
#######################################################
#                                                     #
#                        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  205 ( 1624),  selected  205 , name one
# Molecule2: number of CA atoms  205 ( 1624),  selected  205 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:A  -ch2:A  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   133       1_A - 133_A       4.59    19.19
  LCS_AVERAGE:     51.05

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   126       1_A - 126_A       1.79    19.32
  LONGEST_CONTINUOUS_SEGMENT:   126       2_A - 127_A       1.94    19.29
  LCS_AVERAGE:     44.79

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    47     151_A - 197_A       0.86    31.05
  LCS_AVERAGE:     15.62

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  205
LCS_GDT     RESIDUE       RESIDUE       SEGMENT_SIZE    GLOBAL DISTANCE TEST COLUMNS: number of residues under the threshold assigned to each residue pair
LCS_GDT   NAME NUMBER   NAME NUMBER    1.0  2.0  5.0    0.5  1.0  1.5  2.0  2.5  3.0  3.5  4.0  4.5  5.0  5.5  6.0  6.5  7.0  7.5  8.0  8.5  9.0  9.5 10.0
LCS_GDT     S     1_A     S     1_A      3  126  133      0   11   39   83  101  112  115  121  124  125  126  126  126  126  128  128  129  132  135  137 
LCS_GDT     M     2_A     M     2_A      3  126  133      1    3    3   20   92  106  117  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     N     3_A     N     3_A     40  126  133     12   24   73   99  113  119  120  121  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     I     4_A     I     4_A     40  126  133     12   47   86  102  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     E     5_A     E     5_A     40  126  133     12   52   88  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     V     6_A     V     6_A     40  126  133     12   55   90  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     A     7_A     A     7_A     40  126  133     12   53   90  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     R     8_A     R     8_A     40  126  133     12   54   90  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     A     9_A     A     9_A     40  126  133     19   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     A    10_A     A    10_A     40  126  133     23   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     R    11_A     R    11_A     40  126  133     23   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     L    12_A     L    12_A     40  126  133     12   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     A    13_A     A    13_A     40  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     Q    14_A     Q    14_A     40  126  133     20   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     I    15_A     I    15_A     40  126  133     13   66   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     F    16_A     F    16_A     40  126  133     25   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     K    17_A     K    17_A     40  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     E    18_A     E    18_A     40  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     I    19_A     I    19_A     40  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     C    20_A     C    20_A     40  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     D    21_A     D    21_A     40  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     G    22_A     G    22_A     40  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     I    23_A     I    23_A     40  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     I    24_A     I    24_A     40  126  133     23   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     S    25_A     S    25_A     40  126  133      7   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     Y    26_A     Y    26_A     40  126  133     23   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     R    27_A     R    27_A     40  126  133     23   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     D    28_A     D    28_A     40  126  133     13   62   90  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  133  137 
LCS_GDT     S    29_A     S    29_A     40  126  133      9   40   84  104  114  119  120  122  124  125  126  126  126  127  128  128  128  129  131  134 
