
#######################################################
#                                                     #
#                        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 ( 1014),  selected  133 , name one
# Molecule2: number of CA atoms  133 ( 1010),  selected  133 , 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:   133       2_A - 134_A       2.01     2.01
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   132       2_A - 133_A       1.99     2.01
  LONGEST_CONTINUOUS_SEGMENT:   132       3_A - 134_A       1.55     2.02
  LCS_AVERAGE:     99.25

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   129       6_A - 134_A       0.83     2.07
  LCS_AVERAGE:     94.84

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  133
LCS_GDT     RESIDUE       RESIDUE       SEGMENT_SIZE    GLOBAL DISTANCE TEST COLUMNS: number of residues under the threshold assigned to each residue pair
LCS_GDT   NAME NUMBER   NAME NUMBER    1.0  2.0  5.0    0.5  1.0  1.5  2.0  2.5  3.0  3.5  4.0  4.5  5.0  5.5  6.0  6.5  7.0  7.5  8.0  8.5  9.0  9.5 10.0
LCS_GDT     S     2_A     S     2_A      3  132  133      0    3    3    3    3   10   19   24   26   31   32   38   45   69   81  104  124  128  129  130 
LCS_GDT     M     3_A     M     3_A      3  132  133      0    3    6    9   12   15   43   62   94  116  126  128  129  132  132  132  132  132  132  132 
LCS_GDT     A     4_A     A     4_A      3  132  133      3    3    6    9   12   15   19   30   98  116  126  128  129  132  132  132  132  132  132  132 
LCS_GDT     E     5_A     E     5_A    127  132  133      3    4    4    5   13   37   75   99  123  126  127  130  130  132  132  132  132  132  132  132 
LCS_GDT     L     6_A     L     6_A    129  132  133      3    4    4    5    6   12   60  122  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     K     7_A     K     7_A    129  132  133      6   36  121  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     Q     8_A     Q     8_A    129  132  133     58  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     E     9_A     E     9_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     W    10_A     W    10_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     I    11_A     I    11_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     N    12_A     N    12_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     T    13_A     T    13_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     A    14_A     A    14_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     I    15_A     I    15_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     E    16_A     E    16_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     A    17_A     A    17_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     L    18_A     L    18_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     D    19_A     D    19_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     K    20_A     K    20_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     A    21_A     A    21_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     Y    22_A     Y    22_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     V    23_A     V    23_A    129  132  133     95  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     P    24_A     P    24_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     Y    25_A     Y    25_A    129  132  133     89  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     S    26_A     S    26_A    129  132  133     95  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     H    27_A     H    27_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     F    28_A     F    28_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     P    29_A     P    29_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     V    30_A     V    30_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     G    31_A     G    31_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     A    32_A     A    32_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     C    33_A     C    33_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     L    34_A     L    34_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     V    35_A     V    35_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     T    36_A     T    36_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     E    37_A     E    37_A    129  132  133     96  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     S    38_A     S    38_A    129  132  133     52  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     G    39_A     G    39_A    129  132  133     94  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     K    40_A     K    40_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     I    41_A     I    41_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     Y    42_A     Y    42_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     Q    43_A     Q    43_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     G    44_A     G    44_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     I    45_A     I    45_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     N    46_A     N    46_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     I    47_A     I    47_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     E    48_A     E    48_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     