
#######################################################
#                                                     #
#                        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  150 ( 1212),  selected  150 , name one
# Molecule2: number of CA atoms  153 ( 1242),  selected  150 , 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:   116      35_C - 150_C       4.98    10.40
  LCS_AVERAGE:     67.82

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   105      46_C - 150_C       1.96    13.70
  LCS_AVERAGE:     57.65

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    77      68_C - 144_C       1.00    13.92
  LONGEST_CONTINUOUS_SEGMENT:    77      69_C - 145_C       1.00    13.87
  LCS_AVERAGE:     40.28

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  150
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      3   49   62      3    3    3    3    3   23   30   35   49   50   51   52   55   61   62   64   69   77   83   91 
LCS_GDT     H     2_C     H     2_C     42   49   62      3    8   37   44   45   46   47   48   49   50   51   52   55   61   62   64   69   77   83   91 
LCS_GDT     C     3_C     C     3_C     42   49   62      4   32   39   44   45   46   47   48   49   50   51   52   55   61   62   64   69   77   83   90 
LCS_GDT     P     4_C     P     4_C     42   49   62     10   32   39   44   45   46   47   48   49   50   51   52   55   61   62   64   69   77   80   88 
LCS_GDT     F     5_C     F     5_C     42   49   62     10   32   39   44   45   46   47   48   49   50   51   52   55   61   62   64   69   75   79   87 
LCS_GDT     C     6_C     C     6_C     42   49   62      4   18   38   44   45   46   47   48   49   50   51   52   55   61   62   64   69   75   79   87 
LCS_GDT     F     7_C     F     7_C     42   49   62     10   32   39   44   45   46   47   48   49   50   51   52   55   61   62   64   69   75   79   87 
LCS_GDT     A     8_C     A     8_C     42   49   62     14   32   39   44   45   46   47   48   49   50   51   52   55   61   62   64   69   75   79   87 
LCS_GDT     V     9_C     V     9_C     42   49   62      4   32   39   44   45   46   47   48   49   50   51   52   55   61   62   64   69   75   79   87 
LCS_GDT     D    10_C     D    10_C     42   49   62      5   32   39   44   45   46   47   48   49   50   51   52   55   61   62   64   69   77   80   87 
LCS_GDT     T    11_C     T    11_C     42   49   62      4   32   39   44   45   46   47   48   49   50   51   52   55   61   62   64   74   86   97  110 
LCS_GDT     K    12_C     K    12_C     42   49   62      5   24   38   44   45   46   47   48   49   50   51   52   55   61   63   78   89  104  114  122 
LCS_GDT     V    13_C     V    13_C     42   49   62      9   32   39   44   45   46   47   48   49   50   51   52   68   80  101  112  117  120  121  123 
LCS_GDT     I    14_C     I    14_C     42   49   62      6   32   39   44   45   46   47   48   49   50   51   78   96  106  113  116  118  120  121  123 
LCS_GDT     D    15_C     D    15_C     42   49   62      5   29   39   44   45   46   47   48   49   81   99  106  112  115  116  117  118  120  121  123 
LCS_GDT     S    16_C     S    16_C     42   49   62      5   32   39   44   45   46   47   56   80   83  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     R    17_C     R    17_C     42   49   62      5   32   39   44   45   46   47   48   49   50   81  109  112  115  116  117  118  119  121  122 
LCS_GDT     L    18_C     L    18_C     42   49   62      6   32   39   44   45   46   47   48   49   50   51  109  111  112  113  115  118  118  118  120 
LCS_GDT     V    19_C     V    19_C     42   49   62     14   32   39   44   45   46   47   48   49   50   51   52  100  108  113  114  115  116  117  120 
LCS_GDT     G    20_C     G    20_C     42   49   62      3    3   13   36   45   46   47   48   49   50   85   92  102  105  106  109  110  115  116  117 
LCS_GDT     E    21_C     E    21_C     42   49   62      3   15   38   44   45   46   47   48   49   50   51   52   54   57   60   62   64   68   74   75 
LCS_GDT     G    22_C     G    22_C     42   49   62     10   32   39   44   45   46   47   48   49   50   51   52   54   71   76   81   90  114  116  116 
LCS_GDT     S    23_C     S    23_C     42   49   62     14   32   39   44   45   46   47   48   49   50   51   52   65   71  109  114  115  116  118  120 
LCS_GDT     S    24_C     S    24_C     42   49   62     14   32   39   44   45   46   47   48   49   50   51  109  111  115  116  117  118  119  121  122 