LCS_GDT     S    30_A     S    30_A     40  126  133     11   52   90  105  114  119  120  122  124  125  126  126  126  127  128  128  128  131  133  134 
LCS_GDT     Q    31_A     Q    31_A     40  126  133     15   55   90  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  133  137 
LCS_GDT     Q    32_A     Q    32_A     40  126  133      9   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     T    33_A     T    33_A     40  126  133     21   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     L    34_A     L    34_A     40  126  133     22   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     A    35_A     A    35_A     40  126  133     22   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     A    36_A     A    36_A     40  126  133     22   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     P    37_A     P    37_A     40  126  133     22   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     L    38_A     L    38_A     40  126  133     22   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     L    39_A     L    39_A     40  126  133     11   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     N    40_A     N    40_A     40  126  133     23   62   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     L    41_A     L    41_A     40  126  133     31   66   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     P    42_A     P    42_A     40  126  133     31   64   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     P    43_A     P    43_A     16  126  133      5   47   90  104  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     K    44_A     K    44_A     16  126  133     31   62   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     K    45_A     K    45_A     16  126  133     31   64   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     K    46_A     K    46_A     16  126  133     12   55   88  104  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     N    47_A     N    47_A     16  126  133      8   56   88  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     A    48_A     A    48_A     16  126  133      5   46   89  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     D    49_A     D    49_A     16  126  133      7   16   55   99  110  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     Y    50_A     Y    50_A     16  126  133      7   37   88  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     Y    51_A     Y    51_A     16  126  133     15   66   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     E    52_A     E    52_A     16  126  133      7   26   73  100  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     K    53_A     K    53_A     16  126  133      3   16   44   83  107  115  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     I    54_A     I    54_A     40  126  133     13   63   90  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     S    55_A     S    55_A     40  126  133      3   25   77   97  113  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     D    56_A     D    56_A     40  126  133      8   59   90  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     P    57_A     P    57_A     40  126  133      9   49   90  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     L    58_A     L    58_A     40  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     D    59_A     D    59_A     40  126  133     10   66   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     L    60_A     L    60_A     40  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     S    61_A     S    61_A     40  126  133     17   62   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     T    62_A     T    62_A     40  126  133     16   59   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     I    63_A     I    63_A     40  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     E    64_A     E    64_A     40  126  133     13   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     K    65_A     K    65_A     40  126  133     11   59   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     Q    66_A     Q    66_A     40  126  133     31   63   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     I    67_A     I    67_A     40  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     L    68_A     L    68_A     40  126  133      6   56   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     I    69_A     I    69_A     40  126  133     13   66   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     