
#######################################################
#                                                     #
#                        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  160 ( 1315),  selected  160 , name one
# Molecule2: number of CA atoms  160 ( 1315),  selected  160 , 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:   160       1_A - 160_A       3.36     3.36
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   151       1_A - 151_A       1.99     3.59
  LCS_AVERAGE:     89.70

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    82      50_A - 131_A       1.00     3.60
  LCS_AVERAGE:     37.57

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  160
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     M     1_A     M     1_A     47  151  160      4   64  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     K     2_A     K     2_A     47  151  160     21   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     N     3_A     N     3_A     47  151  160     20   79  116  133  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     F     4_A     F     4_A     47  151  160     29   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     E     5_A     E     5_A     47  151  160     24   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     I     6_A     I     6_A     47  151  160     26   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     V     7_A     V     7_A     47  151  160     24   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     T     8_A     T     8_A     47  151  160     24   75  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     V     9_A     V     9_A     47  151  160     14   64  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     T    10_A     T    10_A     47  151  160     14   59  106  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     P    11_A     P    11_A     47  151  160     14   59   93  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     D    12_A     D    12_A     47  151  160     14   59   90  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     H    13_A     H    13_A     47  151  160     19   71  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     A    14_A     A    14_A     47  151  160     24   74  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     E    15_A     E    15_A     47  151  160     14   71  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     Q    16_A     Q    16_A     47  151  160     24   75  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     L    17_A     L    17_A     47  151  160     24   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     I    18_A     I    18_A     47  151  160     24   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     S    19_A     S    19_A     47  151  160     24   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     M    20_A     M    20_A     47  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     I    21_A     I    21_A     47  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     H    22_A     H    22_A     47  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     E    23_A     E    23_A     47  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     L    24_A     L    24_A     47  151  160     28   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     A    25_A     A    25_A     47  151  160     23   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     E    26_A     E    26_A     47  151  160     23   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     F    27_A     F    27_A     47  151  160     24   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     E    28_A     E    28_A     47  151  160     29   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     K    29_A     K    29_A     47  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     M    30_A     M    30_A     47  151  160     14   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     K    31_A     K    31_A     47  151  160      4   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     S    32_A     S    32_A     47  151  160     20   75  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     S    33_A     S    33_A     47  151  160     22   75  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     V    34_A     V    34_A     47  151  160     20   75  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     V    35_A     V    35_A     47  151  160     18   71  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     N    36_A     N    36_A     47  151  160      5   32  102  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     T    37_A     T    37_A     47  151  160      6   32  102  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     A    38_A     A    38_A     47  151  160      6   32   98  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     E    39_A     E    39_A     47  151  160     14   71  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     K    40_A     K    40_A     47  151  160     24   75  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     L    41_A     L    41_A     47  151  160     12   71  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     R    42_A     R    42_A     47  151  160     18   74  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     K    43_A     K    43_A     47  151  160     24   71  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     D    44_A     D    44_A     47  151  160      5   61  105  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     I    45_A     I    45_A     47  151  160      4   22   60  135  142  145  147  147  148  148  149  149  149  153  154  157  160  160  160  160 
