
#######################################################
#                                                     #
#                        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  155 ( 1262),  selected  153 , name one
# Molecule2: number of CA atoms  153 ( 1242),  selected  153 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:C  -ch2:C  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   117      37_C - 153_C       4.63     9.92
  LCS_AVERAGE:     68.94

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   111      43_C - 153_C       1.72    13.90
  LCS_AVERAGE:     61.78

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   106      46_C - 151_C       0.99    14.81
  LONGEST_CONTINUOUS_SEGMENT:   106      47_C - 152_C       0.98    14.88
  LCS_AVERAGE:     57.77

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  153
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_C     M     1_C     44   51   68      0    3    3    3    3    7   32   37   50   59   63   68   73   80   90   99  113  125  131  138 
LCS_GDT     H     2_C     H     2_C     47   51   68      8   39   46   47   48   49   52   53   57   59   63   68   73   80   92  106  119  125  131  138 
LCS_GDT     C     3_C     C     3_C     47   51   68     30   42   46   47   48   49   52   53   57   59   63   68   73   80   86   99  109  120  131  138 
LCS_GDT     P     4_C     P     4_C     47   51   68     23   42   46   47   48   49   52   53   57   59   63   68   73   80   86   94  105  114  127  138 
LCS_GDT     F     5_C     F     5_C     47   51   68     30   42   46   47   48   49   52   53   57   59   62   68   73   80   85   94  102  110  121  125 
LCS_GDT     C     6_C     C     6_C     47   51   68     30   42   46   47   48   49   52   53   57   59   62   68   73   80   85   93   99  109  117  124 
LCS_GDT     F     7_C     F     7_C     47   51   68     28   42   46   47   48   49   52   53   57   59   62   68   73   80   85   94  102  110  121  127 
LCS_GDT     A     8_C     A     8_C     47   51   68     30   42   46   47   48   49   52   53   57   59   63   68   73   80   85   94  102  111  121  129 
LCS_GDT     V     9_C     V     9_C     47   51   68     23   42   46   47   48   49   52   53   57   59   63   68   73   80   86   94  102  114  125  136 
LCS_GDT     D    10_C     D    10_C     47   51   68      4   25   44   47   48   49   52   53   57   59   63   68   73   80   86   99  112  123  131  138 
LCS_GDT     T    11_C     T    11_C     47   51   68     30   42   46   47   48   49   52   53   57   59   63   68   73   86  102  114  121  127  133  138 
LCS_GDT     K    12_C     K    12_C     47   51   68     30   42   46   47   48   49   52   53   57   59   63   75   90  104  114  120  124  128  133  138 
LCS_GDT     V    13_C     V    13_C     47   51   68     30   42   46   47   48   49   52   53   57   67   87   96  104  113  118  123  126  128  133  138 
LCS_GDT     I    14_C     I    14_C     47   51   68     30   42   46   47   48   49   52   53   57   67   88   96  104  113  118  123  126  128  133  138 
LCS_GDT     D    15_C     D    15_C     47   51   68     30   42   46   47   48   49   52   57   66   82   91   99  108  114  120  123  126  128  133  138 
LCS_GDT     S    16_C     S    16_C     47   51   68     30   42   46   47   48   49   58   70   81   87   96  107  115  119  121  123  126  128  133  138 
LCS_GDT     R    17_C     R    17_C     47   51   68     30   42   46   47   48   49   52   53   57   83   92  106  115  119  121  123  126  128  133  138 
LCS_GDT     L    18_C     L    18_C     47   51   68     30   42   46   47   48   49   52   53   57   70   95  110  115  119  121  123  126  128  133  138 
LCS_GDT     V    19_C     V    19_C     47   51   68     30   42   46   47   48   49   52   53   57   59   63   68   73   80  115  122  126  128  133  138 
LCS_GDT     G    20_C     G    20_C     47   51   68     30   42   46   47   48   49   52   53   57   59   63   68   73   80   85   94  102  114  133  138 
LCS_GDT     E    21_C     E    21_C     47   51   68     30   42   46   47   48   49   52   53   57   59   63   68   73   80   85   91   99  103  108  122 
LCS_GDT     G    22_C     G    22_C     47   51   68     30   42   46   47   48   49   52   53   57   59   63   68   73  119  121  123  126  128  133  138 