G    70_A     G    70_A     40  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     Y    71_A     Y    71_A     40  126  133     31   66   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     Y    72_A     Y    72_A     40  126  133     11   62   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     K    73_A     K    73_A     40  126  133     12   59   90  104  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     T    74_A     T    74_A     40  126  133     13   61   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     V    75_A     V    75_A     40  126  133     16   63   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     E    76_A     E    76_A     40  126  133     13   62   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     A    77_A     A    77_A     40  126  133     31   66   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     F    78_A     F    78_A     40  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     D    79_A     D    79_A     40  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     A    80_A     A    80_A     40  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     D    81_A     D    81_A     40  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     M    82_A     M    82_A     40  126  133     28   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     L    83_A     L    83_A     40  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     K    84_A     K    84_A     40  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     V    85_A     V    85_A     40  126  133     22   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     F    86_A     F    86_A     40  126  133     23   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     R    87_A     R    87_A     40  126  133     23   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     N    88_A     N    88_A     40  126  133     15   57   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     A    89_A     A    89_A     40  126  133     19   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     E    90_A     E    90_A     40  126  133     15   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     K    91_A     K    91_A     40  126  133     20   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     Y    92_A     Y    92_A     40  126  133      3   39   86  104  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     Y    93_A     Y    93_A     40  126  133      9   64   90  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     G    94_A     G    94_A     38  126  133      3    7   55  102  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     R    95_A     R    95_A      4  126  133      3    4    5    7    9   27   75  114  122  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     K    96_A     K    96_A      4  126  133      3   15   32   52   88  109  117  121  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     S    97_A     S    97_A      4  126  133      3   11   26   54   85  107  114  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     P    98_A     P    98_A      4  126  133      5   14   25   52   89  109  117  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     I    99_A     I    99_A     28  126  133      8   56   90  104  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     G   100_A     G   100_A     28  126  133      5   43   88  104  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     R   101_A     R   101_A     28  126  133     17   62   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     D   102_A     D   102_A     28  126  133     29   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     V   103_A     V   103_A     28  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     C   104_A     C   104_A     28  126  133      8   63   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     R   105_A     R   105_A     28  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     L   106_A     L   106_A     28  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     R   107_A     R   107_A     28  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     K   108_A     K   108_A     28  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     A   109_A     A   109_A     28  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     Y   110_A     Y   110_A     28  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     Y   111_A     Y   111_A     28  