
#######################################################
#                                                     #
#                        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:   118      36_C - 153_C       4.94     9.18
  LCS_AVERAGE:     69.80

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   111      43_C - 153_C       1.84    13.54
  LCS_AVERAGE:     61.78

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    90      46_C - 135_C       0.96    14.57
  LCS_AVERAGE:     45.58

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     46   51   69      0    3    3    3    4    4   32   47   56   60   63   69   73   82   88  103  111  118  127  133 
LCS_GDT     H     2_C     H     2_C     47   51   69      3    9   45   48   49   49   52   54   56   60   63   69   73   82   95  104  112  118  126  133 
LCS_GDT     C     3_C     C     3_C     47   51   69     29   44   46   48   49   49   52   54   56   60   63   69   73   82   87  100  109  118  126  133 
LCS_GDT     P     4_C     P     4_C     47   51   69     29   43   46   48   49   49   52   54   56   60   63   69   73   82   86   97  109  118  126  131 
LCS_GDT     F     5_C     F     5_C     47   51   69     29   44   46   48   49   49   52   54   56   60   63   69   73   82   86   96  103  116  121  128 
LCS_GDT     C     6_C     C     6_C     47   51   69     30   44   46   48   49   49   52   54   56   60   63   69   73   82   84   93  102  112  121  125 
LCS_GDT     F     7_C     F     7_C     47   51   69     30   44   46   48   49   49   52   54   56   60   63   69   73   82   86   96  103  116  121  128 
LCS_GDT     A     8_C     A     8_C     47   51   69     30   44   46   48   49   49   52   54   56   60   63   69   73   82   86   96  103  116  121  128 
LCS_GDT     V     9_C     V     9_C     47   51   69     30   44   46   48   49   49   52   54   56   60   63   69   73   82   86   96  105  116  123  129 
LCS_GDT     D    10_C     D    10_C     47   51   69      5   44   46   48   49   49   52   54   56   60   63   69   73   82   86   96  106  116  126  130 
LCS_GDT     T    11_C     T    11_C     47   51   69     30   44   46   48   49   49   52   54   56   60   63   69   74   89  100  108  116  122  130  134 
LCS_GDT     K    12_C     K    12_C     47   51   69     30   44   46   48   49   49   52   54   56   60   67   80   94  101  112  120  125  128  131  134 
LCS_GDT     V    13_C     V    13_C     47   51   69     29   44   46   48   49   49   52   54   60   73   88   97  107  115  119  124  128  129  131  134 
LCS_GDT     I    14_C     I    14_C     47   51   69     30   44   46   48   49   49   52   54   60   76   90   98  108  115  120  124  128  129  131  134 
LCS_GDT     D    15_C     D    15_C     47   51   69     30   44   46   48   49   49   52   54   75   89   99  107  114  120  124  124  128  129  131  134 
LCS_GDT     S    16_C     S    16_C     47   51   69     30   44   46   48   49   49   63   77   89   99  108  116  119  120  124  124  128  129  131  134 
LCS_GDT     R    17_C     R    17_C     47   51   69      5   44   46   48   49   49   62   74   87  101  110  117  119  120  124  124  128  129  131  134 
LCS_GDT     L    18_C     L    18_C     47   51   69     30   44   46   48   49   49   61   75   87  104  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     V    19_C     V    19_C     47   51   69     30   44   46   48   49   49   52   54   56   60   89  103  112  118  124  124  128  129  131  134 
LCS_GDT     G    20_C     G    20_C     47   51   69     30   44   46   48   49   49   52   54   56   60   63   69   73   82   86  123  125  125  131  134 
LCS_GDT     E    21_C     E    21_C     47   51   69     30   44   46   48   49   49   52   54   56   60   63   69   73   82   85   96  123  125  126  127 
LCS_GDT     G    22_C     G    22_C     47   51   69     30   44   46   48   49   49   52   54   56   98  110  117  119  120  124  124  128  129  131  134 
LCS_GDT     S    23_C     S    23_C     47   51   69     30   44   46   48   49   49   52   54   85  109  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     S    24_C     S    24_C     47   51   69     30   44   46   48   49   53   69   85  100  110  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     V    25_C     V    25_C     47   51   69     30   44   46   48   49   56   72   85   95  107  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     R    26_C     R    26_C     47   51   69     30   44   46   48   49   49   52   54   77   91  102  111  117  120  124  124  128  129  131  134 
LCS_GDT     R    27_C     R    27_C     47   51   69     23   44   46   48   49   49   52   54   75   91   99  107  116  120  124  124  128  129  131  134 
LCS_GDT     R    28_C     R    28_C     47   51   69     30   44   46   48   49   49   52   54   60   66   82   94  105  113  119  124  128  129  131  134 