LCS_GDT     S    23_C     S    23_C     47   51   68     30   42   46   47   48   49   52   53   57   59  109  113  115  119  121  123  126  128  133  138 
LCS_GDT     S    24_C     S    24_C     47   51   68     30   42   46   47   48   49   52   77   86   99  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     V    25_C     V    25_C     47   51   68     30   42   46   47   48   49   64   77   85   95  107  113  115  119  121  123  126  128  133  138 
LCS_GDT     R    26_C     R    26_C     47   51   68     30   42   46   47   48   49   52   57   68   85   92  100  109  116  121  123  126  128  133  138 
LCS_GDT     R    27_C     R    27_C     47   51   68     30   42   46   47   48   49   52   57   69   85   92   99  109  115  121  123  126  128  133  138 
LCS_GDT     R    28_C     R    28_C     47   51   68     30   42   46   47   48   49   52   53   57   59   73   92  101  109  115  121  126  128  133  138 
LCS_GDT     R    29_C     R    29_C     47   51   68     30   42   46   47   48   49   52   53   57   59   63   80   95  106  114  121  124  128  133  138 
LCS_GDT     Q    30_C     Q    30_C     47   51   68     30   42   46   47   48   49   52   53   57   59   63   68   79   93  106  116  121  127  133  138 
LCS_GDT     C    31_C     C    31_C     47   51   68     30   42   46   47   48   49   52   53   57   59   63   68   73   81   91  100  115  125  131  138 
LCS_GDT     L    32_C     L    32_C     47   51   68     28   42   46   47   48   49   52   53   57   59   63   68   73   81   91   98  109  120  131  138 
LCS_GDT     V    33_C     V    33_C     47   51   68     23   42   46   47   48   49   52   53   57   59   63   68   73   80   85   94  105  111  121  129 
LCS_GDT     C    34_C     C    34_C     47   51   68     25   42   46   47   48   49   52   53   57   59   63   68   73   80   85   94  102  110  121  125 
LCS_GDT     N    35_C     N    35_C     47   51   68     30   42   46   47   48   49   52   53   57   59   63   68   73   80   87   96  108  114  123  136 
LCS_GDT     E    36_C     E    36_C     47   51   68     30   42   46   47   48   49   52   53   57   59   63   68   73   80   86   96  108  114  128  138 
LCS_GDT     R    37_C     R    37_C     47   51  117     30   42   46   47   48   49   52   53   57   59   63   68   73   81   95  109  121  125  131  138 
LCS_GDT     F    38_C     F    38_C     47   51  117     30   42   46   47   48   49   52   53   57   59   63   68   79   93  106  116  121  127  133  138 
LCS_GDT     T    39_C     T    39_C     47   51  117     30   42   46   47   48   49   52   53   57   59   65   80   95  107  115  121  124  128  133  138 
LCS_GDT     T    40_C     T    40_C     47   51  117     17   42   46   47   48   49   52   53   57   66   87   96  104  110  118  123  126  128  133  138 
LCS_GDT     F    41_C     F    41_C     47   51  117     30   42   46   47   48   49   52   57   69   85   92   99  109  116  121  123  126  128  133  138 
LCS_GDT     E    42_C     E    42_C     47   51  117     30   42   46   47   48   49   60   72   85   95  107  112  115  119  121  123  126  128  133  138 
LCS_GDT     V    43_C     V    43_C     47  111  117     30   42   46   47   48   60   74   85   99  107  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     A    44_C     A    44_C     47  111  117      6   42   46   53   75   92  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     E    45_C     E    45_C     90  111  117      6   42   46   47   66   92  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     L    46_C     L    46_C    106  111  117      6   47   94  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     V    47_C     V    47_C    106  111  117     63   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  135 