LCS_GDT     E    46_A     E    46_A     47  151  160      4   21   89  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     N    47_A     N    47_A     75  151  160      3   70  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     K    48_A     K    48_A     75  151  160      5   10   93  131  142  145  147  147  148  148  149  149  149  152  154  155  160  160  160  160 
LCS_GDT     A    49_A     A    49_A     79  151  160      9   17   53  116  139  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     V    50_A     V    50_A     82  151  160     12   78  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     H    51_A     H    51_A     82  151  160     24   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     G    52_A     G    52_A     82  151  160     11   69  106  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     F    53_A     F    53_A     82  151  160     15   71  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     I    54_A     I    54_A     82  151  160     25   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     A    55_A     A    55_A     82  151  160     31   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     F    56_A     F    56_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     I    57_A     I    57_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     G    58_A     G    58_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     E    59_A     E    59_A     82  151  160      4   21   38  125  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     E    60_A     E    60_A     82  151  160     29   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     P    61_A     P    61_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     A    62_A     A    62_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     G    63_A     G    63_A     82  151  160     21   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     M    64_A     M    64_A     82  151  160     24   75  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     N    65_A     N    65_A     82  151  160      9   71  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     L    66_A     L    66_A     82  151  160     24   75  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     F    67_A     F    67_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     Y    68_A     Y    68_A     82  151  160     28   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     Y    69_A     Y    69_A     82  151  160     25   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     A    70_A     A    70_A     82  151  160     17   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     Y    71_A     Y    71_A     82  151  160     17   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     S    72_A     S    72_A     82  151  160      4   56  109  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     T    73_A     T    73_A     82  151  160     10   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     W    74_A     W    74_A     82  151  160     18   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     V    75_A     V    75_A     82  151  160      6   75  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     G    76_A     G    76_A     82  151  160      6   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     Q    77_A     Q    77_A     82  151  160      6   41  106  133  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     Y    78_A     Y    78_A     82  151  160     25   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     L    79_A     L    79_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     H    80_A     H    80_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     M    81_A     M    81_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     E    82_A     E    82_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     D    83_A     D    83_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     L    84_A     L    84_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     Y    85_A     Y    85_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     I    86_A     I    86_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     R    87_A     R    87_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     P    88_A     P    88_A     82  151  160     24   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     Q    89_A     Q    89_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     F    90_A     