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     S   112_A     S   112_A     28  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     A   113_A     A   113_A     28  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     R   114_A     R   114_A     28  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     H   115_A     H   115_A     28  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     E   116_A     E   116_A     28  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     A   117_A     A   117_A     28  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     S   118_A     S   118_A     28  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     A   119_A     A   119_A     28  126  133     12   66   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     Q   120_A     Q   120_A     28  126  133     31   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     I   121_A     I   121_A     28  126  133     23   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     D   122_A     D   122_A     28  126  133     18   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     E   123_A     E   123_A     28  126  133     21   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     I   124_A     I   124_A     28  126  133     20   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     V   125_A     V   125_A     28  126  133     12   67   91  105  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     G   126_A     G   126_A     28  126  133      3   19   69  102  114  119  120  122  124  125  126  126  126  127  128  128  129  132  135  137 
LCS_GDT     E   127_A     E   127_A      5  126  133      3    5    8   13   19   30   46   80  101  117  123  126  126  127  128  128  129  132  135  137 
LCS_GDT     T   128_A     T   128_A      5    6  133      3    5    8   13   22   30   50   86  109  118  123  126  126  127  128  128  129  132  135  137 
LCS_GDT     A   129_A     A   129_A      5    6  133      3    5    5    6    9   11   14   16   19   25   30   39   55   77   97  121  126  128  129  131 
LCS_GDT     S   130_A     S   130_A      5    6  133      3    5    5    6    7   10   12   15   20   27   30   37   49   68   89  109  121  126  129  130 
LCS_GDT     E   131_A     E   131_A      4    7  133      3    4    5    8    9   11   13   14   15   16   17   18   22   24   28   35   44   53   65   87 
LCS_GDT     A   132_A     A   132_A      4    7  133      3    4    5    8    9   11   13   14   15   16   17   18   20   24   28   32   36   39   46   51 
LCS_GDT     D   133_A     D   133_A      4    7  133      3    4    5    8    9   11   13   14   15   16   17   18   22   23   28   32   36   39   46   51 
LCS_GDT     S   134_A     S   134_A      4    7   21      3    4    5    8    9   11   13   14   15   16   17   18   19   20   21   23   26   29   31   34 
LCS_GDT     S   135_A     S   135_A      4    7   21      3    4    5    7    9   11   13   14   15   16   17   18   19   20   21   23   24   27   32   34 
LCS_GDT     E   136_A     E   136_A      3    7   21      3    3    5    8    9   11   13   14   15   16   17   18   19   20   21   23   24   26   30   32 
LCS_GDT     T   137_A     T   137_A      3    7   21      3    3    5    8    9   11   13   14   15   16   17   18   19   20   21   23   24   29   30   32 
LCS_GDT     S   138_A     S   138_A      4    5   21      3    4    4    6    9   11   13   14   15   16   17   18   19   20   22   23   26   29   31   32 
LCS_GDT     V   139_A     V   139_A      4    5   21      3    4    4    4    7    9   12   14   15   16   17   18   19   20   24   24   27   31   37   39 
LCS_GDT     S   140_A     S   140_A      4    6   21      3    4    4    4    5    6    8    8   10   11   11   14   15   18   21   22   24   31   37   39 
LCS_GDT     E   141_A     E   141_A      4    6   20      0    4    4    4    5    6    8    8   10   12   16   18   19   19   21   32   41   49   50   59 
LCS_GDT     K   142_A     K   142_A      3    6   20      2    3    3    5    7    8    9   10   18   21   25   29   37   41   48   53   57   64   68   77 
LCS_GDT     E   143_A     E   143_A      3    6   19      3    3    5    7   11   19   21   24   32   36   40   47   57   65   78   86  104  114  124  130 
LCS_GDT     S   144_A     S   144_A      3    6   20      3    4    7   10   15   21   24   31   42   55   75   86  101  114  123  125  126  128  129  130 
LCS_GDT     G   145_A     G   145_A      3    6   58      3    3    4    5    8   26   39   50   70   89  105  118  123  124  125  127  127  128  129  130 