LCS_GDT     M    48_C     M    48_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     P    49_C     P    49_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     R    50_C     R    50_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     V    51_C     V    51_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     V    52_C     V    52_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     K    53_C     K    53_C    106  111  117     23   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     S    54_C     S    54_C    106  111  117     15   79   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     N    55_C     N    55_C    106  111  117     28   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     D    56_C     D    56_C    106  111  117     59   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     V    57_C     V    57_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     R    58_C     R    58_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     E    59_C     E    59_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     P    60_C     P    60_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     F    61_C     F    61_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     N    62_C     N    62_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     E    63_C     E    63_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     E    64_C     E    64_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     K    65_C     K    65_C    106  111  117     63   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     L    66_C     L    66_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     R    67_C     R    67_C    106  111  117     54   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     S    68_C     S    68_C    106  111  117     54   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     G    69_C     G    69_C    106  111  117     54   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     M    70_C     M    70_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     L    71_C     L    71_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     R    72_C     R    72_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     A    73_C     A    73_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     L    74_C     L    74_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     E    75_C     E    75_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     K    76_C     K    76_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     R    77_C     R    77_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     P    78_C     P    78_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     V    79_C     V    79_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     S    80_C     S    80_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     S    81_C     S    81_C    106  111  117     63   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     D    82_C     D    82_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     D    83_C     D    83_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     V    84_C     V    84_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     E    85_C     E    85_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     M    86_C     M    86_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     A    87_C     A    87_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     I    88_C     I    88_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     N    89_C     N    89_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     H    90_C     H    90_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     I    91_C     I    91_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     K    92_C     K    92_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     S    93_C     S    93_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     Q    94_C     Q    94_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     L    95_C     L    95_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     R    96_C     R    96_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     A    97_C     A    97_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     T    98_C     T    98_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     G    99_C     G    99_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  120  123  125  128  131  133 
LCS_GDT     E   100_C     E   100_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  131  134 
LCS_GDT     R   101_C     R   101_C    106  111  117     66   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  135 