LCS_GDT     V    25_C     V    25_C     42   49   62     13   32   39   44   45   46   47   56   64  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     R    26_C     R    26_C     42   49   62     14   32   39   44   45   46   47   48   49  102  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     R    27_C     R    27_C     42   49   62     11   32   39   44   45   46   47   48   78   91  104  108  112  114  116  117  118  120  121  123 
LCS_GDT     R    28_C     R    28_C     42   49   62      5   27   39   44   45   46   47   48   58   82   93   99  107  112  113  116  118  120  121  123 
LCS_GDT     R    29_C     R    29_C     42   49   62     14   32   39   44   45   46   47   48   50   60   81   92  100  106  113  116  118  120  121  123 
LCS_GDT     Q    30_C     Q    30_C     42   49   62     14   32   39   44   45   46   47   48   49   50   58   67   78   95  102  108  113  118  121  123 
LCS_GDT     C    31_C     C    31_C     42   49   62     14   32   39   44   45   46   47   48   49   50   51   52   55   61   62   74   90   95  102  111 
LCS_GDT     L    32_C     L    32_C     42   49   62     14   32   39   44   45   46   47   48   49   50   51   52   55   61   62   64   69   77   81   90 
LCS_GDT     V    33_C     V    33_C     42   49   62     10   32   39   44   45   46   47   48   49   50   51   52   55   61   62   64   69   75   79   87 
LCS_GDT     C    34_C     C    34_C     42   49   62     14   32   39   44   45   46   47   48   49   50   51   52   55   61   62   64   69   75   79   87 
LCS_GDT     N    35_C     N    35_C     42   49  116     14   32   39   44   45   46   47   48   49   50   51   52   55   61   62   74   90   95  102  111 
LCS_GDT     E    36_C     E    36_C     42   49  116     14   32   39   44   45   46   47   48   49   50   51   52   55   61   62   69   80   93  101  111 
LCS_GDT     R    37_C     R    37_C     42   49  116     14   32   39   44   45   46   47   48   49   50   51   54   71   83   94  106  111  115  120  123 
LCS_GDT     F    38_C     F    38_C     42   49  116      6   29   39   44   45   46   47   48   49   50   51   54   67   85   94  108  113  116  121  123 
LCS_GDT     T    39_C     T    39_C     42   49  116      6   32   39   44   45   46   47   48   49   50   54   84  100  109  113  116  118  120  121  123 
LCS_GDT     T    40_C     T    40_C     42   49  116      7   32   39   44   45   46   47   48   49   74   89   97  105  109  113  116  118  120  121  123 
LCS_GDT     F    41_C     F    41_C     42   49  116     13   32   39   44   45   46   47   48   49   85   99  107  111  112  116  117  118  120  121  123 
LCS_GDT     E    42_C     E    42_C     42   49  116     13   32   39   44   45   46   47   70   86   98  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     V    43_C     V    43_C     42   49  116     14   32   39   44   45   46   47   48   93  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     A    44_C     A    44_C     42   49  116      5   29   39   44   45   46   47   48   64   75  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     E    45_C     E    45_C     26   49  116      5   26   38   44   45   46   50   73   93  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     L    46_C     L    46_C     26  105  116      4   17   39   44   45   46   47   48   49   75   81  109  112  115  116  117  118  120  121  123 
LCS_GDT     V    47_C     V    47_C      3  105  116      3    3    5   11   25   25   46   48   48   50   81   89   95  115  116  117  118  118  119  122 
LCS_GDT     M    48_C     M    48_C      3  105  116      3    6   13   28   39   46   47   93  101  102  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     P    49_C     P    49_C      3  105  116      3    3    4    6   15   21   25   47   49   75  103  109  112  115  116  117  118  120  121  123 
