041   1.159     2.293   90.476   82.667
LGA    S   128_A      S   128_A     0.886     0    0.048   0.099     1.007   88.214   88.968
LGA    Q   129_A      Q   129_A     0.805     0    0.021   0.143     1.392   90.476   87.460
LGA    W   130_A      W   130_A     0.760     0    0.018   0.086     0.858   90.476   91.837
LGA    F   131_A      F   131_A     0.796     0    0.016   0.092     1.234   90.476   87.186
LGA    E   132_A      E   132_A     0.793     0    0.044   0.970     3.820   90.476   77.884
LGA    S   133_A      S   133_A     0.859     0    0.075   0.080     1.177   88.214   90.556
LGA    L   134_A      L   134_A     1.244     0    0.674   0.529     1.827   81.548   84.881

# 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):     0.625          0.660                  1.062           94.849   91.050

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  134  132    4.0    132    0.63    98.106    99.289    18.195

LGA_LOCAL      RMSD:   0.625  Number of atoms:  132  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   0.625  Number of assigned atoms:  132 
Std_ASGN_ATOMS RMSD:   0.625  Standard rmsd on all 132 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.255291 * X  +  -0.824734 * Y  +  -0.504620 * Z  + -13.488109
  Y_new =   0.305594 * X  +   0.426331 * Y  +  -0.851384 * Z  +   9.164394
  Z_new =   0.917300 * X  +  -0.371559 * Y  +   0.143195 * Z  +  -0.225535 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  2.266748 -1.161246 -1.202947   [DEG:  129.8751  -66.5345  -68.9238 ]
ZXZ: -0.535039  1.427107  1.955655   [DEG:  -30.6555   81.7672  112.0508 ]
 
# END of job