LCS_GDT     R    29_C     R    29_C     47   51   69     30   44   46   48   49   49   52   54   56   66   74   86   98  109  117  122  125  129  131  134 
LCS_GDT     Q    30_C     Q    30_C     47   51   69     30   44   46   48   49   49   52   54   56   60   63   69   83   94  106  116  119  126  130  134 
LCS_GDT     C    31_C     C    31_C     47   51   69     30   44   46   48   49   49   52   54   56   60   63   69   73   84   95  104  112  118  127  133 
LCS_GDT     L    32_C     L    32_C     47   51   69     30   44   46   48   49   49   52   54   56   60   63   69   73   82   89   99  109  118  126  133 
LCS_GDT     V    33_C     V    33_C     47   51   69     29   44   46   48   49   49   52   54   56   60   63   69   73   82   86   96  103  116  121  128 
LCS_GDT     C    34_C     C    34_C     47   51   69     30   44   46   48   49   49   52   54   56   60   63   69   73   82   86   96  103  116  121  128 
LCS_GDT     N    35_C     N    35_C     47   51   69     30   44   46   48   49   49   52   54   56   60   63   69   73   82   87   99  106  116  126  129 
LCS_GDT     E    36_C     E    36_C     47   51  118     30   44   46   48   49   49   52   54   56   60   63   69   73   82   87   99  109  118  126  133 
LCS_GDT     R    37_C     R    37_C     47   51  118     30   44   46   48   49   49   52   54   56   60   63   69   73   88   99  111  116  122  130  133 
LCS_GDT     F    38_C     F    38_C     47   51  118     24   44   46   48   49   49   52   54   56   60   63   72   83   97  108  116  121  127  131  134 
LCS_GDT     T    39_C     T    39_C     47   51  118     26   44   46   48   49   49   52   54   56   60   74   87  100  112  117  122  125  129  131  134 
LCS_GDT     T    40_C     T    40_C     47   51  118     23   44   46   48   49   49   52   54   60   76   90   98  109  116  120  124  128  129  131  134 
LCS_GDT     F    41_C     F    41_C     47   51  118     30   44   46   48   49   49   52   54   75   91   99  107  116  120  124  124  128  129  131  134 
LCS_GDT     E    42_C     E    42_C     47   51  118     30   44   46   48   49   49   63   80   90  101  109  117  119  120  124  124  128  129  131  134 
LCS_GDT     V    43_C     V    43_C     47  111  118     30   44   46   48   49   65   79   92  102  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     A    44_C     A    44_C     47  111  118     29   44   46   56   78   98  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     E    45_C     E    45_C     89  111  118      4   44   46   55   80   98  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     L    46_C     L    46_C     90  111  118     23   52   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     V    47_C     V    47_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     M    48_C     M    48_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     P    49_C     P    49_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     R    50_C     R    50_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     V    51_C     V    51_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     V    52_C     V    52_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     K    53_C     K    53_C     90  111  118     36   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     S    54_C     S    54_C     90  111  118     24   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     N    55_C     N    55_C     90  111  118     49   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     D    56_C     D    56_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     V    57_C     V    57_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     R    58_C     R    58_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     E    59_C     E    59_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     P    60_C     P    60_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     F    61_C     F    61_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     N    62_C     N    62_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     E    63_C     E    63_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     E    64_C     E    64_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     K    65_C     K    65_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     L    66_C     L    66_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     R    67_C     R    67_C     90  111  118     57   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     S    68_C     S    68_C     90  111  118     57   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     G    69_C     G    69_C     90  111  118     57   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     M    70_C     M    70_C     90  111  118     38   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     L    71_C     L    71_C     90  