LCS_GDT     R    50_C     R    50_C      3  105  116      4    4   11   23   35   43   47   48   49  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     V    51_C     V    51_C     61  105  116     27   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     V    52_C     V    52_C     61  105  116     29   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     K    53_C     K    53_C     61  105  116     29   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     S    54_C     S    54_C     61  105  116     29   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     N    55_C     N    55_C     61  105  116     18   50   82   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     D    56_C     D    56_C     61  105  116     18   53   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     V    57_C     V    57_C     61  105  116     18   50   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     R    58_C     R    58_C     61  105  116     18   53   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     E    59_C     E    59_C     61  105  116     14   53   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     P    60_C     P    60_C     61  105  116     18   53   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     F    61_C     F    61_C     61  105  116     18   52   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     N    62_C     N    62_C     61  105  116     15   40   74   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     E    63_C     E    63_C     73  105  116     18   40   73   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     E    64_C     E    64_C     74  105  116     18   40   78   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     K    65_C     K    65_C     75  105  116     18   42   83   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     L    66_C     L    66_C     76  105  116     18   53   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     R    67_C     R    67_C     76  105  116     18   53   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     S    68_C     S    68_C     77  105  116     18   53   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     G    69_C     G    69_C     77  105  116     29   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     M    70_C     M    70_C     77  105  116     29   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     L    71_C     L    71_C     77  105  116     29   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     R    72_C     R    72_C     77  105  116     29   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     A    73_C     A    73_C     77  105  116     29   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     L    74_C     L    74_C     77  105  116     29   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     E    75_C     E    75_C     77  105  116     29   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     K    76_C     K    76_C     77  105  116     27   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     R    77_C     R    77_C     77  105  116     17   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     P    78_C     P    78_C     77  105  116     29   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     V    79_C     V    79_C     77  105  116      7   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     S    80_C     S    80_C     77  105  116     19   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     S    81_C     S    81_C     77  105  116     19   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     D    82_C     D    82_C     77  105  116     19   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     D    83_C     D    83_C     77  105  116     19   32   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     V    84_C     V    84_C     77  105  116     19   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     E    85_C     E    85_C     77  105  116     19   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     M    86_C     M    86_C     77  105  116     19   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     A    87_C     A    87_C     77  105  116     19   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     I    88_C     I    88_C     77  105  116     19   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     N    89_C     N    89_C     77  105  116     19   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     H    90_C     H    90_C     77  105  116     19   51   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     I    91_C     I    91_C     77  105  116     19   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     K    92_C     K    92_C     77  105  116     19   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     S    93_C     S    93_C     77  105  116     19   52   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     Q    94_C     Q    94_C     77  105  116     19   51   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     L    95_C     