LCS_GDT     E   102_C     E   102_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     V   103_C     V   103_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     P   104_C     P   104_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     S   105_C     S   105_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     K   106_C     K   106_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     M   107_C     M   107_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     I   108_C     I   108_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     G   109_C     G   109_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     N   110_C     N   110_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     L   111_C     L   111_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     V   112_C     V   112_C    106  111  117     59   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     M   113_C     M   113_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     E   114_C     E   114_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     Q   115_C     Q   115_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     L   116_C     L   116_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     K   117_C     K   117_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     K   118_C     K   118_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     L   119_C     L   119_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     D   120_C     D   120_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     K   121_C     K   121_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     V   122_C     V   122_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     A   123_C     A   123_C    106  111  117     69   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     Y   124_C     Y   124_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     I   125_C     I   125_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     R   126_C     R   126_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     F   127_C     F   127_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     A   128_C     A   128_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     S   129_C     S   129_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     V   130_C     V   130_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     Y   131_C     Y   131_C    106  111  117     72   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     R   132_C     R   132_C    106  111  117     69   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     S   133_C     S   133_C    106  111  117     56   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     F   134_C     F   134_C    106  111  117     11   66   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     E   135_C     E   135_C    106  111  117     10   48   94  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     D   136_C     D   136_C    106  111  117      7   34   76  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     I   137_C     I   137_C    106  111  117      5   34   81  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     K   138_C     K   138_C    106  111  117     10   34   88  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     D   139_C     D   139_C    106  111  117     11   34   69  105  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     F   140_C     F   140_C    106  111  117     11   14   59  105  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     G   141_C     G   141_C    106  111  117     11   66   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     E   142_C     E   142_C    106  111  117     11   79   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     E   143_C     E   143_C    106  111  117     22   85   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     I   144_C     I   144_C    106  111  117     30   88   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     A   145_C     A   145_C    106  111  117     66   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     R   146_C     R   146_C    106  111  117     13   88   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     L   147_C     L   147_C    106  111  117     28   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     E   148_C     E   148_C    106  111  117     28   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     D   149_C     D   149_C    106  111  117     28   76   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     H   150_C     H   150_C    106  111  117     28   76   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     H   151_C     H   151_C    106  111  117      3   90   98  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     H   152_C     H   152_C    106  111  117      3   59   93  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_GDT     H   153_C     H   153_C     26  111  117      9   59   91  106  108  108  108  110  110  110  111  113  115  119  121  123  126  128  133  138 