F    90_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     R    91_A     R    91_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     R    92_A     R    92_A     82  151  160     21   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     M    93_A     M    93_A     82  151  160     23   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     G    94_A     G    94_A     82  151  160     29   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     L    95_A     L    95_A     82  151  160     23   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     A    96_A     A    96_A     82  151  160     14   68  115  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     R    97_A     R    97_A     82  151  160     20   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     T    98_A     T    98_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     L    99_A     L    99_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     W   100_A     W   100_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     K   101_A     K   101_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     K   102_A     K   102_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     L   103_A     L   103_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     A   104_A     A   104_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     E   105_A     E   105_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     L   106_A     L   106_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     A   107_A     A   107_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     R   108_A     R   108_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     D   109_A     D   109_A     82  151  160     27   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     K   110_A     K   110_A     82  151  160     23   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     G   111_A     G   111_A     82  151  160     17   76  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     I   112_A     I   112_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     V   113_A     V   113_A     82  151  160     19   74  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     R   114_A     R   114_A     82  151  160     11   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     L   115_A     L   115_A     82  151  160     12   73  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     E   116_A     E   116_A     82  151  160     12   71  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     W   117_A     W   117_A     82  151  160     29   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     A   118_A     A   118_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     V   119_A     V   119_A     82  151  160     30   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     L   120_A     L   120_A     82  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     D   121_A     D   121_A     82  151  160     12   73  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     W   122_A     W   122_A     82  151  160     11   64  112  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     N   123_A     N   123_A     82  151  160     11   68  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     K   124_A     K   124_A     82  151  160     11   65  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     N   125_A     N   125_A     82  151  160      8   61  112  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     A   126_A     A   126_A     82  151  160     12   72  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     I   127_A     I   127_A     82  151  160     11   65  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     A   128_A     A   128_A     82  151  160      4   26  103  133  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     L   129_A     L   129_A     82  151  160     11   65  112  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     Y   130_A     Y   130_A     82  151  160     32   76  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     D   131_A     D   131_A     82  151  160      5   65  114  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     T   132_A     T   132_A     80  151  160      3   26   93  128  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     V   133_A     V   133_A     67  151  160      4   41   91  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     D   134_A     D   134_A     37  151  160      4   41   91  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     Y   135_A     Y   135_A     23  151  160     12   45  109  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     V   136_A     V   136_A     23  151  160     12   26   77  127  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     N   137_A     N   137_A     23  151  160     15   76  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     L   138_A     L   138_A      8  151  160     23   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     T   139_A     T   139_A      8  151  160     11   41  113  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     