L    95_C     77  105  116     18   49   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     R    96_C     R    96_C     77  105  116     15   48   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     A    97_C     A    97_C     77  105  116     19   52   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     T    98_C     T    98_C     77  105  116     18   48   80   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     G    99_C     G    99_C     77  105  116      6   41   78   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     E   100_C     E   100_C     77  105  116     19   51   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     R   101_C     R   101_C     77  105  116      7   20   76   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     E   102_C     E   102_C     77  105  116     19   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     V   103_C     V   103_C     77  105  116     19   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     P   104_C     P   104_C     77  105  116     18   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     S   105_C     S   105_C     77  105  116     16   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     K   106_C     K   106_C     77  105  116     19   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     M   107_C     M   107_C     77  105  116     19   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     I   108_C     I   108_C     77  105  116     23   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     G   109_C     G   109_C     77  105  116     28   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     N   110_C     N   110_C     77  105  116     29   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     L   111_C     L   111_C     77  105  116     24   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     V   112_C     V   112_C     77  105  116     23   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     M   113_C     M   113_C     77  105  116     29   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     E   114_C     E   114_C     77  105  116     12   53   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     Q   115_C     Q   115_C     77  105  116      6   40   78   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     L   116_C     L   116_C     77  105  116     11   50   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     K   117_C     K   117_C     77  105  116     17   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     K   118_C     K   118_C     77  105  116     17   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     L   119_C     L   119_C     77  105  116     29   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     D   120_C     D   120_C     77  105  116     29   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     K   121_C     K   121_C     77  105  116     29   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     V   122_C     V   122_C     77  105  116     29   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     A   123_C     A   123_C     77  105  116     29   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     Y   124_C     Y   124_C     77  105  116     29   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     I   125_C     I   125_C     77  105  116     29   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     R   126_C     R   126_C     77  105  116     29   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     F   127_C     F   127_C     77  105  116     29   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     A   128_C     A   128_C     77  105  116     29   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     S   129_C     S   129_C     77  105  116     29   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     V   130_C     V   130_C     77  105  116     22   54   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     Y   131_C     Y   131_C     77  105  116     29   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     R   132_C     R   132_C     77  105  116     29   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     S   133_C     S   133_C     77  105  116     29   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     F   134_C     F   134_C     77  105  116      6   54   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     E   135_C     E   135_C     77  105  116      7   53   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     