LCS_AVERAGE  LCS_A:  62.83  (  57.77   61.78   68.94 )

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     72     90     98    106    108    108    108    110    110    110    111    113    115    119    121    123    126    128    133    138 
GDT PERCENT_AT  47.06  58.82  64.05  69.28  70.59  70.59  70.59  71.90  71.90  71.90  72.55  73.86  75.16  77.78  79.08  80.39  82.35  83.66  86.93  90.20
GDT RMS_LOCAL    0.32   0.46   0.67   0.96   1.02   1.02   1.02   1.38   1.38   1.38   1.72   2.21   2.70   3.38   3.84   4.01   4.50   4.65   5.44   6.14
GDT RMS_ALL_AT  15.64  15.59  15.34  14.89  14.78  14.78  14.78  14.30  14.30  14.30  13.90  13.27  12.48  11.36  10.46  10.23   9.35   9.20   8.06   7.34

# Checking swapping
#   possible swapping detected:  E    21_C      E    21_C
#   possible swapping detected:  E    36_C      E    36_C
#   possible swapping detected:  F    38_C      F    38_C
#   possible swapping detected:  E    45_C      E    45_C
#   possible swapping detected:  D    56_C      D    56_C
#   possible swapping detected:  E    59_C      E    59_C
#   possible swapping detected:  E    63_C      E    63_C
#   possible swapping detected:  E    64_C      E    64_C
#   possible swapping detected:  E    75_C      E    75_C
#   possible swapping detected:  D    83_C      D    83_C
#   possible swapping detected:  E    85_C      E    85_C
#   possible swapping detected:  E   100_C      E   100_C
#   possible swapping detected:  E   114_C      E   114_C
#   possible swapping detected:  F   127_C      F   127_C
#   possible swapping detected:  E   135_C      E   135_C
#   possible swapping detected:  F   140_C      F   140_C
#   possible swapping detected:  E   142_C      E   142_C
#   possible swapping detected:  E   148_C      E   148_C

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    M     1_C      M     1_C    29.502     0    0.348   1.002    33.959    0.000    0.000
LGA    H     2_C      H     2_C    27.691     0    0.671   1.558    28.617    0.000    0.000
LGA    C     3_C      C     3_C    31.334     0    0.045   0.059    34.319    0.000    0.000
LGA    P     4_C      P     4_C    32.000     0    0.024   0.089    34.062    0.000    0.000
LGA    F     5_C      F     5_C    35.838     0    0.096   0.169    37.881    0.000    0.000
LGA    C     6_C      C     6_C    37.480     0    0.090   0.108    38.312    0.000    0.000
LGA    F     7_C      F     7_C    34.605     0    0.177   0.315    36.622    0.000    0.000
LGA    A     8_C      A     8_C    34.506     0    0.019   0.025    34.928    0.000    0.000
LGA    V     9_C      V     9_C    31.524     0    0.148   1.148    32.966    0.000    0.000
LGA    D    10_C      D    10_C    30.333     0    0.130   0.776    31.403    0.000    0.000
LGA    T    11_C      T    11_C    29.038     0    0.073   0.919    29.161    0.000    0.000
LGA    K    12_C      K    12_C    27.633     0    0.088   0.386    31.164    0.000    0.000
LGA    V    13_C      V    13_C    24.294     0    0.042   0.083    25.189    0.000    0.000
LGA    I    14_C      I    14_C    25.241     0    0.169   1.131    30.075    0.000    0.000
LGA    D    15_C      D    15_C    22.676     0    0.086   0.352    23.542    0.000    0.000
LGA    S    16_C      S    16_C    18.597     0    0.250   0.326    19.924    0.000    0.000
LGA    R    17_C      R    17_C    17.760     0    0.022   0.808    24.318    0.000    0.000
LGA    L    18_C      L    18_C    15.146     0    0.108   0.843    16.343    0.000    0.000
LGA    V    19_C      V    19_C    17.402     0    0.028   1.205    19.042    0.000    0.000
LGA    G    20_C      G    20_C    17.243     0    0.114   0.114    17.581    0.000    0.000
LGA    E    21_C      E    21_C    15.661     0    0.140   0.604    22.061    0.000    0.000
LGA    G    22_C      G    22_C    11.734     0    0.014   0.014    13.326    0.119    0.119
LGA    S    23_C      S    23_C    10.701     0    0.013   0.088    12.810    0.000    0.000