N    49_A     N    49_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     A    50_A     A    50_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     S    51_A     S    51_A    129  132  133     82  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     F    52_A     F    52_A    129  132  133     74  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     G    53_A     G    53_A    129  132  133     68  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     L    54_A     L    54_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     T    55_A     T    55_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     N    56_A     N    56_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     C    57_A     C    57_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     A    58_A     A    58_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     E    59_A     E    59_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     R    60_A     R    60_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     T    61_A     T    61_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     A    62_A     A    62_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     F    63_A     F    63_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     F    64_A     F    64_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     K    65_A     K    65_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     A    66_A     A    66_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     V    67_A     V    67_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     S    68_A     S    68_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     E    69_A     E    69_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     G    70_A     G    70_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     E    71_A     E    71_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     R    72_A     R    72_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     S    73_A     S    73_A    129  132  133     98  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     F    74_A     F    74_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     T    75_A     T    75_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     H    76_A     H    76_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     L    77_A     L    77_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     V    78_A     V    78_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     V    79_A     V    79_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     A    80_A     A    80_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     G    81_A     G    81_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     H    82_A     H    82_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     T    83_A     T    83_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     P    84_A     P    84_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     D    85_A     D    85_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     P    86_A     P    86_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     I    87_A     I    87_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     S    88_A     S    88_A    129  132  133     60  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     P    89_A     P    89_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     C    90_A     C    90_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     G    91_A     G    91_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     A    92_A     A    92_A    129  132  133     94  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     C    93_A     C    93_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     R    94_A     R    94_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     Q    95_A     Q    95_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     V    96_A     V    96_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     M    97_A     M    97_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     A    98_A     A    98_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     E    99_A     E    99_A    129  132  133     99  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     F   100_A     F   100_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     C   101_A     C   101_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     A   102_A     A   102_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     P   103_A     P   103_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     D   104_A     D   104_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     M   105_A     M   105_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     P   106_A     P   106_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     V   107_A     V   107_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     T   108_A     T   108_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     L   109_A     L   109_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     V   110_A     V   110_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     G   111_A     G   111_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     D   112_A     D   112_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     N   113_A     N   113_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     G   114_A     G   114_A    129  132  133     33  