D   136_C     D   136_C     77  105  116      4   24   83   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     I   137_C     I   137_C     77  105  116      5   51   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     K   138_C     K   138_C     77  105  116     27   54   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     D   139_C     D   139_C     77  105  116     28   54   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     F   140_C     F   140_C     77  105  116     28   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     G   141_C     G   141_C     77  105  116     24   54   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     E   142_C     E   142_C     77  105  116     27   54   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     E   143_C     E   143_C     77  105  116     29   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     I   144_C     I   144_C     77  105  116     29   55   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     A   145_C     A   145_C     77  105  116     27   54   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     R   146_C     R   146_C     52  105  116      8   53   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     L   147_C     L   147_C     52  105  116      8   53   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     E   148_C     E   148_C     52  105  116     11   54   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     D   149_C     D   149_C     52  105  116      3   20   77   97  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_GDT     H   150_C     H   150_C     52  105  116     27   54   84   99  100  100  100  100  101  103  106  109  112  115  116  117  118  120  121  123 
LCS_AVERAGE  LCS_A:  55.25  (  40.28   57.65   67.82 )

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     29     55     84     99    100    100    100    100    101    103    106    109    112    115    116    117    118    120    121    123 
GDT PERCENT_AT  18.95  35.95  54.90  64.71  65.36  65.36  65.36  65.36  66.01  67.32  69.28  71.24  73.20  75.16  75.82  76.47  77.12  78.43  79.08  80.39
GDT RMS_LOCAL    0.34   0.68   0.92   1.11   1.13   1.13   1.13   1.13   1.27   1.77   2.22   2.40   2.94   3.06   3.21   3.28   3.35   4.17   4.09   4.78
GDT RMS_ALL_AT  13.46  13.57  13.40  13.75  13.73  13.73  13.73  13.73  13.78  13.25  12.77  13.38  12.14  12.46  12.10  12.15  12.24  10.83  11.10  10.29

# Checking swapping
#   possible swapping detected:  E    21_C      E    21_C
#   possible swapping detected:  F    38_C      F    38_C
#   possible swapping detected:  E    42_C      E    42_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:  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:  Y   131_C      Y   131_C
#   possible swapping detected:  F   140_C      F   140_C
#   possible swapping detected:  E   143_C      E   143_C

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    M     1_C      M     1_C    30.914     0    0.349   0.974    32.261    0.000    0.000
LGA    H     2_C      H     2_C    31.319     0    0.692   1.453    32.450    0.000    0.000
LGA    C     3_C      C     3_C    32.079     0    0.134   0.142    34.494    0.000    0.000
LGA    P     4_C      P     4_C    32.769     0    0.153   0.457    35.381    0.000    0.000
LGA    F     5_C      F     5_C    36.056     0    0.056   0.200    39.215    0.000    0.000
LGA    C     6_C      C     6_C    38.985     0    0.081   0.083    41.382    0.000    0.000
LGA    F     7_C      F     7_C    38.803     0    0.082   1.130    40.707    0.000    0.000
LGA    A     8_C      A     8_C    38.811     0    0.048   0.066    38.811    0.000    0.000
LGA    V     9_C      V     9_C    38.450     0    0.066   0.147    41.821    0.000    0.000
LGA    D    10_C      D    10_C    35.598     0    0.129   0.159    39.537    0.000    0.000
LGA    T    11_C      T    11_C    29.962     0    0.185   0.215    31.784    0.000    0.000
LGA    K    12_C      K    12_C    27.350     0    0.046   1.261    35.210    0.000    0.000
LGA    V    13_C      V    13_C    22.126     0    0.131   0.225    24.196    0.000    0.000
LGA    I    14_C      I    14_C    19.922     0    0.044   0.560    21.980    0.000    0.000
LGA    D    15_C      D    15_C    15.049     0    0.095   0.315    16.769    0.000    0.000
LGA    S    16_C      S    16_C    13.015     0    0.306   0.819    15.610    0.000    0.000