K   140_A     K   140_A      8  151  160      3   29   76  125  138  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     S   141_A     S   141_A      8  151  160      3    6   65  114  137  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     E   142_A     E   142_A      8  151  160      2    6    8   69  134  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     G   143_A     G   143_A      8  151  160     24   72  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     W   144_A     W   144_A      8  151  160     24   73  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     F   145_A     F   145_A      8  151  160      4   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     T   146_A     T   146_A      8  151  160     32   79  116  135  142  145  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     F   147_A     F   147_A     13  151  160      5   10   13   35   93  143  147  147  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     R   148_A     R   148_A     13  151  160      5   10   13   26   46   76  117  145  148  148  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     M   149_A     M   149_A     13  151  160      5   10   13   16   28   48   72  104  126  143  149  149  150  153  154  157  160  160  160  160 
LCS_GDT     D   150_A     D   150_A     13  151  160      3    7   13   15   20   29   40   55   67   94  112  143  148  153  154  157  160  160  160  160 
LCS_GDT     G   151_A     G   151_A     13  151  160      3    9   13   15   20   29   38   50   62   79   97  117  131  147  154  157  160  160  160  160 
LCS_GDT     A   152_A     A   152_A     13   18  160      3   10   13   14   19   25   38   47   60   72   90  105  120  140  147  155  160  160  160  160 
LCS_GDT     A   153_A     A   153_A     13   18  160      6   10   13   15   20   29   40   56   73   95  117  133  147  153  154  157  160  160  160  160 
LCS_GDT     I   154_A     I   154_A     13   18  160      6   10   13   15   20   29   39   55   75   97  133  144  150  153  154  157  160  160  160  160 
LCS_GDT     N   155_A     N   155_A     13   18  160      6   10   13   14   19   24   38   45   56   69   83  110  126  140  148  157  160  160  160  160 
LCS_GDT     K   156_A     K   156_A     13   18  160      6   10   13   15   20   29   38   50   62   77   93  111  127  140  151  157  160  160  160  160 
LCS_GDT     F   157_A     F   157_A     13   18  160      6   10   13   15   20   36   51   69   93  117  135  145  150  153  154  157  160  160  160  160 
LCS_GDT     A   158_A     A   158_A     13   18  160      6   10   13   14   19   27   38   58   74  103  133  144  150  153  154  157  160  160  160  160 
LCS_GDT     D   159_A     D   159_A     13   18  160      6   10   13   14   19   29   38   45   59   72   83  111  126  140  148  157  160  160  160  160 
LCS_GDT     E   160_A     E   160_A     10   18  160      0    3   10   16   20   29   39   51   62   77   93  111  126  143  151  156  160  160  160  160 
LCS_AVERAGE  LCS_A:  75.76  (  37.57   89.70  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     32     79    116    135    142    145    147    147    148    148    149    149    150    153    154    157    160    160    160    160 
GDT PERCENT_AT  20.00  49.38  72.50  84.38  88.75  90.62  91.88  91.88  92.50  92.50  93.12  93.12  93.75  95.62  96.25  98.12 100.00 100.00 100.00 100.00
GDT RMS_LOCAL    0.36   0.67   0.96   1.15   1.24   1.31   1.36   1.36   1.42   1.42   1.54   1.54   2.09   2.39   2.40   3.06   3.36   3.36   3.36   3.36
GDT RMS_ALL_AT   3.60   3.68   3.72   3.75   3.76   3.73   3.73   3.73   3.71   3.71   3.68   3.68   3.51   3.47   3.48   3.37   3.36   3.36   3.36   3.36

# Checking swapping
#   possible swapping detected:  E     5_A      E     5_A
#   possible swapping detected:  D    12_A      D    12_A
#   possible swapping detected:  F    53_A      F    53_A
#   possible swapping detected:  F    56_A      F    56_A
#   possible swapping detected:  E    59_A      E    59_A
#   possible swapping detected:  Y    69_A      Y    69_A
#   possible swapping detected:  Y    78_A      Y    78_A
#   possible swapping detected:  F    90_A      F    90_A
#   possible swapping detected:  Y   135_A      Y   135_A
#   possible swapping detected:  F   147_A      F   147_A
#   possible swapping detected:  D   159_A      D   159_A
#   possible swapping detected:  E   160_A      E   160_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    M     1_A      M     1_A     1.391     0    0.280   0.859     4.909   83.810   65.476
LGA    K     2_A      K     2_A     1.223     0    0.098   1.116     5.297   83.690   61.164
LGA    N     3_A      N     3_A     1.438     0    0.081   0.937     5.098   77.143   61.012
LGA    F     4_A      F     4_A     1.009     0    0.125   1.352     6.485   83.690   61.039
LGA    E     5_A      E     5_A     0.772     0    0.051   0.664     3.199   90.476   73.280
LGA    I     6_A      I     6_A     0.762     0    0.064   0.615     1.196   90.476   88.214