LGA    S    24_C      S    24_C    12.629     0    0.030   0.605    16.550    0.000    0.000
LGA    V    25_C      V    25_C    14.465     0    0.037   0.111    16.567    0.000    0.000
LGA    R    26_C      R    26_C    18.698     0    0.031   0.903    24.453    0.000    0.000
LGA    R    27_C      R    27_C    20.424     0    0.130   0.500    22.500    0.000    0.000
LGA    R    28_C      R    28_C    25.198     0    0.022   0.984    28.168    0.000    0.000
LGA    R    29_C      R    29_C    26.901     0    0.013   0.233    29.359    0.000    0.000
LGA    Q    30_C      Q    30_C    30.806     0    0.024   0.937    34.141    0.000    0.000
LGA    C    31_C      C    31_C    33.089     0    0.062   0.093    34.887    0.000    0.000
LGA    L    32_C      L    32_C    34.986     0    0.082   0.139    37.033    0.000    0.000
LGA    V    33_C      V    33_C    38.228     0    0.029   0.354    40.353    0.000    0.000
LGA    C    34_C      C    34_C    39.091     0    0.063   0.076    39.454    0.000    0.000
LGA    N    35_C      N    35_C    37.421     0    0.145   0.211    40.305    0.000    0.000
LGA    E    36_C      E    36_C    35.701     0    0.075   0.521    37.314    0.000    0.000
LGA    R    37_C      R    37_C    32.339     0    0.080   0.732    36.549    0.000    0.000
LGA    F    38_C      F    38_C    29.234     0    0.017   0.079    30.073    0.000    0.000
LGA    T    39_C      T    39_C    25.318     0    0.050   0.085    26.836    0.000    0.000
LGA    T    40_C      T    40_C    21.738     0    0.016   1.336    22.696    0.000    0.000
LGA    F    41_C      F    41_C    18.297     0    0.186   0.365    21.736    0.000    0.000
LGA    E    42_C      E    42_C    14.490     0    0.078   0.845    15.850    0.000    0.000
LGA    V    43_C      V    43_C    11.208     0    0.047   0.235    13.721    0.119    0.068
LGA    A    44_C      A    44_C     6.743     0    0.066   0.069     8.152   11.190   14.190
LGA    E    45_C      E    45_C     6.496     0    0.034   0.578    10.813   26.190   13.545
LGA    L    46_C      L    46_C     1.797     0    0.403   0.316     4.493   69.762   62.024
LGA    V    47_C      V    47_C     0.582     0    0.072   1.140     2.762   90.476   83.129
LGA    M    48_C      M    48_C     0.834     0    0.048   0.140     0.916   90.476   91.667
LGA    P    49_C      P    49_C     0.872     0    0.042   0.077     1.009   90.476   87.891
LGA    R    50_C      R    50_C     0.492     0    0.028   1.226     5.331   97.619   77.489
LGA    V    51_C      V    51_C     0.414     0    0.025   0.082     0.427  100.000  100.000
LGA    V    52_C      V    52_C     0.479     0    0.074   0.096     0.580  100.000   95.918
LGA    K    53_C      K    53_C     0.900     0    0.012   0.659     1.933   90.476   85.503
LGA    S    54_C      S    54_C     1.224     0    0.010   0.041     1.513   81.429   80.000
LGA    N    55_C      N    55_C     0.760     0    0.038   0.285     1.251   90.476   89.345
LGA    D    56_C      D    56_C     0.658     0    0.035   0.960     3.622   90.476   75.357
LGA    V    57_C      V    57_C     0.688     0    0.050   1.179     2.844   92.857   83.265
LGA    R    58_C      R    58_C     0.444     0    0.166   0.942     3.731   95.238   85.455
LGA    E    59_C      E    59_C     0.232     0    0.049   0.650     2.109   97.619   87.989
LGA    P    60_C      P    60_C     0.417     0    0.020   0.332     1.252   97.619   94.626
LGA    F    61_C      F    61_C     0.530     0    0.016   0.093     0.714   92.857   91.342
LGA    N    62_C      N    62_C     0.345     0    0.043   0.403     0.982   97.619   96.429
LGA    E    63_C      E    63_C     0.559     0    0.093   0.978     5.212   92.857   75.079
LGA    E    64_C      E    64_C     1.046     0    0.010   0.151     1.414   83.690   82.434
LGA    K    65_C      K    65_C     0.984     0    0.046   0.625     2.203   85.952   83.651
LGA    L    66_C      L    66_C     0.696     0    0.052   0.104     0.854   90.476   94.048
LGA    R    67_C      R    67_C     1.070     0    0.083   0.728     3.511   85.952   75.801
LGA    S    68_C      S    68_C     1.321     0    0.007   0.554     3.305   81.429   76.190
LGA    G    69_C      G    69_C     1.115     0    0.025   0.025     1.168   83.690   83.690
LGA    M    70_C      M    70_C     0.817     0    0.046   0.883     2.833   90.476   86.310