LGA    R    17_C      R    17_C     9.547     0    0.121   1.824    15.205    0.833    0.693
LGA    L    18_C      L    18_C     9.042     0    0.105   0.923    12.361    2.143    1.071
LGA    V    19_C      V    19_C     9.213     0    0.079   0.946    10.889    1.548    0.884
LGA    G    20_C      G    20_C    12.035     0    0.504   0.504    12.882    0.000    0.000
LGA    E    21_C      E    21_C    16.114     0    0.256   1.378    21.915    0.000    0.000
LGA    G    22_C      G    22_C    12.918     0    0.113   0.113    13.414    0.000    0.000
LGA    S    23_C      S    23_C    10.515     0    0.111   0.126    11.320    1.071    0.714
LGA    S    24_C      S    24_C     7.939     0    0.065   0.668     9.259    4.881    4.683
LGA    V    25_C      V    25_C     8.736     0    0.164   1.212    11.860    2.262    1.361
LGA    R    26_C      R    26_C     9.330     0    0.028   1.279    12.992    1.548    0.823
LGA    R    27_C      R    27_C    13.446     0    0.128   1.067    19.583    0.000    0.000
LGA    R    28_C      R    28_C    16.968     0    0.092   1.073    19.468    0.000    0.000
LGA    R    29_C      R    29_C    21.186     0    0.045   0.614    24.560    0.000    0.000
LGA    Q    30_C      Q    30_C    25.645     0    0.028   0.806    28.046    0.000    0.000
LGA    C    31_C      C    31_C    31.240     0    0.028   0.709    34.764    0.000    0.000
LGA    L    32_C      L    32_C    35.791     0    0.049   1.114    38.865    0.000    0.000
LGA    V    33_C      V    33_C    40.263     0    0.026   0.379    44.471    0.000    0.000
LGA    C    34_C      C    34_C    38.245     0    0.078   0.104    38.463    0.000    0.000
LGA    N    35_C      N    35_C    33.264     0    0.138   1.203    37.445    0.000    0.000
LGA    E    36_C      E    36_C    30.544     0    0.120   0.721    33.225    0.000    0.000
LGA    R    37_C      R    37_C    24.708     0    0.027   0.999    26.656    0.000    0.000
LGA    F    38_C      F    38_C    22.441     0    0.101   0.252    25.821    0.000    0.000
LGA    T    39_C      T    39_C    17.249     0    0.028   1.115    19.308    0.000    0.000
LGA    T    40_C      T    40_C    16.292     0    0.056   1.346    18.805    0.000    0.000
LGA    F    41_C      F    41_C    11.759     0    0.175   1.213    14.519    0.000    0.000
LGA    E    42_C      E    42_C    11.274     0    0.163   0.883    14.909    0.833    0.370
LGA    V    43_C      V    43_C     8.326     0    0.067   1.307     9.678    2.619    2.449
LGA    A    44_C      A    44_C     9.162     0    0.086   0.099    10.124    4.048    3.238
LGA    E    45_C      E    45_C     8.723     0    0.065   0.386     9.898    2.143    1.429
LGA    L    46_C      L    46_C     8.492     0    0.523   1.225    10.278    3.452    2.440
LGA    V    47_C      V    47_C     9.138     0    0.400   1.143    11.008    2.976    2.449
LGA    M    48_C      M    48_C     6.004     0    0.464   0.923     7.921   13.690   17.619
LGA    P    49_C      P    49_C     7.431     0    0.049   0.352     8.290   17.976   15.918
LGA    R    50_C      R    50_C     7.095     0    0.451   1.453    15.459   17.500    6.753
LGA    V    51_C      V    51_C     0.651     0    0.393   1.044     3.094   82.143   73.742
LGA    V    52_C      V    52_C     0.412     0    0.013   1.216     2.780  100.000   88.844
LGA    K    53_C      K    53_C     0.373     0    0.065   0.577     1.846   97.619   90.794
LGA    S    54_C      S    54_C     0.596     0    0.073   0.682     2.548   90.595   85.000
LGA    N    55_C      N    55_C     1.662     0    0.258   1.015     3.254   81.548   73.333
LGA    D    56_C      D    56_C     1.399     0    0.057   0.307     1.729   79.286   78.214
LGA    V    57_C      V    57_C     1.444     0    0.057   1.129     4.348   83.690   75.170
LGA    R    58_C      R    58_C     0.966     0    0.230   1.564     7.586   79.524   62.381
LGA    E    59_C      E    59_C     0.941     0    0.080   0.646     1.267   92.857   87.513
LGA    P    60_C      P    60_C     0.883     0    0.042   0.117     1.024   88.214   87.891
LGA    F    61_C      F    61_C     1.138     0    0.041   0.161     2.048   83.690   78.398
LGA    N    62_C      N    62_C     1.997     0    0.119   0.862     3.518   72.857   64.226
LGA    E    63_C      E    63_C     1.934     0    0.068   0.654     3.983   72.857   61.852
LGA    E    64_C      E    64_C     1.849     0    0.024   1.146     5.451   72.857   55.820
LGA    K    65_C      K    65_C     1.498     0    0.088   0.730     2.264   79.286   73.016