LCS_GDT     H   146_A     H   146_A      3    5   58      3    3    4    6    8   10   16   19   24   25   29   34   41   50   56   58  119  126  128  130 
LCS_GDT     E   147_A     E   147_A      3    5   58      3    3    4    6   10   15   18   30   38   43   47   52   53   55   58   62   64   65   68  130 
LCS_GDT     K   148_A     K   148_A      4    5   58      3    3    5    5    6    9   16   19   24   34   40   46   51   55   58   60   64   65   68   70 
LCS_GDT     D   149_A     D   149_A      4   51   58      3    3    5    6   22   28   41   48   50   51   52   52   53   55   58   62   64   65   68   70 
LCS_GDT     D   150_A     D   150_A      4   51   58      3    3    5    5   13   16   40   44   50   51   52   52   53   55   58   62   64   65   68   70 
LCS_GDT     D   151_A     D   151_A     47   51   58     17   39   46   46   47   49   49   49   50   51   52   52   53   55   58   62   64   65   68   70 
LCS_GDT     V   152_A     V   152_A     47   51   58     16   39   46   46   47   49   49   49   50   51   52   52   53   55   58   62   65   90   95  101 
LCS_GDT     I   153_A     I   153_A     47   51   58     18   39   46   46   47   49   49   49   50   51   52   52   53   61   73   81   88   99  115  136 
LCS_GDT     R   154_A     R   154_A     47   51   58     16   39   46   46   47   49   49   49   50   51   52   64   76   98  118  127  129  132  135  137 
LCS_GDT     C   155_A     C   155_A     47   51   58     18   39   46   46   47   49   49   49   50   51   52   64   75   93  105  118  127  132  135  137 
LCS_GDT     I   156_A     I   156_A     47   51   58     10   39   46   46   47   49   49   49   50   51   52   67   75   88  105  117  127  132  135  137 
LCS_GDT     C   157_A     C   157_A     47   51   58      6   39   46   46   47   49   49   49   50   51   52   67   75   93  105  117  127  132  135  137 
LCS_GDT     G   158_A     G   158_A     47   51   58     18   39   46   46   47   49   49   49   50   51   53   64   76   99  122  127  129  132  135  137 
LCS_GDT     L   159_A     L   159_A     47   51   58      3   39   46   46   47   49   49   49   50   51   52   53   58   69   74   81   88  113  133  137 
LCS_GDT     Y   160_A     Y   160_A     47   51   58     11   39   46   46   47   49   49   49   50   51   52   52   53   66   73   77   83  110  115  126 
LCS_GDT     K   161_A     K   161_A     47   51   58     11   39   46   46   47   49   49   49   50   51   52   52   53   55   58   64   69   74   98  104 
LCS_GDT     D   162_A     D   162_A     47   51   58     14   39   46   46   47   49   49   49   50   51   52   52   53   55   58   62   64   65   68   86 
LCS_GDT     E   163_A     E   163_A     47   51   58     12   39   46   46   47   49   49   49   50   51   52   52   53   55   58   62   64   65   68   70 
LCS_GDT     G   164_A     G   164_A     47   51   58     18   39   46   46   47   49   49   49   50   51   52   52   53   55   58   62   64   65   68   70 
LCS_GDT     L   165_A     L   165_A     47   51   58     18   39   46   46   47   49   49   49   50   51   52   52   53   55   58   62   64   65   68   70 
LCS_GDT     M   166_A     M   166_A     47   51   58     10   39   46   46   47   49   49   49   50   51   52   52   53   55   58   62   64   65   68   70 
LCS_GDT     I   167_A     I   167_A     47   51   58     18   39   46   46   47   49   49   49   50   51   52   52   53   55   58   62   64   69   79   99 
LCS_GDT     Q   168_A     Q   168_A     47   51   58     18   39   46   46   47   49   49   49   50   51   52   52   53   59   69   77   90  101  110  127 
LCS_GDT     C   169_A     C   169_A     47   51   58     18   39   46   46   47   49   49   49   50   51   52   58   66   88   97  108  122  132  135  137 
LCS_GDT     D   170_A     D   170_A     47   51   58     18   39   46   46   47   49   49   49   50   51   52   54   65   73   97  102  119  128  135  137 
LCS_GDT     K   171_A     K   171_A     47   51   58     16   39   46   46   47   49   49   49   50   51   60   78   93  109  122  126  128  132  135  137 
LCS_GDT     C   172_A     C   172_A     47   51   58     10   39   46   46   47   49   49   49   50   51   52   64   76   88  123  127  129  132  135  137 
LCS_GDT     M   173_A     M   173_A     47   51   58     16   39   46   46   47   49   49   49   50   51   52   53   58   88   97  114  128  132  135  137 