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     V   115_A     V   115_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     T   116_A     T   116_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     K   117_A     K   117_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     A   118_A     A   118_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     T   119_A     T   119_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     T   120_A     T   120_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     V   121_A     V   121_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     R   122_A     R   122_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     E   123_A     E   123_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     L   124_A     L   124_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     L   125_A     L   125_A    129  132  133    102  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     P   126_A     P   126_A    129  132  133     85  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     Y   127_A     Y   127_A    129  132  133      5   52  121  124  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     A   128_A     A   128_A    129  132  133      5  101  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     F   129_A     F   129_A    129  132  133     31  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     T   130_A     T   130_A    129  132  133     94  120  122  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     E   131_A     E   131_A    129  132  133     24   86  121  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     K   132_A     K   132_A    129  132  133      3   62  112  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     D   133_A     D   133_A    129  132  133      3    3    5   89  126  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_GDT     L   134_A     L   134_A    129  132  133     13   62  121  125  127  128  128  128  129  129  129  130  130  132  132  132  132  132  132  132 
LCS_AVERAGE  LCS_A:  98.03  (  94.84   99.25  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    102    120    122    125    127    128    128    128    129    129    129    130    130    132    132    132    132    132    132    132 
GDT PERCENT_AT  76.69  90.23  91.73  93.98  95.49  96.24  96.24  96.24  96.99  96.99  96.99  97.74  97.74  99.25  99.25  99.25  99.25  99.25  99.25  99.25
GDT RMS_LOCAL    0.29   0.39   0.42   0.57   0.62   0.68   0.68   0.68   0.83   0.83   0.83   1.08   1.08   1.55   1.55   1.55   1.55   1.55   1.55   1.55
GDT RMS_ALL_AT   2.07   2.06   2.06   2.09   2.08   2.08   2.08   2.08   2.07   2.07   2.07   2.05   2.05   2.02   2.02   2.02   2.02   2.02   2.02   2.02

# Checking swapping
#   possible swapping detected:  E     9_A      E     9_A
#   possible swapping detected:  Y    42_A      Y    42_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    S     2_A      S     2_A    15.518     0    0.043   0.649    17.369    0.000    0.000
LGA    M     3_A      M     3_A     9.868     0    0.619   1.074    11.850    0.833    1.012
LGA    A     4_A      A     4_A     9.156     0    0.635   0.604    10.724    2.143    1.714
LGA    E     5_A      E     5_A     8.095     0    0.626   0.536    11.062    9.048    5.185
LGA    L     6_A      L     6_A     5.496     0    0.604   1.353    11.107   31.190   17.798
LGA    K     7_A      K     7_A     1.688     0    0.630   0.988    12.774   79.286   42.487
LGA    Q     8_A      Q     8_A     0.628     0    0.036   0.077     1.020   92.976   93.704
LGA    E     9_A      E     9_A     0.427     0    0.007   0.627     1.962  100.000   93.862
LGA    W    10_A      W    10_A     0.318     0    0.012   0.124     0.460  100.000  100.000
LGA    I    11_A      I    11_A     0.312     0    0.024   0.065     0.577  100.000   98.810
LGA    N    12_A      N    12_A     0.267     0    0.003   0.046     0.387  100.000  100.000
LGA    T    13_A      T    13_A     0.310     0    0.005   0.050     0.453  100.000  100.000
LGA    A    14_A      A    14_A     0.233     0    0.035   0.038     0.287  100.000  100.000
LGA    I    15_A      I    15_A     0.200     0    0.011   0.078     0.379  100.000  100.000
LGA    E    16_A      E    16_A     0.395     0    0.031   0.462     1.293   97.619   92.698
LGA    A    17_A      A    17_A     0.435     0    0.015   0.016     0.515   97.619   98.095
LGA    L    18_A      L    18_A     0.366     0    0.018   1.256     2.676  100.000   90.238
LGA    D    19_A      D    19_A     0.227     0    0.029   0.113     0.838  100.000   96.429
LGA    K    20_A      K    20_A     0.162     0    0.028   0.191     0.341  100.000  100.000
LGA    A    21_A      A    21_A     0.336     0    0.050   0.067     0.611   97.619   98.095
LGA    Y    22_A      Y    22_A     0.496     0    0.011   0.046     1.036   95.238   91.310
LGA    V    23_A      V    23_A     0.696     0    0.045   0.050     0.834   90.476   90.476
LGA    P    24_A      P    24_A     0.544     0    0.044   0.050     0.767   90.476   91.837
LGA    Y    25_A      Y    25_A     0.778     0    0.028   0.067     0.912   90.476   90.476
LGA    S    26_A      S    26_A     0.696     0    0.012   0.038     0.734   90.476   92.063
LGA    H    27_A      H    27_A     0.433     0    0.017   0.336     1.507  100.000   92.571
LGA    F    28_A      F    28_A     0.400     0    0.021   0.042     0.647  100.000   96.537