LGA    L    66_C      L    66_C     1.165     0    0.034   0.973     2.824   83.690   76.310
LGA    R    67_C      R    67_C     1.203     0    0.049   0.994     2.409   83.690   78.442
LGA    S    68_C      S    68_C     1.074     0    0.041   0.523     2.547   85.952   80.397
LGA    G    69_C      G    69_C     0.500     0    0.028   0.028     0.736   97.619   97.619
LGA    M    70_C      M    70_C     0.337     0    0.031   0.882     3.687  100.000   89.345
LGA    L    71_C      L    71_C     0.360     0    0.086   1.073     3.932  100.000   86.131
LGA    R    72_C      R    72_C     0.527     0    0.040   0.751     3.973   95.238   80.087
LGA    A    73_C      A    73_C     0.367     0    0.045   0.048     0.598   97.619   98.095
LGA    L    74_C      L    74_C     0.337     0    0.240   0.730     3.616   92.976   78.750
LGA    E    75_C      E    75_C     0.234     0    0.032   0.685     1.939   97.619   90.741
LGA    K    76_C      K    76_C     0.522     0    0.160   1.189     3.494   92.857   82.222
LGA    R    77_C      R    77_C     0.652     0    0.101   1.020     2.809   90.476   88.442
LGA    P    78_C      P    78_C     0.265     0    0.157   0.420     1.047   92.976   90.612
LGA    V    79_C      V    79_C     1.201     0    0.046   0.073     1.510   83.690   81.497
LGA    S    80_C      S    80_C     1.687     0    0.068   0.107     1.845   72.857   72.857
LGA    S    81_C      S    81_C     1.591     0    0.081   0.098     1.591   77.143   78.571
LGA    D    82_C      D    82_C     1.498     0    0.038   0.493     2.359   75.000   77.262
LGA    D    83_C      D    83_C     1.681     0    0.043   0.338     2.312   72.857   72.917
LGA    V    84_C      V    84_C     1.475     0    0.055   1.231     3.311   79.286   72.109
LGA    E    85_C      E    85_C     1.134     0    0.059   1.181     4.090   81.429   73.175
LGA    M    86_C      M    86_C     1.267     0    0.025   1.123     3.003   81.429   71.429
LGA    A    87_C      A    87_C     1.292     0    0.017   0.029     1.473   83.690   83.238
LGA    I    88_C      I    88_C     0.905     0    0.040   1.529     3.962   88.214   76.071
LGA    N    89_C      N    89_C     0.910     0    0.056   1.052     4.022   85.952   74.167
LGA    H    90_C      H    90_C     1.295     0    0.051   1.134     5.345   81.429   60.238
LGA    I    91_C      I    91_C     1.133     0    0.040   1.494     3.984   81.429   70.595
LGA    K    92_C      K    92_C     0.955     0    0.031   1.041     6.131   85.952   67.884
LGA    S    93_C      S    93_C     1.220     0    0.029   0.728     2.236   81.429   78.651
LGA    Q    94_C      Q    94_C     1.475     0    0.102   1.039     2.719   81.429   74.021
LGA    L    95_C      L    95_C     1.673     0    0.028   0.998     3.360   72.857   71.071
LGA    R    96_C      R    96_C     1.703     0    0.039   0.865     3.354   72.857   64.372
LGA    A    97_C      A    97_C     1.446     0    0.091   0.089     1.533   77.143   78.000
LGA    T    98_C      T    98_C     1.868     0    0.112   1.090     3.968   72.857   67.483
LGA    G    99_C      G    99_C     1.955     0    0.290   0.290     1.976   72.857   72.857
LGA    E   100_C      E   100_C     1.749     0    0.047   1.053     3.257   64.881   62.381
LGA    R   101_C      R   101_C     1.845     0    0.049   1.414     9.594   70.833   45.152
LGA    E   102_C      E   102_C     1.110     0    0.056   0.366     1.825   81.429   80.476
LGA    V   103_C      V   103_C     1.114     0    0.039   1.128     3.797   85.952   76.190
LGA    P   104_C      P   104_C     0.995     0    0.073   0.382     1.907   88.214   84.082
LGA    S   105_C      S   105_C     0.932     0    0.064   0.581     2.303   88.214   83.175
LGA    K   106_C      K   106_C     0.713     0    0.045   1.224     5.577   90.476   72.751
LGA    M   107_C      M   107_C     0.790     0    0.023   1.261     5.121   90.476   72.321
LGA    I   108_C      I   108_C     0.595     0    0.039   1.294     3.174   95.238   78.571
LGA    G   109_C      G   109_C     0.273     0    0.069   0.069     0.435  100.000  100.000
LGA    N   110_C      N   110_C     0.409     0    0.024   0.554     1.728   95.238   93.036
LGA    L   111_C      L   111_C     0.784     0    0.052   1.116     3.014   90.476   81.250
LGA    V   112_C      V   112_C     0.771     0    0.047   0.874     2.604   88.214   83.129
LGA    M   113_C      M   113_C     0.514     0    0.035   0.875     1.917   90.476   86.131