111  118     53   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     R    72_C     R    72_C     90  111  118     38   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     A    73_C     A    73_C     90  111  118     23   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     L    74_C     L    74_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     E    75_C     E    75_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     K    76_C     K    76_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     R    77_C     R    77_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     P    78_C     P    78_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     V    79_C     V    79_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     S    80_C     S    80_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     S    81_C     S    81_C     90  111  118     58   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     D    82_C     D    82_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  116  119  120  124  124  128  129  131  134 
LCS_GDT     D    83_C     D    83_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     V    84_C     V    84_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     E    85_C     E    85_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     M    86_C     M    86_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     A    87_C     A    87_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     I    88_C     I    88_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     N    89_C     N    89_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     H    90_C     H    90_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     I    91_C     I    91_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     K    92_C     K    92_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     S    93_C     S    93_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     Q    94_C     Q    94_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     L    95_C     L    95_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     R    96_C     R    96_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     A    97_C     A    97_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     T    98_C     T    98_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     G    99_C     G    99_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     E   100_C     E   100_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     R   101_C     R   101_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     E   102_C     E   102_C     90  111  118     36   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     V   103_C     V   103_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     P   104_C     P   104_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     S   105_C     S   105_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     K   106_C     K   106_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     M   107_C     M   107_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     I   108_C     I   108_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     G   109_C     G   109_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     N   110_C     N   110_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     L   111_C     L   111_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     V   112_C     V   112_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     M   113_C     M   113_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     E   114_C     E   114_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     Q   115_C     Q   115_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     L   116_C     L   116_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     K   117_C     K   117_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     K   118_C     K   118_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     L   119_C     L   119_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     D   120_C     D   120_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     K   121_C     K   121_C     90  111  118     59   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     V   122_C     V   122_C     90  111  118     38   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     A   123_C     A   123_C     90  111  118     36   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     Y   124_C     Y   124_C     90  111  118     56   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     I   125_C     I   125_C     90  111  118     56   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     R   126_C     R   126_C     90  111  118     38   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     F   127_C     F   127_C     90  111  118     39   