LGA    P    29_A      P    29_A     0.514     0    0.045   0.054     0.549   97.619   97.279
LGA    V    30_A      V    30_A     0.315     0    0.020   1.337     2.702  100.000   88.844
LGA    G    31_A      G    31_A     0.182     0    0.008   0.008     0.240  100.000  100.000
LGA    A    32_A      A    32_A     0.166     0    0.011   0.015     0.244  100.000  100.000
LGA    C    33_A      C    33_A     0.177     0    0.053   0.062     0.344  100.000  100.000
LGA    L    34_A      L    34_A     0.218     0    0.011   0.042     0.267  100.000  100.000
LGA    V    35_A      V    35_A     0.066     0    0.016   1.339     2.847  100.000   88.844
LGA    T    36_A      T    36_A     0.449     0    0.032   0.072     0.616   95.238   93.197
LGA    E    37_A      E    37_A     0.738     0    0.045   1.119     4.096   90.476   76.878
LGA    S    38_A      S    38_A     1.015     0    0.046   0.054     1.037   88.214   87.460
LGA    G    39_A      G    39_A     0.755     0    0.011   0.011     0.845   90.476   90.476
LGA    K    40_A      K    40_A     0.392     0    0.042   0.751     3.770   97.619   78.360
LGA    I    41_A      I    41_A     0.332     0    0.078   1.360     3.867   97.619   81.726
LGA    Y    42_A      Y    42_A     0.262     0    0.022   0.038     0.316  100.000  100.000
LGA    Q    43_A      Q    43_A     0.156     0    0.078   0.549     1.647  100.000   91.799
LGA    G    44_A      G    44_A     0.160     0    0.023   0.023     0.311  100.000  100.000
LGA    I    45_A      I    45_A     0.290     0    0.027   0.090     0.761  100.000   97.619
LGA    N    46_A      N    46_A     0.290     0    0.055   0.205     0.575   97.619   98.810
LGA    I    47_A      I    47_A     0.376     0    0.024   0.049     0.666  100.000   98.810
LGA    E    48_A      E    48_A     0.513     0    0.033   0.177     1.133   92.857   90.529
LGA    N    49_A      N    49_A     0.397     0    0.013   0.065     0.751  100.000   95.238
LGA    A    50_A      A    50_A     0.227     0    0.016   0.019     0.639   97.619   98.095
LGA    S    51_A      S    51_A     0.756     0    0.016   0.053     1.433   92.857   89.048
LGA    F    52_A      F    52_A     0.820     0    0.020   1.027     6.380   90.476   59.307
LGA    G    53_A      G    53_A     0.879     0    0.016   0.016     0.879   90.476   90.476
LGA    L    54_A      L    54_A     0.395     0    0.003   1.232     3.076  100.000   88.155
LGA    T    55_A      T    55_A     0.124     0    0.015   0.037     0.335  100.000  100.000
LGA    N    56_A      N    56_A     0.084     0    0.006   1.088     2.639  100.000   91.250
LGA    C    57_A      C    57_A     0.103     0    0.015   0.046     0.325  100.000  100.000
LGA    A    58_A      A    58_A     0.052     0    0.012   0.012     0.067  100.000  100.000
LGA    E    59_A      E    59_A     0.101     0    0.016   0.087     0.257  100.000  100.000
LGA    R    60_A      R    60_A     0.133     0    0.011   0.152     0.550  100.000   98.268
LGA    T    61_A      T    61_A     0.123     0    0.018   0.070     0.286  100.000  100.000
LGA    A    62_A      A    62_A     0.161     0    0.008   0.010     0.226  100.000  100.000
LGA    F    63_A      F    63_A     0.190     0    0.026   0.042     0.336  100.000  100.000
LGA    F    64_A      F    64_A     0.313     0    0.026   0.082     0.755  100.000   94.805
LGA    K    65_A      K    65_A     0.256     0    0.034   0.152     0.451  100.000  100.000
LGA    A    66_A      A    66_A     0.093     0    0.019   0.018     0.147  100.000  100.000
LGA    V    67_A      V    67_A     0.104     0    0.027   1.325     2.552  100.000   88.844
LGA    S    68_A      S    68_A     0.299     0    0.014   0.695     3.010  100.000   91.667
LGA    E    69_A      E    69_A     0.395     0    0.018   0.797     2.807  100.000   87.090
LGA    G    70_A      G    70_A     0.303     0    0.047   0.047     0.303  100.000  100.000
LGA    E    71_A      E    71_A     0.224     0    0.022   0.250     1.066  100.000   96.878
LGA    R    72_A      R    72_A     0.420     0    0.051   0.103     0.719   95.238   98.268
LGA    S    73_A      S    73_A     0.643     0    0.093   0.108     0.855   92.857   92.063
LGA    F    74_A      F    74_A     0.208     0    0.018   0.085     0.348  100.000  100.000
LGA    T    75_A      T    75_A     0.158     0    0.040   0.038     0.182  100.000  100.000
LGA    H    76_A      H    76_A     0.157     0    0.042   0.119     0.250  100.000  100.000
LGA    L    77_A      L    77_A     0.170     0    0.019   0.038     0.236  100.000  100.000
LGA    V    78_A      V    78_A     0.193     0    0.035   1.344     2.616  100.000   88.844
LGA    V    79_A      V    79_A     0.193     0    0.044   1.327     2.761  100.000   88.844
LGA    A    80_A      A    80_A     0.152     0    0.016   0.027     0.194  100.000  100.000
LGA    G    81_A      G    81_A     0.136     0    0.021   0.021     0.451  100.000  100.000
LGA    H    82_A      H    82_A     0.338     0    0.019   0.117     0.769  100.000   96.190
LGA    T    83_A      T    83_A     0.373     0    0.010   0.023     0.614  100.000   97.279
LGA    P    84_A      P    84_A     0.407     0    0.037   0.048     0.501  100.000   98.639
LGA    D    85_A      D    85_A     0.547     0    0.039   0.100     0.884   92.857   91.667
LGA    P    86_A      P    86_A     0.429     0    0.056   0.068     0.448  100.000  100.000