LCS_GDT     V   174_A     V   174_A     47   51   58     16   39   46   46   47   49   49   49   50   51   52   53   58   88   97  118  128  132  135  137 
LCS_GDT     W   175_A     W   175_A     47   51   58     18   39   46   46   47   49   49   49   50   51   52   52   58   64   70   80   91  108  126  131 
LCS_GDT     Q   176_A     Q   176_A     47   51   58     14   39   46   46   47   49   49   49   50   51   52   52   61   69   76   90  106  119  126  136 
LCS_GDT     H   177_A     H   177_A     47   51   58     18   39   46   46   47   49   49   49   50   51   52   52   53   55   62   71   81   88  101  112 
LCS_GDT     C   178_A     C   178_A     47   51   58     18   39   46   46   47   49   49   49   50   51   52   52   53   55   58   62   64   65   68   91 
LCS_GDT     D   179_A     D   179_A     47   51   58     16   38   46   46   47   49   49   49   50   51   52   52   53   55   58   62   64   65   68   71 
LCS_GDT     C   180_A     C   180_A     47   51   58     12   38   46   46   47   49   49   49   50   51   52   52   53   56   66   73   81   89  100  108 
LCS_GDT     M   181_A     M   181_A     47   51   58     12   39   46   46   47   49   49   49   50   51   52   52   53   55   58   62   68   83   91  106 
LCS_GDT     G   182_A     G   182_A     47   51   58     17   39   46   46   47   49   49   49   50   51   52   52   53   55   58   62   64   65   68   70 
LCS_GDT     V   183_A     V   183_A     47   51   58     18   39   46   46   47   49   49   49   50   51   52   52   53   55   58   62   64   65   68   70 
LCS_GDT     N   184_A     N   184_A     47   51   58     18   39   46   46   47   49   49   49   50   51   52   52   53   55   58   62   64   65   68   70 
LCS_GDT     T   185_A     T   185_A     47   51   58      5   28   46   46   47   49   49   49   50   51   52   52   53   55   58   62   64   65   68   70 
LCS_GDT     D   186_A     D   186_A     47   51   58      5    8   46   46   47   49   49   49   50   51   52   52   53   55   58   62   64   65   68   70 
LCS_GDT     V   187_A     V   187_A     47   51   58      5   30   46   46   47   49   49   49   50   51   52   52   53   55   58   62   64   65   68   70 
LCS_GDT     E   188_A     E   188_A     47   51   58      5   32   46   46   47   49   49   49   50   51   52   52   53   55   58   62   64   65   68   70 
LCS_GDT     H   189_A     H   189_A     47   51   58      5   34   46   46   47   49   49   49   50   51   52   52   53   55   58   62   64   65   68   73 
LCS_GDT     Y   190_A     Y   190_A     47   51   58     18   39   46   46   47   49   49   49   50   51   52   52   53   55   58   62   68   72   90  106 
LCS_GDT     L   191_A     L   191_A     47   51   58     18   39   46   46   47   49   49   49   50   51   52   52   53   55   58   62   75   88  109  117 
LCS_GDT     C   192_A     C   192_A     47   51   58     18   39   46   46   47   49   49   49   50   51   52   52   53   55   58   82  109  114  123  133 
LCS_GDT     E   193_A     E   193_A     47   51   58     15   39   46   46   47   49   49   49   50   51   52   52   53   55   58   62   64   73   87   92 
LCS_GDT     Q   194_A     Q   194_A     47   51   58     18   39   46   46   47   49   49   49   50   51   52   52   70   77   88   99  104  109  110  113 
LCS_GDT     C   195_A     C   195_A     47   51   58      4   39   46   46   47   49   49   49   50   51   52   52   53   55   88   99  104  109  110  113 
LCS_GDT     D   196_A     D   196_A     47   51   58     15   39   46   46   47   49   49   49   50   51   52   52   53   55   58   62   64   65   68   70 
LCS_GDT     P   197_A     P   197_A     47   51   58      3    5   27   44   47   49   49   49   50   51   52   52   53   55   58   62   64   65   68   70 
LCS_GDT     R   198_A     R   198_A      6   51   58      3    6   27   31   44   49   49   49   50   51   52   52   53   55   58   62   64   65   68   70 
LCS_GDT     P   199_A     P   199_A      6   51   58      3    6   15   31   41   49   49   49   50   51   52   52   53   55   58   62   64   65   68   70 
LCS_GDT     V   200_A     V   200_A      6   51   58      4    6    6    7   10   19   32   43   47   51   52   52   53   55   58   60   64   65   68   70 
LCS_GDT     D   201_A     D   201_A      6    8   58      4    6    6    7    9   14   19   26   35   39   44   46   50   51   57   60   64   64   68   70 
LCS_GDT     R   202_A     R   202_A      6    8   58      4    6    6    7    9   10   14   19   22   23   28   34   38   41   46   49   52   60   68   70 