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     A   128_C     A   128_C     90  111  118     42   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     S   129_C     S   129_C     90  111  118     36   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     V   130_C     V   130_C     90  111  118     36   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     Y   131_C     Y   131_C     90  111  118     27   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     R   132_C     R   132_C     90  111  118     27   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     S   133_C     S   133_C     90  111  118      3   26   71   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     F   134_C     F   134_C     90  111  118      3   23   48   90  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     E   135_C     E   135_C     90  111  118      5   18   40   71   93  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     D   136_C     D   136_C     23  111  118      5   23   48   83  100  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     I   137_C     I   137_C     23  111  118      5   23   56   92  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     K   138_C     K   138_C     23  111  118     11   32   70   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     D   139_C     D   139_C     23  111  118     11   27   62   90  103  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     F   140_C     F   140_C     23  111  118     11   16   48   90  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     G   141_C     G   141_C     23  111  118     11   64   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     E   142_C     E   142_C     23  111  118     11   65   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     E   143_C     E   143_C     23  111  118     12   79   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     I   144_C     I   144_C     23  111  118     48   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     A   145_C     A   145_C     23  111  118     49   88   92   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     R   146_C     R   146_C     23  111  118     13   41   89   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     L   147_C     L   147_C     23  111  118     11   55   90   94  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     E   148_C     E   148_C     23  111  118      9   30   90   93  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     D   149_C     D   149_C     23  111  118      7   21   74   92  103  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     H   150_C     H   150_C     23  111  118      7   23   45   89  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     H   151_C     H   151_C     23  111  118      3   23   44   85  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     H   152_C     H   152_C     23  111  118      3   23   45   89  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_GDT     H   153_C     H   153_C     23  111  118      4   23   45   85  104  107  110  110  110  111  113  117  119  120  124  124  128  129  131  134 
LCS_AVERAGE  LCS_A:  59.05  (  45.58   61.78   69.80 )

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     59     88     92     94    104    107    110    110    110    111    113    117    119    120    124    124    128    129    131    134 
GDT PERCENT_AT  38.56  57.52  60.13  61.44  67.97  69.93  71.90  71.90  71.90  72.55  73.86  76.47  77.78  78.43  81.05  81.05  83.66  84.31  85.62  87.58
GDT RMS_LOCAL    0.28   0.51   0.67   0.73   1.21   1.33   1.60   1.60   1.60   1.84   2.21   2.95   3.12   3.27   3.79   3.79   4.37   4.50   4.82   5.15
GDT RMS_ALL_AT  15.19  15.12  14.83  14.87  14.57  14.41  13.90  13.90  13.90  13.54  13.01  11.67  11.39  11.13  10.26  10.26   9.34   9.16   8.72   8.40

# Checking swapping
#   possible swapping detected:  F     7_C      F     7_C
#   possible swapping detected:  D    10_C      D    10_C
#   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    42_C      E    42_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    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:  D   120_C      D   120_C
#   possible swapping detected:  F   127_C      F   127_C
#   possible swapping detected:  Y   131_C      Y   131_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    28.983     0    0.302   0.974    33.600    0.000    0.000
LGA    H     2_C      H     2_C    27.722     0    0.683   1.512    28.442    0.000    0.000
LGA    C     3_C      C     3_C    31.070     0    0.053   0.064    34.046    0.000    0.000
LGA    P     4_C      P     4_C    31.618     0    0.024   0.100    33.737    0.000    0.000
LGA    F     5_C      F     5_C    35.555     0    0.147   0.204    37.872    0.000    0.000
LGA    C     6_C      C     6_C    37.341     0    0.071   0.082    38.141    0.000    0.000