LGA    V     7_A      V     7_A     0.623     0    0.064   1.188     2.826   92.857   82.313
LGA    T     8_A      T     8_A     1.019     0    0.047   1.108     3.948   88.214   75.170
LGA    V     9_A      V     9_A     1.478     0    0.118   0.966     3.526   77.143   73.605
LGA    T    10_A      T    10_A     1.821     0    0.058   1.066     3.792   72.857   69.864
LGA    P    11_A      P    11_A     2.000     0    0.040   0.119     2.060   68.810   68.231
LGA    D    12_A      D    12_A     2.170     0    0.039   0.685     3.877   68.810   61.250
LGA    H    13_A      H    13_A     1.063     0    0.030   0.469     1.509   85.952   82.429
LGA    A    14_A      A    14_A     0.993     0    0.097   0.092     1.273   88.214   86.857
LGA    E    15_A      E    15_A     1.249     0    0.107   1.183     2.377   83.690   81.905
LGA    Q    16_A      Q    16_A     0.744     0    0.040   1.749     6.268   90.476   65.238
LGA    L    17_A      L    17_A     0.457     0    0.045   0.812     3.835   97.619   81.726
LGA    I    18_A      I    18_A     0.436     0    0.040   0.135     1.041  100.000   95.298
LGA    S    19_A      S    19_A     0.281     0    0.076   0.536     1.850  100.000   95.476
LGA    M    20_A      M    20_A     0.567     0    0.046   0.919     2.129   92.857   84.048
LGA    I    21_A      I    21_A     0.485     0    0.068   0.176     0.635   97.619   95.238
LGA    H    22_A      H    22_A     0.428     0    0.027   0.460     1.172   95.238   92.476
LGA    E    23_A      E    23_A     0.533     0    0.057   0.301     0.995   90.476   93.651
LGA    L    24_A      L    24_A     0.958     0    0.036   0.126     1.243   88.214   88.214
LGA    A    25_A      A    25_A     0.918     0    0.039   0.043     1.169   88.214   88.667
LGA    E    26_A      E    26_A     0.776     0    0.042   0.805     4.146   90.476   77.143
LGA    F    27_A      F    27_A     0.833     0    0.049   0.353     1.202   90.476   88.831
LGA    E    28_A      E    28_A     0.717     0    0.150   0.409     2.266   95.238   84.815
LGA    K    29_A      K    29_A     0.743     0    0.136   0.891     3.139   88.214   76.455
LGA    M    30_A      M    30_A     1.373     0    0.273   0.774     2.401   88.333   80.655
LGA    K    31_A      K    31_A     1.148     0    0.040   0.863     5.214   85.952   67.566
LGA    S    32_A      S    32_A     1.196     0    0.053   0.598     3.305   83.690   77.698
LGA    S    33_A      S    33_A     1.069     0    0.013   0.793     2.797   83.690   80.397
LGA    V    34_A      V    34_A     1.069     0    0.111   0.201     1.516   79.286   81.497
LGA    V    35_A      V    35_A     1.357     0    0.135   0.155     2.180   75.119   77.823
LGA    N    36_A      N    36_A     1.940     0    0.091   0.926     3.890   70.833   61.488
LGA    T    37_A      T    37_A     1.875     0    0.030   0.076     2.042   72.857   71.701
LGA    A    38_A      A    38_A     1.874     0    0.058   0.076     1.972   72.857   72.857
LGA    E    39_A      E    39_A     1.321     0    0.059   1.086     4.485   83.810   70.265
LGA    K    40_A      K    40_A     1.002     0    0.039   0.402     3.117   81.429   75.132
LGA    L    41_A      L    41_A     1.350     0    0.036   0.206     1.628   81.429   81.488
LGA    R    42_A      R    42_A     1.007     0    0.076   1.555     7.230   81.429   65.974
LGA    K    43_A      K    43_A     1.422     0    0.040   0.742     4.386   77.143   66.720
LGA    D    44_A      D    44_A     1.982     0    0.115   0.186     2.253   68.810   66.786
LGA    I    45_A      I    45_A     2.410     0    0.031   1.123     3.912   64.762   64.226
LGA    E    46_A      E    46_A     1.982     0    0.027   0.182     2.098   70.833   71.111
LGA    N    47_A      N    47_A     1.137     0    0.548   0.809     4.903   77.619   62.500
LGA    K    48_A      K    48_A     2.455     0    0.658   1.275    10.832   77.381   41.217
LGA    A    49_A      A    49_A     3.074     0    0.087   0.086     4.890   54.286   49.714
LGA    V    50_A      V    50_A     1.490     0    0.037   1.056     3.678   79.286   70.068
LGA    H    51_A      H    51_A     0.623     0    0.036   1.121     5.860   90.476   64.381
LGA    G    52_A      G    52_A     1.733     0    0.138   0.138     2.172   72.976   72.976
LGA    F    53_A      F    53_A     1.372     0    0.135   0.225     2.500   79.286   73.074
LGA    I    54_A      I    54_A     0.520     0    0.046   1.131     3.454   92.857   79.226
LGA    A    55_A      A    55_A     0.548     0    0.103   0.107     0.642   92.857   92.381
LGA    F    56_A      F    56_A     0.864     0    0.059   0.321     1.177   88.214   86.364
LGA    I    57_A      I    57_A     0.810     0    0.048   0.558     2.516   90.476   86.310
LGA    G    58_A      G    58_A     0.942     0    0.571   0.571     1.751   86.071   86.071
LGA    E    59_A      E    59_A     2.500     0    0.216   1.146     4.683   68.810   56.455
LGA    E    60_A      E    60_A     1.216     0    0.092   0.240     3.555   88.333   74.762
LGA    P    61_A      P    61_A     0.934     0    0.092   0.240     2.027   88.214   82.925