LGA    L    71_C      L    71_C     1.223     0    0.068   0.202     1.398   81.429   81.429
LGA    R    72_C      R    72_C     1.334     0    0.027   0.852     2.753   81.429   76.970
LGA    A    73_C      A    73_C     1.007     0    0.022   0.034     1.097   85.952   86.857
LGA    L    74_C      L    74_C     0.890     0    0.160   0.153     0.967   90.476   90.476
LGA    E    75_C      E    75_C     1.404     0    0.087   1.067     2.288   81.429   77.778
LGA    K    76_C      K    76_C     1.246     0    0.061   0.139     2.304   85.952   77.831
LGA    R    77_C      R    77_C     0.672     0    0.016   1.003     2.760   90.476   85.844
LGA    P    78_C      P    78_C     0.681     0    0.039   0.094     0.763   90.476   91.837
LGA    V    79_C      V    79_C     0.574     0    0.060   0.091     1.093   88.214   91.905
LGA    S    80_C      S    80_C     1.222     0    0.014   0.019     1.484   85.952   84.444
LGA    S    81_C      S    81_C     1.190     0    0.114   0.753     4.164   83.690   74.127
LGA    D    82_C      D    82_C     1.174     0    0.022   0.122     1.505   83.690   81.488
LGA    D    83_C      D    83_C     0.793     0    0.027   0.053     0.996   90.476   90.476
LGA    V    84_C      V    84_C     0.595     0    0.032   0.065     0.649   92.857   91.837
LGA    E    85_C      E    85_C     0.978     0    0.071   0.178     1.920   90.476   82.593
LGA    M    86_C      M    86_C     0.987     0    0.025   0.826     3.313   90.476   84.345
LGA    A    87_C      A    87_C     0.511     0    0.036   0.051     0.682   95.238   96.190
LGA    I    88_C      I    88_C     0.471     0    0.036   0.077     0.720   95.238   94.048
LGA    N    89_C      N    89_C     0.869     0    0.033   0.051     1.135   90.476   85.952
LGA    H    90_C      H    90_C     0.918     0    0.087   1.152     2.762   90.476   82.714
LGA    I    91_C      I    91_C     0.556     0    0.020   0.043     0.739   90.476   95.238
LGA    K    92_C      K    92_C     0.550     0    0.031   0.485     1.261   90.476   87.460
LGA    S    93_C      S    93_C     1.053     0    0.026   0.175     1.155   83.690   82.937
LGA    Q    94_C      Q    94_C     1.050     0    0.078   0.164     1.182   88.214   84.444
LGA    L    95_C      L    95_C     0.880     0    0.055   1.054     2.879   90.476   84.107
LGA    R    96_C      R    96_C     1.172     0    0.023   0.982     3.629   83.690   72.208
LGA    A    97_C      A    97_C     1.175     0    0.024   0.024     1.410   81.429   81.429
LGA    T    98_C      T    98_C     1.143     0    0.020   0.051     1.249   81.429   85.306
LGA    G    99_C      G    99_C     1.059     0    0.204   0.204     1.059   85.952   85.952
LGA    E   100_C      E   100_C     1.311     0    0.028   0.231     1.424   81.429   83.439
LGA    R   101_C      R   101_C     0.817     0    0.062   0.748     2.552   90.476   85.065
LGA    E   102_C      E   102_C     1.022     0    0.026   0.628     1.351   88.214   84.444
LGA    V   103_C      V   103_C     1.000     0    0.033   0.073     1.126   88.214   87.891
LGA    P   104_C      P   104_C     0.895     0    0.063   0.074     0.980   90.476   90.476
LGA    S   105_C      S   105_C     0.446     0    0.054   0.087     0.768   92.857   95.238
LGA    K   106_C      K   106_C     0.663     0    0.036   0.847     3.721   90.476   83.228
LGA    M   107_C      M   107_C     0.722     0    0.053   0.799     2.540   90.476   85.179
LGA    I   108_C      I   108_C     0.502     0    0.013   0.092     0.596   90.476   95.238
LGA    G   109_C      G   109_C     0.677     0    0.034   0.034     0.876   90.476   90.476
LGA    N   110_C      N   110_C     0.787     0    0.035   0.173     1.163   90.476   89.345
LGA    L   111_C      L   111_C     0.611     0    0.018   0.109     0.940   90.476   90.476
LGA    V   112_C      V   112_C     0.754     0    0.074   1.179     2.657   90.476   80.748
LGA    M   113_C      M   113_C     0.792     0    0.034   0.674     1.624   90.476   87.143
LGA    E   114_C      E   114_C     0.841     0    0.048   1.052     5.589   90.476   65.873
LGA    Q   115_C      Q   115_C     0.487     0    0.013   1.037     3.024   97.619   90.265
LGA    L   116_C      L   116_C     0.399     0    0.030   0.068     0.534  100.000   98.810
LGA    K   117_C      K   117_C     0.529     0    0.057   0.996     3.643   92.857   83.333