LGA    F     7_C      F     7_C    34.524     0    0.224   1.209    35.271    0.000    0.000
LGA    A     8_C      A     8_C    34.608     0    0.042   0.046    35.108    0.000    0.000
LGA    V     9_C      V     9_C    31.888     0    0.113   1.106    33.432    0.000    0.000
LGA    D    10_C      D    10_C    31.467     0    0.174   1.046    34.181    0.000    0.000
LGA    T    11_C      T    11_C    28.687     0    0.056   1.008    29.320    0.000    0.000
LGA    K    12_C      K    12_C    26.802     0    0.058   0.320    29.205    0.000    0.000
LGA    V    13_C      V    13_C    23.088     0    0.059   0.107    24.167    0.000    0.000
LGA    I    14_C      I    14_C    23.678     0    0.180   1.122    28.436    0.000    0.000
LGA    D    15_C      D    15_C    20.816     0    0.090   0.453    21.809    0.000    0.000
LGA    S    16_C      S    16_C    16.628     0    0.238   0.305    17.958    0.000    0.000
LGA    R    17_C      R    17_C    15.095     0    0.055   0.912    23.384    0.000    0.000
LGA    L    18_C      L    18_C    12.891     0    0.116   0.827    13.933    0.000    0.595
LGA    V    19_C      V    19_C    15.415     0    0.026   1.183    17.033    0.000    0.000
LGA    G    20_C      G    20_C    15.583     0    0.113   0.113    15.779    0.000    0.000
LGA    E    21_C      E    21_C    13.898     0    0.154   0.567    20.326    0.000    0.000
LGA    G    22_C      G    22_C     9.931     0    0.021   0.021    11.513    2.262    2.262
LGA    S    23_C      S    23_C     9.299     0    0.039   0.107    11.565    1.548    1.032
LGA    S    24_C      S    24_C    11.178     0    0.046   0.610    15.205    0.000    0.000
LGA    V    25_C      V    25_C    12.727     0    0.027   0.104    14.991    0.000    0.000
LGA    R    26_C      R    26_C    16.933     0    0.031   0.974    22.266    0.000    0.000
LGA    R    27_C      R    27_C    18.836     0    0.130   0.336    21.003    0.000    0.000
LGA    R    28_C      R    28_C    23.608     0    0.027   1.093    26.761    0.000    0.000
LGA    R    29_C      R    29_C    25.600     0    0.032   1.056    28.001    0.000    0.000
LGA    Q    30_C      Q    30_C    29.726     0    0.016   0.933    33.035    0.000    0.000
LGA    C    31_C      C    31_C    32.420     0    0.056   0.096    34.569    0.000    0.000
LGA    L    32_C      L    32_C    34.579     0    0.063   0.145    36.862    0.000    0.000
LGA    V    33_C      V    33_C    38.047     0    0.015   0.357    40.454    0.000    0.000
LGA    C    34_C      C    34_C    38.663     0    0.084   0.082    38.838    0.000    0.000
LGA    N    35_C      N    35_C    36.677     0    0.152   0.219    39.821    0.000    0.000
LGA    E    36_C      E    36_C    34.789     0    0.082   0.473    36.554    0.000    0.000
LGA    R    37_C      R    37_C    31.069     0    0.107   0.741    34.805    0.000    0.000
LGA    F    38_C      F    38_C    27.785     0    0.017   0.117    28.703    0.000    0.000
LGA    T    39_C      T    39_C    23.806     0    0.047   0.095    25.348    0.000    0.000
LGA    T    40_C      T    40_C    20.366     0    0.020   1.335    21.281    0.000    0.000
LGA    F    41_C      F    41_C    16.818     0    0.178   0.358    20.253    0.000    0.000
LGA    E    42_C      E    42_C    13.152     0    0.099   0.364    14.388    0.000    0.053
LGA    V    43_C      V    43_C    10.061     0    0.032   0.756    11.262    1.429    0.816
LGA    A    44_C      A    44_C     5.883     0    0.056   0.058     7.227   18.571   21.143
LGA    E    45_C      E    45_C     5.497     0    0.054   0.555     9.695   33.571   18.783
LGA    L    46_C      L    46_C     1.343     0    0.369   0.283     4.258   77.619   67.798
LGA    V    47_C      V    47_C     0.906     0    0.087   1.147     2.862   92.857   82.041
LGA    M    48_C      M    48_C     0.947     0    0.043   0.131     0.994   90.476   91.667
LGA    P    49_C      P    49_C     1.034     0    0.052   0.088     1.248   88.214   85.306
LGA    R    50_C      R    50_C     0.541     0    0.029   1.039     5.454   90.476   74.329
LGA    V    51_C      V    51_C     0.531     0    0.031   0.081     0.756   92.857   95.918
LGA    V    52_C      V    52_C     0.912     0    0.070   0.086     1.134   90.476   86.599
LGA    K    53_C      K    53_C     0.958     0    0.014   0.687     1.815   90.476   84.497
LGA    S    54_C      S    54_C     0.886     0    0.010   0.042     0.996   90.476   90.476
LGA    N    55_C      N    55_C     1.112     0    0.037   0.262     1.645   81.429   81.488
LGA    D    56_C      D    56_C     1.375     0    0.036   0.963     3.300   79.286   69.345
LGA    V    57_C      V    57_C     1.393     0    0.044   1.179     3.408   83.690   74.626
LGA    R    58_C      R    58_C     0.934     0    0.147   0.948     4.535   88.214   77.922