LGA    A    62_A      A    62_A     0.563     0    0.227   0.258     0.740   90.476   92.381
LGA    G    63_A      G    63_A     0.956     0    0.035   0.035     1.011   88.214   88.214
LGA    M    64_A      M    64_A     1.009     0    0.067   0.616     1.828   83.690   81.488
LGA    N    65_A      N    65_A     1.363     0    0.135   0.317     2.111   79.286   77.202
LGA    L    66_A      L    66_A     0.934     0    0.117   0.812     4.384   85.952   71.190
LGA    F    67_A      F    67_A     0.565     0    0.035   0.102     0.804   90.476   94.805
LGA    Y    68_A      Y    68_A     1.102     0    0.048   0.127     1.263   88.214   83.690
LGA    Y    69_A      Y    69_A     1.310     0    0.045   0.270     2.060   81.429   74.365
LGA    A    70_A      A    70_A     1.342     0    0.096   0.106     1.574   83.690   81.524
LGA    Y    71_A      Y    71_A     1.308     0    0.031   0.129     1.938   77.143   81.508
LGA    S    72_A      S    72_A     1.816     0    0.053   0.083     2.258   77.143   73.016
LGA    T    73_A      T    73_A     1.144     0    0.119   1.218     3.360   83.690   75.850
LGA    W    74_A      W    74_A     1.026     0    0.168   0.219     2.932   83.690   76.871
LGA    V    75_A      V    75_A     1.474     0    0.376   1.245     3.498   71.429   66.735
LGA    G    76_A      G    76_A     1.181     0    0.652   0.652     2.927   77.619   77.619
LGA    Q    77_A      Q    77_A     2.111     0    0.179   1.110     7.574   64.881   47.196
LGA    Y    78_A      Y    78_A     1.126     0    0.052   0.256     1.428   81.429   90.635
LGA    L    79_A      L    79_A     0.629     0    0.023   0.867     3.068   90.476   81.012
LGA    H    80_A      H    80_A     0.497     0    0.016   1.142     2.298   97.619   85.524
LGA    M    81_A      M    81_A     0.290     0    0.035   0.151     1.088  100.000   96.488
LGA    E    82_A      E    82_A     0.443     0    0.121   0.804     3.917   92.976   78.148
LGA    D    83_A      D    83_A     0.571     0    0.061   0.202     1.266   97.619   90.655
LGA    L    84_A      L    84_A     0.525     0    0.073   0.200     0.841   90.476   91.667
LGA    Y    85_A      Y    85_A     0.685     0    0.011   0.144     0.728   90.476   92.857
LGA    I    86_A      I    86_A     0.738     0    0.024   1.047     2.644   90.476   79.940
LGA    R    87_A      R    87_A     0.491     0    0.041   0.663     3.206   92.857   82.121
LGA    P    88_A      P    88_A     0.931     0    0.100   0.126     1.449   90.476   86.599
LGA    Q    89_A      Q    89_A     0.531     0    0.305   1.118     5.676   86.071   67.407
LGA    F    90_A      F    90_A     0.724     0    0.195   0.378     3.250   95.238   74.719
LGA    R    91_A      R    91_A     0.499     0    0.622   0.932     2.994   84.524   85.887
LGA    R    92_A      R    92_A     1.403     0    0.299   1.757     9.845   79.286   44.156
LGA    M    93_A      M    93_A     1.231     0    0.231   1.081     6.330   83.690   60.417
LGA    G    94_A      G    94_A     0.627     0    0.186   0.186     1.388   88.214   88.214
LGA    L    95_A      L    95_A     0.999     0    0.032   0.938     2.909   85.952   78.571
LGA    A    96_A      A    96_A     1.586     0    0.187   0.223     2.048   79.286   76.381
LGA    R    97_A      R    97_A     0.740     0    0.068   0.593     3.579   95.238   75.628
LGA    T    98_A      T    98_A     0.475     0    0.064   0.113     0.932   97.619   94.558
LGA    L    99_A      L    99_A     0.634     0    0.049   0.074     0.890   90.476   90.476
LGA    W   100_A      W   100_A     0.554     0    0.027   0.484     1.800   90.476   88.027
LGA    K   101_A      K   101_A     0.928     0    0.048   0.940     3.158   85.952   81.005
LGA    K   102_A      K   102_A     0.972     0    0.082   0.695     2.854   85.952   75.344
LGA    L   103_A      L   103_A     0.535     0    0.046   1.043     3.847   92.857   82.560
LGA    A   104_A      A   104_A     0.568     0    0.047   0.048     0.586   90.476   90.476
LGA    E   105_A      E   105_A     0.680     0    0.052   0.989     4.888   92.857   75.979
LGA    L   106_A      L   106_A     0.589     0    0.053   1.135     2.699   90.476   83.333
LGA    A   107_A      A   107_A     0.560     0    0.048   0.047     0.629   92.857   92.381
LGA    R   108_A      R   108_A     0.937     0    0.045   1.665     9.519   85.952   55.238
LGA    D   109_A      D   109_A     1.269     0    0.055   0.927     3.662   79.286   67.798
LGA    K   110_A      K   110_A     1.052     0    0.091   1.030     3.243   85.952   75.503
LGA    G   111_A      G   111_A     1.129     0    0.074   0.074     1.174   81.429   81.429
LGA    I   112_A      I   112_A     0.756     0    0.018   0.118     2.009   90.476   83.869
LGA    V   113_A      V   113_A     1.147     0    0.270   1.374     4.751   85.952   75.782
LGA    R   114_A      R   114_A     0.967     0    0.028   0.864     2.934   90.476   78.615
LGA    L   115_A      L   115_A     1.175     0    0.174   1.133     3.104   83.690   76.548
LGA    E   116_A      E   116_A     1.277     0    0.037   0.465     2.446   85.952   77.831