LCS_GDT     E   203_A     E   203_A      6    8   58      4    6    6    7    9   10   16   18   22   23   29   34   38   41   42   45   49   53   53   54 
LCS_GDT     V   204_A     V   204_A      4    8   58      4    4    4    6    7    8    9   13   18   21   22   26   32   36   40   44   45   46   50   54 
LCS_GDT     P   205_A     P   205_A      4    8   57      4    4    4    6    7    8    9   10   10   11   12   14   17   18   20   24   25   34   38   42 
LCS_AVERAGE  LCS_A:  37.15  (  15.62   44.79   51.05 )

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     31     67     91    105    114    119    120    122    124    125    126    126    126    127    128    128    129    132    135    137 
GDT PERCENT_AT  15.12  32.68  44.39  51.22  55.61  58.05  58.54  59.51  60.49  60.98  61.46  61.46  61.46  61.95  62.44  62.44  62.93  64.39  65.85  66.83
GDT RMS_LOCAL    0.32   0.70   0.87   1.09   1.23   1.37   1.41   1.56   1.69   1.72   1.79   1.79   1.79   2.10   2.16   2.16   3.20   3.81   4.88   4.92
GDT RMS_ALL_AT  19.36  19.75  19.46  19.55  19.59  19.52  19.49  19.43  19.36  19.37  19.32  19.32  19.32  19.27  19.25  19.25  18.25  17.77  16.62  16.69

# Checking swapping
#   possible swapping detected:  E     5_A      E     5_A
#   possible swapping detected:  D    21_A      D    21_A
#   possible swapping detected:  D    49_A      D    49_A
#   possible swapping detected:  Y    50_A      Y    50_A
#   possible swapping detected:  Y    51_A      Y    51_A
#   possible swapping detected:  E    52_A      E    52_A
#   possible swapping detected:  D    56_A      D    56_A
#   possible swapping detected:  F    78_A      F    78_A
#   possible swapping detected:  Y    92_A      Y    92_A
#   possible swapping detected:  D   102_A      D   102_A
#   possible swapping detected:  Y   110_A      Y   110_A
#   possible swapping detected:  E   116_A      E   116_A
#   possible swapping detected:  D   122_A      D   122_A
#   possible swapping detected:  E   136_A      E   136_A
#   possible swapping detected:  D   149_A      D   149_A
#   possible swapping detected:  Y   160_A      Y   160_A
#   possible swapping detected:  D   170_A      D   170_A
#   possible swapping detected:  D   179_A      D   179_A
#   possible swapping detected:  D   186_A      D   186_A
#   possible swapping detected:  E   193_A      E   193_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    S     1_A      S     1_A     5.512     0    0.570   0.573     6.027   26.786   26.667
LGA    M     2_A      M     2_A     4.027     0    0.640   0.880    12.897   43.929   24.702
LGA    N     3_A      N     3_A     3.897     0    0.627   1.158     7.978   52.024   32.500
LGA    I     4_A      I     4_A     3.029     0    0.072   0.395     3.628   53.571   51.845
LGA    E     5_A      E     5_A     2.425     0    0.014   1.424     5.373   62.857   56.032
LGA    V     6_A      V     6_A     2.154     0    0.101   0.910     3.590   70.952   66.395
LGA    A     7_A      A     7_A     2.181     0    0.045   0.043     2.564   68.810   66.476
LGA    R     8_A      R     8_A     1.810     0    0.046   1.030     6.335   75.000   47.835
LGA    A     9_A      A     9_A     1.233     0    0.058   0.057     1.425   83.690   83.238
LGA    A    10_A      A    10_A     1.145     0    0.064   0.072     1.346   85.952   85.048
LGA    R    11_A      R    11_A     0.917     0    0.081   1.264     6.460   92.976   64.632
LGA    L    12_A      L    12_A     0.622     0    0.090   0.226     1.192   97.619   91.786
LGA    A    13_A      A    13_A     0.110     0    0.081   0.084     0.354  100.000  100.000
LGA    Q    14_A      Q    14_A     0.867     0    0.140   1.326     6.694   88.214   65.767
LGA    I    15_A      I    15_A     1.065     0    0.050   0.100     1.863   88.214   82.679
LGA    F    16_A      F    16_A     0.748     0    0.045   0.125     1.244   88.214   91.385
LGA    K    17_A      K    17_A     0.735     0    0.013   0.706     2.021   90.476   87.672
LGA    E    18_A      E    18_A     0.810     0    0.042   1.275     4.089   90.476   72.751
LGA    I    19_A      I    19_A     0.891     0    0.014   0.095     1.092   90.476   88.214
LGA    C    20_A      C    20_A     0.762     0    0.124   0.743     3.255   90.476   83.730
LGA    D    21_A      D    21_A     0.809     0    0.022   0.904     3.781   90.476   75.357
LGA    G    22_A      G    22_A     0.585     0    0.094   0.094     0.587   95.238   95.238