LGA    E    59_C      E    59_C     0.581     0    0.056   0.628     1.646   95.238   88.730
LGA    P    60_C      P    60_C     0.254     0    0.020   0.331     1.112  100.000   97.347
LGA    F    61_C      F    61_C     0.381     0    0.012   0.135     0.816  100.000   93.939
LGA    N    62_C      N    62_C     0.352     0    0.048   0.430     0.968   97.619   96.429
LGA    E    63_C      E    63_C     0.658     0    0.102   0.971     5.379   92.857   74.180
LGA    E    64_C      E    64_C     1.189     0    0.014   0.608     3.383   81.429   67.460
LGA    K    65_C      K    65_C     1.151     0    0.038   0.622     2.013   81.429   78.624
LGA    L    66_C      L    66_C     0.860     0    0.046   0.105     0.997   90.476   94.048
LGA    R    67_C      R    67_C     1.229     0    0.069   0.715     3.720   81.429   73.420
LGA    S    68_C      S    68_C     1.513     0    0.012   0.128     1.742   79.286   78.571
LGA    G    69_C      G    69_C     1.264     0    0.027   0.027     1.314   81.429   81.429
LGA    M    70_C      M    70_C     1.033     0    0.048   0.891     2.867   83.690   81.786
LGA    L    71_C      L    71_C     1.409     0    0.070   0.195     1.576   81.429   78.214
LGA    R    72_C      R    72_C     1.474     0    0.023   0.848     2.578   81.429   75.368
LGA    A    73_C      A    73_C     1.136     0    0.035   0.047     1.238   85.952   85.048
LGA    L    74_C      L    74_C     0.928     0    0.150   0.151     1.061   88.214   89.345
LGA    E    75_C      E    75_C     1.179     0    0.090   1.047     2.430   85.952   79.735
LGA    K    76_C      K    76_C     0.920     0    0.067   0.143     1.560   90.595   85.556
LGA    R    77_C      R    77_C     0.614     0    0.011   1.024     3.082   90.476   87.792
LGA    P    78_C      P    78_C     0.791     0    0.062   0.104     0.926   90.476   90.476
LGA    V    79_C      V    79_C     0.689     0    0.065   0.099     1.254   88.214   89.184
LGA    S    80_C      S    80_C     1.442     0    0.011   0.017     1.723   83.690   80.079
LGA    S    81_C      S    81_C     1.423     0    0.106   0.739     4.353   81.429   71.270
LGA    D    82_C      D    82_C     1.449     0    0.024   0.135     1.882   81.429   77.143
LGA    D    83_C      D    83_C     1.000     0    0.028   0.057     1.221   85.952   84.821
LGA    V    84_C      V    84_C     0.757     0    0.034   0.062     0.833   90.476   90.476
LGA    E    85_C      E    85_C     1.132     0    0.071   0.170     2.093   81.429   76.720
LGA    M    86_C      M    86_C     1.128     0    0.025   0.819     3.383   85.952   82.083
LGA    A    87_C      A    87_C     0.597     0    0.037   0.052     0.796   90.476   92.381
LGA    I    88_C      I    88_C     0.545     0    0.037   0.089     0.796   90.476   90.476
LGA    N    89_C      N    89_C     0.903     0    0.038   0.053     1.242   90.476   85.952
LGA    H    90_C      H    90_C     0.906     0    0.081   1.158     2.684   90.476   82.714
LGA    I    91_C      I    91_C     0.514     0    0.022   0.049     0.700   92.857   96.429
LGA    K    92_C      K    92_C     0.505     0    0.035   0.508     1.426   92.857   88.519
LGA    S    93_C      S    93_C     1.018     0    0.028   0.258     1.155   83.690   82.937
LGA    Q    94_C      Q    94_C     1.015     0    0.096   0.831     2.774   88.214   80.794
LGA    L    95_C      L    95_C     0.852     0    0.019   1.096     2.965   90.476   84.107
LGA    R    96_C      R    96_C     1.102     0    0.034   0.884     3.198   83.690   72.814
LGA    A    97_C      A    97_C     1.153     0    0.011   0.017     1.407   81.429   81.429
LGA    T    98_C      T    98_C     1.241     0    0.019   0.046     1.530   79.286   80.204
LGA    G    99_C      G    99_C     1.275     0    0.213   0.213     1.275   81.429   81.429
LGA    E   100_C      E   100_C     1.578     0    0.030   0.243     1.696   77.143   77.619
LGA    R   101_C      R   101_C     1.059     0    0.058   0.750     2.282   81.429   80.823
LGA    E   102_C      E   102_C     1.303     0    0.024   0.638     1.721   81.429   77.619
LGA    V   103_C      V   103_C     1.367     0    0.046   0.077     1.459   81.429   81.429
LGA    P   104_C      P   104_C     1.284     0    0.063   0.320     1.947   81.429   78.980
LGA    S   105_C      S   105_C     0.787     0    0.024   0.098     0.927   90.476   90.476
LGA    K   106_C      K   106_C     1.082     0    0.009   0.875     3.617   81.429   76.243
LGA    M   107_C      M   107_C     1.012     0    0.047   0.323     1.708   85.952   81.548
LGA    I   108_C      I   108_C     0.585     0    0.011   0.090     0.691   90.476   94.048
LGA    G   109_C      G   109_C     0.746     0    0.036   0.036     0.845   90.476   90.476
LGA    N   110_C      N   110_C     0.749     0    0.042   0.156     1.091   90.476   89.345
LGA    L   111_C      L   111_C     0.541     0    0.018   0.162     1.260   90.476   89.345