LGA    W   117_A      W   117_A     0.539     0    0.045   0.272     1.494   95.238   91.258
LGA    A   118_A      A   118_A     0.168     0    0.042   0.075     0.356  100.000  100.000
LGA    V   119_A      V   119_A     0.442     0    0.039   0.116     1.235  100.000   93.333
LGA    L   120_A      L   120_A     0.357     0    0.084   1.069     3.460   95.238   86.786
LGA    D   121_A      D   121_A     1.214     0    0.047   0.240     1.611   83.690   82.619
LGA    W   122_A      W   122_A     1.637     0    0.068   0.189     1.800   75.000   82.891
LGA    N   123_A      N   123_A     1.298     0    0.074   0.106     1.561   79.286   80.417
LGA    K   124_A      K   124_A     1.541     0    0.097   1.416     8.479   75.000   57.037
LGA    N   125_A      N   125_A     1.636     0    0.033   1.045     3.135   72.857   68.036
LGA    A   126_A      A   126_A     1.087     0    0.039   0.043     1.262   81.429   83.238
LGA    I   127_A      I   127_A     1.488     0    0.049   0.120     1.838   77.143   76.071
LGA    A   128_A      A   128_A     2.154     0    0.062   0.080     2.488   68.810   68.000
LGA    L   129_A      L   129_A     1.682     0    0.087   1.132     2.790   79.405   72.202
LGA    Y   130_A      Y   130_A     0.879     0    0.108   0.304     1.156   88.214   89.722
LGA    D   131_A      D   131_A     1.628     0    0.181   0.862     3.301   75.000   67.083
LGA    T   132_A      T   132_A     2.585     0    0.321   0.339     3.321   59.167   56.259
LGA    V   133_A      V   133_A     2.330     0    0.521   0.896     3.091   63.095   59.524
LGA    D   134_A      D   134_A     2.273     0    0.533   1.065     4.841   60.952   51.607
LGA    Y   135_A      Y   135_A     1.943     0    0.032   1.422    11.452   64.881   38.810
LGA    V   136_A      V   136_A     2.620     0    0.019   0.074     4.345   71.310   59.388
LGA    N   137_A      N   137_A     1.211     0    0.242   0.802     2.674   77.143   74.107
LGA    L   138_A      L   138_A     0.911     0    0.281   0.847     2.860   90.476   83.095
LGA    T   139_A      T   139_A     1.745     0    0.104   1.138     5.342   75.000   62.925
LGA    K   140_A      K   140_A     3.086     0    0.628   1.038     7.802   50.833   31.270
LGA    S   141_A      S   141_A     3.237     0    0.502   0.714     4.500   57.262   49.603
LGA    E   142_A      E   142_A     3.255     0    0.209   0.890     8.725   55.476   32.487
LGA    G   143_A      G   143_A     1.228     0    0.400   0.400     1.810   77.143   77.143
LGA    W   144_A      W   144_A     1.071     0    0.061   0.203     1.602   81.429   83.401
LGA    F   145_A      F   145_A     1.102     0    0.100   1.196     7.326   88.333   54.156
LGA    T   146_A      T   146_A     0.614     0    0.135   1.031     3.650   77.738   70.272
LGA    F   147_A      F   147_A     3.448     0    0.126   0.707     6.639   53.810   33.636
LGA    R   148_A      R   148_A     5.284     0    0.060   0.946     9.783   21.190   14.632
LGA    M   149_A      M   149_A     7.502     0    0.024   0.966     8.332    9.048   11.250
LGA    D   150_A      D   150_A    10.596     0    0.032   1.226    15.908    0.119    0.060
LGA    G   151_A      G   151_A    12.214     0    0.490   0.490    13.355    0.000    0.000
LGA    A   152_A      A   152_A    14.319     0    0.060   0.084    14.966    0.000    0.000
LGA    A   153_A      A   153_A    11.754     0    0.038   0.049    12.568    0.000    0.000
LGA    I   154_A      I   154_A    10.392     0    0.045   1.043    11.425    0.000    0.119
LGA    N   155_A      N   155_A    13.943     0    0.039   0.171    17.102    0.000    0.000
LGA    K   156_A      K   156_A    14.487     0    0.079   1.315    20.734    0.000    0.000
LGA    F   157_A      F   157_A    10.973     0    0.087   0.521    12.040    0.000    6.623
LGA    A   158_A      A   158_A    11.288     0    0.112   0.109    12.527    0.000    0.000
LGA    D   159_A      D   159_A    15.318     0    0.670   1.157    16.669    0.000    0.000
LGA    E   160_A      E   160_A    16.418     0    0.614   0.983    17.297    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      160     640    640  100.00    1315   1315  100.00               160
SUMMARY(RMSD_GDC):     3.363          3.341                  3.810           76.560   69.609

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  160  160    4.0    147    1.36    80.938    86.449    10.101

LGA_LOCAL      RMSD:   1.355  Number of atoms:  147  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   3.728  Number of assigned atoms:  160 
Std_ASGN_ATOMS RMSD:   3.363  Standard rmsd on all 160 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.970838 * X  +   0.237948 * Y  +  -0.029216 * Z  + -33.992447
  Y_new =   0.238429 * X  +  -0.945643 * Y  +   0.221158 * Z  +  34.456802
  Z_new =   0.024996 * X  +  -0.221675 * Y  +  -0.974800 * Z  +  16.027948 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  0.240824 -0.024999 -2.917990   [DEG:   13.7982   -1.4323 -167.1885 ]
ZXZ: -3.010248  2.916620  3.029307   [DEG: -172.4745  167.1100  173.5665 ]
 
# END of job