LGA    I    87_A      I    87_A     0.290     0    0.012   0.521     1.960  100.000   96.607
LGA    S    88_A      S    88_A     0.640     0    0.066   0.113     1.202   97.619   93.730
LGA    P    89_A      P    89_A     0.547     0    0.040   0.359     1.373   92.857   90.544
LGA    C    90_A      C    90_A     0.618     0    0.027   0.074     0.806   92.857   92.063
LGA    G    91_A      G    91_A     0.560     0    0.033   0.033     0.574   92.857   92.857
LGA    A    92_A      A    92_A     0.624     0    0.007   0.007     0.732   90.476   90.476
LGA    C    93_A      C    93_A     0.397     0    0.016   0.042     0.490  100.000  100.000
LGA    R    94_A      R    94_A     0.351     0    0.023   0.093     0.869  100.000   96.537
LGA    Q    95_A      Q    95_A     0.350     0    0.029   0.096     0.525  100.000   98.942
LGA    V    96_A      V    96_A     0.343     0    0.012   1.333     2.774  100.000   88.844
LGA    M    97_A      M    97_A     0.413     0    0.013   0.899     2.465  100.000   93.214
LGA    A    98_A      A    98_A     0.352     0    0.020   0.024     0.428  100.000  100.000
LGA    E    99_A      E    99_A     0.487     0    0.025   0.306     1.759  100.000   90.741
LGA    F   100_A      F   100_A     0.260     0    0.019   0.076     0.353  100.000  100.000
LGA    C   101_A      C   101_A     0.038     0    0.030   0.043     0.142  100.000  100.000
LGA    A   102_A      A   102_A     0.120     0    0.033   0.029     0.161  100.000  100.000
LGA    P   103_A      P   103_A     0.123     0    0.052   0.071     0.394  100.000  100.000
LGA    D   104_A      D   104_A     0.168     0    0.022   0.541     1.302  100.000   95.357
LGA    M   105_A      M   105_A     0.057     0    0.026   0.311     0.754  100.000   98.810
LGA    P   106_A      P   106_A     0.130     0    0.043   0.305     0.997  100.000   98.639
LGA    V   107_A      V   107_A     0.293     0    0.016   1.349     2.671  100.000   88.844
LGA    T   108_A      T   108_A     0.449     0    0.039   0.037     0.449  100.000  100.000
LGA    L   109_A      L   109_A     0.462     0    0.043   1.252     3.134   97.619   87.976
LGA    V   110_A      V   110_A     0.248     0    0.060   1.339     2.571  100.000   88.844
LGA    G   111_A      G   111_A     0.424     0    0.018   0.018     0.435  100.000  100.000
LGA    D   112_A      D   112_A     0.603     0    0.017   0.176     2.027   95.238   86.310
LGA    N   113_A      N   113_A     0.433     0    0.029   0.846     2.990   95.238   87.560
LGA    G   114_A      G   114_A     0.991     0    0.022   0.022     0.991   90.476   90.476
LGA    V   115_A      V   115_A     0.292     0    0.054   0.630     2.717   97.619   91.156
LGA    T   116_A      T   116_A     0.136     0    0.041   0.069     0.558  100.000   98.639
LGA    K   117_A      K   117_A     0.187     0    0.022   0.660     2.114  100.000   90.952
LGA    A   118_A      A   118_A     0.411     0    0.050   0.066     0.469  100.000  100.000
LGA    T   119_A      T   119_A     0.312     0    0.032   0.100     0.516  100.000   98.639
LGA    T   120_A      T   120_A     0.283     0    0.014   0.039     0.437  100.000  100.000
LGA    V   121_A      V   121_A     0.178     0    0.025   1.329     2.611  100.000   88.844
LGA    R   122_A      R   122_A     0.206     0    0.009   0.347     1.555  100.000   93.290
LGA    E   123_A      E   123_A     0.394     0    0.016   0.461     1.280  100.000   95.873
LGA    L   124_A      L   124_A     0.325     0    0.048   1.254     2.969  100.000   90.238
LGA    L   125_A      L   125_A     0.352     0    0.016   0.160     1.101   95.238   91.726
LGA    P   126_A      P   126_A     0.845     0    0.656   0.633     2.638   82.143   84.422
LGA    Y   127_A      Y   127_A     2.202     0    0.044   1.331     7.110   64.762   47.381
LGA    A   128_A      A   128_A     1.692     0    0.036   0.050     1.901   77.143   76.286
LGA    F   129_A      F   129_A     1.274     0    0.076   0.214     1.495   81.429   83.074
LGA    T   130_A      T   130_A     0.598     0    0.042   0.103     1.565   85.952   81.565
LGA    E   131_A      E   131_A     2.096     0    0.113   0.766     3.466   68.929   60.794
LGA    K   132_A      K   132_A     2.309     0    0.066   0.902     4.175   57.500   54.339
LGA    D   133_A      D   133_A     3.259     0    0.057   0.190     5.565   53.571   42.083
LGA    L   134_A      L   134_A     2.588     0    0.019   0.618     3.943   53.810   59.464

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      133     532    532  100.00    1010   1010  100.00               133
SUMMARY(RMSD_GDC):     2.008          1.975                  2.268           92.699   88.971

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  134  133    4.0    128    0.68    94.925    96.448    16.385

LGA_LOCAL      RMSD:   0.681  Number of atoms:  128  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   2.083  Number of assigned atoms:  133 
Std_ASGN_ATOMS RMSD:   2.008  Standard rmsd on all 133 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.655085 * X  +   0.402890 * Y  +   0.639174 * Z  + -28.555548
  Y_new =  -0.750071 * X  +  -0.448526 * Y  +  -0.486023 * Z  +  25.269094
  Z_new =   0.090872 * X  +  -0.797812 * Y  +   0.596019 * Z  + -12.495365 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -2.288699 -0.090998 -0.929175   [DEG: -131.1328   -5.2138  -53.2378 ]
ZXZ:  0.920677  0.932262  3.028180   [DEG:   52.7509   53.4147  173.5019 ]
 
# END of job