LGA    V   112_C      V   112_C     0.606     0    0.071   1.197     2.623   95.238   84.762
LGA    M   113_C      M   113_C     0.668     0    0.031   0.704     2.240   92.857   86.190
LGA    E   114_C      E   114_C     0.754     0    0.036   1.041     5.598   90.476   65.873
LGA    Q   115_C      Q   115_C     0.417     0    0.002   1.032     3.029  100.000   91.323
LGA    L   116_C      L   116_C     0.309     0    0.026   0.057     0.478  100.000  100.000
LGA    K   117_C      K   117_C     0.454     0    0.069   1.000     3.613   97.619   85.450
LGA    K   118_C      K   118_C     0.454     0    0.061   0.616     2.007  100.000   91.852
LGA    L   119_C      L   119_C     0.244     0    0.070   0.106     0.664  100.000   98.810
LGA    D   120_C      D   120_C     0.213     0    0.041   0.334     1.045  100.000   95.298
LGA    K   121_C      K   121_C     0.448     0    0.051   0.463     1.991   95.238   87.619
LGA    V   122_C      V   122_C     0.837     0    0.035   0.054     1.086   88.214   87.891
LGA    A   123_C      A   123_C     0.751     0    0.066   0.071     0.751   90.476   90.476
LGA    Y   124_C      Y   124_C     0.436     0    0.075   0.126     0.984   95.238   95.238
LGA    I   125_C      I   125_C     0.577     0    0.037   0.653     2.622   92.857   87.500
LGA    R   126_C      R   126_C     0.745     0    0.088   0.349     1.179   88.214   88.831
LGA    F   127_C      F   127_C     0.665     0    0.025   0.123     0.740   90.476   90.476
LGA    A   128_C      A   128_C     0.648     0    0.073   0.087     1.035   88.214   88.667
LGA    S   129_C      S   129_C     0.894     0    0.046   0.047     1.165   88.214   88.968
LGA    V   130_C      V   130_C     1.033     0    0.073   1.252     2.772   85.952   78.163
LGA    Y   131_C      Y   131_C     0.802     0    0.142   1.343     8.762   90.476   53.929
LGA    R   132_C      R   132_C     0.457     0    0.562   0.448     2.085   88.810   94.199
LGA    S   133_C      S   133_C     2.342     0    0.099   0.720     3.246   61.190   58.651
LGA    F   134_C      F   134_C     2.859     0    0.051   0.683     3.320   53.571   60.087
LGA    E   135_C      E   135_C     4.154     0    0.097   0.392     4.974   40.238   35.344
LGA    D   136_C      D   136_C     3.522     0    0.051   0.190     3.737   46.667   48.333
LGA    I   137_C      I   137_C     2.995     0    0.023   1.105     3.803   55.357   51.845
LGA    K   138_C      K   138_C     2.579     0    0.113   0.779     6.601   59.048   48.042
LGA    D   139_C      D   139_C     3.070     0    0.025   0.392     4.247   53.571   48.512
LGA    F   140_C      F   140_C     2.862     0    0.013   1.239     3.560   62.976   58.052
LGA    G   141_C      G   141_C     1.484     0    0.055   0.055     1.964   83.810   83.810
LGA    E   142_C      E   142_C     1.099     0    0.038   0.194     3.423   85.952   72.646
LGA    E   143_C      E   143_C     0.958     0    0.039   0.357     2.557   92.976   82.910
LGA    I   144_C      I   144_C     1.025     0    0.031   0.046     2.319   83.690   77.262
LGA    A   145_C      A   145_C     1.314     0    0.039   0.058     2.317   77.381   78.190
LGA    R   146_C      R   146_C     2.002     0    0.307   0.773     3.383   63.095   66.364
LGA    L   147_C      L   147_C     2.019     0    0.108   0.242     2.978   64.881   72.083
LGA    E   148_C      E   148_C     2.461     0    0.176   0.190     2.813   60.952   63.069
LGA    D   149_C      D   149_C     2.846     0    0.073   0.434     3.386   55.357   56.250
LGA    H   150_C      H   150_C     2.675     0    0.172   0.783     3.803   57.143   58.143
LGA    H   151_C      H   151_C     2.800     0    0.090   1.120     3.848   55.357   54.381
LGA    H   152_C      H   152_C     2.779     0    0.137   1.126     9.137   57.143   34.238
LGA    H   153_C      H   153_C     3.043     0    0.562   1.190     7.469   50.119   36.381

# 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):     7.137          7.109                  7.282           59.277   56.341

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  155  153    4.0    110    1.60    67.974    67.547     6.480

LGA_LOCAL      RMSD:   1.598  Number of atoms:  110  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  13.898  Number of assigned atoms:  153 
Std_ASGN_ATOMS RMSD:   7.137  Standard rmsd on all 153 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.152331 * X  +   0.221268 * Y  +  -0.963242 * Z  +   4.077177
  Y_new =   0.936982 * X  +   0.277726 * Y  +   0.211975 * Z  +  34.307865
  Z_new =   0.314421 * X  +  -0.934831 * Y  +  -0.165017 * Z  +  17.649475 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  1.409630 -0.319847 -1.745517   [DEG:   80.7658  -18.3259 -100.0108 ]
ZXZ: -1.787408  1.736572  2.817138   [DEG: -102.4109   99.4982  161.4101 ]
 
# END of job