LGA    E   114_C      E   114_C     0.999     0    0.069   1.047     5.220   85.952   65.979
LGA    Q   115_C      Q   115_C     1.750     0    0.065   1.171     4.053   79.286   71.799
LGA    L   116_C      L   116_C     1.303     0    0.035   0.966     2.744   83.690   81.786
LGA    K   117_C      K   117_C     0.565     0    0.032   1.046     6.200   88.214   70.265
LGA    K   118_C      K   118_C     0.736     0    0.025   0.563     2.936   90.476   82.857
LGA    L   119_C      L   119_C     0.565     0    0.061   0.854     2.544   92.857   84.286
LGA    D   120_C      D   120_C     0.561     0    0.035   0.247     1.310   92.857   90.536
LGA    K   121_C      K   121_C     0.658     0    0.066   0.591     3.989   90.476   74.497
LGA    V   122_C      V   122_C     0.549     0    0.038   0.086     0.643   95.238   93.197
LGA    A   123_C      A   123_C     0.348     0    0.054   0.057     0.546  100.000   98.095
LGA    Y   124_C      Y   124_C     0.287     0    0.043   0.437     1.191  100.000   93.730
LGA    I   125_C      I   125_C     0.362     0    0.024   1.574     4.658  100.000   81.667
LGA    R   126_C      R   126_C     0.384     0    0.043   0.393     1.450  100.000   94.892
LGA    F   127_C      F   127_C     0.459     0    0.028   0.118     0.740   95.238   93.074
LGA    A   128_C      A   128_C     0.488     0    0.059   0.059     0.748   95.238   96.190
LGA    S   129_C      S   129_C     0.560     0    0.141   0.584     1.816   90.595   87.619
LGA    V   130_C      V   130_C     0.767     0    0.014   1.280     2.884   90.476   80.748
LGA    Y   131_C      Y   131_C     0.507     0    0.015   0.251     2.785   95.238   81.944
LGA    R   132_C      R   132_C     0.464     0    0.142   0.842     3.004   95.238   90.346
LGA    S   133_C      S   133_C     0.387     0    0.128   0.155     0.512   97.619   98.413
LGA    F   134_C      F   134_C     1.046     0    0.025   0.478     2.397   83.690   77.662
LGA    E   135_C      E   135_C     1.006     0    0.179   0.559     3.482   79.524   71.587
LGA    D   136_C      D   136_C     1.451     0    0.150   0.699     3.411   81.429   69.464
LGA    I   137_C      I   137_C     1.511     0    0.065   1.062     4.627   77.143   68.810
LGA    K   138_C      K   138_C     1.312     0    0.085   1.324     7.480   81.429   54.233
LGA    D   139_C      D   139_C     0.958     0    0.034   0.618     2.032   90.476   87.262
LGA    F   140_C      F   140_C     0.982     0    0.035   0.223     1.572   85.952   84.762
LGA    G   141_C      G   141_C     1.197     0    0.051   0.051     1.271   81.429   81.429
LGA    E   142_C      E   142_C     1.231     0    0.036   0.285     3.105   85.952   74.339
LGA    E   143_C      E   143_C     0.781     0    0.054   0.622     2.446   90.476   88.677
LGA    I   144_C      I   144_C     0.746     0    0.025   0.144     1.333   90.476   89.345
LGA    A   145_C      A   145_C     1.420     0    0.025   0.030     1.892   79.286   78.000
LGA    R   146_C      R   146_C     1.673     0    0.387   1.557     5.989   75.000   50.130
LGA    L   147_C      L   147_C     1.396     0    0.017   1.069     2.546   79.286   75.238
LGA    E   148_C      E   148_C     1.137     0    0.174   0.943     3.468   75.119   74.180
LGA    D   149_C      D   149_C     2.151     0    0.678   0.612     4.561   56.548   60.714
LGA    H   150_C      H   150_C     1.500     0    0.066   1.509     8.540   55.119   35.381

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      150     600    600  100.00    1212   1212  100.00               153
SUMMARY(RMSD_GDC):     9.013          8.969                  9.176           56.446   51.546

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  150  153    4.0    100    1.13    60.621    62.015     8.136

LGA_LOCAL      RMSD:   1.129  Number of atoms:  100  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  13.727  Number of assigned atoms:  150 
Std_ASGN_ATOMS RMSD:   9.013  Standard rmsd on all 150 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.158037 * X  +  -0.605775 * Y  +  -0.779783 * Z  + 112.745232
  Y_new =  -0.894518 * X  +   0.246599 * Y  +  -0.372861 * Z  + 117.678520
  Z_new =   0.418164 * X  +   0.756456 * Y  +  -0.502905 * Z  + -22.129229 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -1.395928 -0.431423  2.157518   [DEG:  -79.9808  -24.7187  123.6167 ]
ZXZ: -1.124772  2.097753  0.504985   [DEG:  -64.4447  120.1924   28.9335 ]
 
# END of job