LGA    K   118_C      K   118_C     0.528     0    0.051   0.632     2.316   92.857   88.677
LGA    L   119_C      L   119_C     0.224     0    0.063   0.061     0.375  100.000  100.000
LGA    D   120_C      D   120_C     0.162     0    0.040   0.361     1.033  100.000   96.488
LGA    K   121_C      K   121_C     0.384     0    0.050   0.469     1.715   95.238   87.619
LGA    V   122_C      V   122_C     0.692     0    0.033   0.058     0.923   90.476   90.476
LGA    A   123_C      A   123_C     0.608     0    0.065   0.069     0.608   95.238   94.286
LGA    Y   124_C      Y   124_C     0.279     0    0.069   0.212     1.218   97.619   94.524
LGA    I   125_C      I   125_C     0.564     0    0.067   0.652     2.919   92.857   87.500
LGA    R   126_C      R   126_C     0.640     0    0.030   0.407     1.188   90.476   88.831
LGA    F   127_C      F   127_C     0.554     0    0.010   0.165     0.717   90.476   93.939
LGA    A   128_C      A   128_C     0.604     0    0.076   0.090     0.928   90.476   90.476
LGA    S   129_C      S   129_C     0.793     0    0.093   0.650     1.647   90.476   87.540
LGA    V   130_C      V   130_C     1.076     0    0.076   1.247     3.185   83.690   75.850
LGA    Y   131_C      Y   131_C     0.918     0    0.051   0.114     1.951   90.476   83.056
LGA    R   132_C      R   132_C     0.725     0    0.093   0.221     1.226   90.476   89.654
LGA    S   133_C      S   133_C     0.558     0    0.107   0.666     1.885   92.857   89.127
LGA    F   134_C      F   134_C     1.252     0    0.062   0.737     2.407   83.690   75.325
LGA    E   135_C      E   135_C     1.698     0    0.117   0.409     2.517   72.857   70.212
LGA    D   136_C      D   136_C     2.389     0    0.091   0.213     2.963   64.762   60.952
LGA    I   137_C      I   137_C     2.196     0    0.029   1.124     3.380   64.762   61.964
LGA    K   138_C      K   138_C     2.170     0    0.123   0.789     6.339   66.786   54.233
LGA    D   139_C      D   139_C     2.570     0    0.023   0.347     3.546   60.952   56.429
LGA    F   140_C      F   140_C     2.465     0    0.019   1.253     3.126   66.905   62.987
LGA    G   141_C      G   141_C     1.378     0    0.061   0.061     1.746   83.810   83.810
LGA    E   142_C      E   142_C     0.983     0    0.017   0.184     3.062   88.214   76.296
LGA    E   143_C      E   143_C     0.896     0    0.051   0.484     1.984   88.214   86.508
LGA    I   144_C      I   144_C     1.065     0    0.025   0.055     1.944   85.952   80.476
LGA    A   145_C      A   145_C     0.860     0    0.043   0.062     1.633   83.810   85.143
LGA    R   146_C      R   146_C     1.256     0    0.302   1.020     2.443   77.381   76.883
LGA    L   147_C      L   147_C     1.556     0    0.106   0.203     2.306   72.976   77.202
LGA    E   148_C      E   148_C     1.615     0    0.186   0.193     1.990   72.857   77.619
LGA    D   149_C      D   149_C     1.736     0    0.051   0.413     2.045   70.833   71.845
LGA    H   150_C      H   150_C     1.569     0    0.218   0.551     2.049   72.857   75.476
LGA    H   151_C      H   151_C     1.375     0    0.066   0.396     1.926   81.429   78.000
LGA    H   152_C      H   152_C     1.653     0    0.185   1.113     6.023   77.143   55.762
LGA    H   153_C      H   153_C     1.979     0    0.530   1.107     4.690   68.929   62.667

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      153     612    612  100.00    1242   1242  100.00               153
SUMMARY(RMSD_GDC):     7.114          7.081                  7.209           61.853   59.185

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  155  153    4.0    110    1.38    70.098    68.290     7.440

LGA_LOCAL      RMSD:   1.378  Number of atoms:  110  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  14.301  Number of assigned atoms:  153 
Std_ASGN_ATOMS RMSD:   7.114  Standard rmsd on all 153 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.910852 * X  +  -0.320082 * Y  +  -0.260568 * Z  +   4.812748
  Y_new =  -0.255421 * X  +   0.058760 * Y  +  -0.965043 * Z  +  32.661285
  Z_new =   0.324203 * X  +   0.945566 * Y  +  -0.028234 * Z  +  16.092270 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -0.273398 -0.330170  1.600646   [DEG:  -15.6645  -18.9173   91.7103 ]
ZXZ: -0.263718  1.599034  0.330306   [DEG:  -15.1099   91.6179   18.9252 ]
 
# END of job