LGA    I    23_A      I    23_A     0.434     0    0.024   0.443     1.010   97.619   94.107
LGA    I    24_A      I    24_A     0.548     0    0.061   0.101     0.991   92.857   91.667
LGA    S    25_A      S    25_A     1.004     0    0.235   0.582     3.985   85.952   76.667
LGA    Y    26_A      Y    26_A     0.853     0    0.035   0.061     1.512   90.476   85.992
LGA    R    27_A      R    27_A     1.231     0    0.007   1.050     4.310   77.143   68.961
LGA    D    28_A      D    28_A     1.808     0    0.056   0.767     3.999   70.952   66.190
LGA    S    29_A      S    29_A     3.077     0    0.073   0.645     5.799   50.119   44.206
LGA    S    30_A      S    30_A     2.476     0    0.021   0.032     2.656   62.857   62.222
LGA    Q    31_A      Q    31_A     1.930     0    0.216   0.411     2.662   70.833   65.767
LGA    Q    32_A      Q    32_A     1.152     0    0.029   1.387     5.167   81.429   67.249
LGA    T    33_A      T    33_A     0.951     0    0.052   0.185     1.373   88.214   86.599
LGA    L    34_A      L    34_A     0.212     0    0.014   0.179     0.989  100.000   98.810
LGA    A    35_A      A    35_A     0.670     0    0.093   0.097     0.907   92.857   92.381
LGA    A    36_A      A    36_A     0.813     0    0.019   0.029     0.983   90.476   90.476
LGA    P    37_A      P    37_A     0.855     0    0.033   0.043     0.958   90.476   90.476
LGA    L    38_A      L    38_A     0.750     0    0.075   1.141     2.537   90.476   83.095
LGA    L    39_A      L    39_A     1.029     0    0.154   1.403     2.772   88.214   80.774
LGA    N    40_A      N    40_A     1.437     0    0.063   0.946     5.017   83.690   71.667
LGA    L    41_A      L    41_A     1.194     0    0.030   0.278     1.961   79.286   78.214
LGA    P    42_A      P    42_A     1.245     0    0.123   0.233     1.908   77.143   81.565
LGA    P    43_A      P    43_A     2.414     0    0.014   0.228     3.474   70.833   64.014
LGA    K    44_A      K    44_A     1.901     0    0.031   0.714     4.196   72.976   61.323
LGA    K    45_A      K    45_A     1.532     0    0.081   0.687     5.050   77.143   57.566
LGA    K    46_A      K    46_A     2.046     0    0.222   0.768     5.660   68.810   52.487
LGA    N    47_A      N    47_A     1.743     0    0.095   1.099     4.275   72.857   67.381
LGA    A    48_A      A    48_A     1.671     0    0.036   0.034     2.035   68.810   69.619
LGA    D    49_A      D    49_A     2.780     0    0.106   1.146     6.934   59.048   46.012
LGA    Y    50_A      Y    50_A     1.783     0    0.010   0.500     5.227   75.119   57.976
LGA    Y    51_A      Y    51_A     0.653     0    0.058   0.467     2.955   83.810   77.500
LGA    E    52_A      E    52_A     2.669     0    0.101   1.205     7.830   55.833   42.063
LGA    K    53_A      K    53_A     3.546     0    0.086   1.264     7.678   48.452   39.206
LGA    I    54_A      I    54_A     1.189     0    0.126   0.145     2.080   79.286   79.464
LGA    S    55_A      S    55_A     2.862     0    0.160   0.146     3.927   59.048   53.810
LGA    D    56_A      D    56_A     2.034     0    0.086   0.344     2.222   73.095   69.940
LGA    P    57_A      P    57_A     2.028     0    0.618   0.548     4.643   56.548   58.980
LGA    L    58_A      L    58_A     0.880     0    0.068   1.225     2.864   81.548   76.369
LGA    D    59_A      D    59_A     1.013     0    0.181   0.677     2.194   85.952   79.464
LGA    L    60_A      L    60_A     0.258     0    0.006   0.089     0.999   95.238   94.048
LGA    S    61_A      S    61_A     1.521     0    0.037   0.610     2.045   77.262   78.968
LGA    T    62_A      T    62_A     1.882     0    0.030   0.147     2.874   75.000   68.435
LGA    I    63_A      I    63_A     0.816     0    0.034   0.093     1.512   92.976   87.262
LGA    E    64_A      E    64_A     0.872     0    0.049   1.337     4.753   85.952   70.159
LGA    K    65_A      K    65_A     1.704     0    0.030   1.335     4.746   79.286   67.196
LGA    Q    66_A      Q    66_A     1.247     0    0.131   0.172     2.382   85.952   76.931
LGA    I    67_A      I    67_A     0.499     0    0.011   0.102     0.815   92.857   91.667
LGA    L    68_A      L    68_A     1.196     0    0.021   0.096     2.635   83.690   74.286
LGA    I    69_A      I    69_A     0.919     0    0.056   0.086     1.520   90.476   84.881
LGA    G    70_A      G    70_A     0.399     0    0.010   0.010     0.832   95.238   95.238
LGA    Y    71_A      Y    71_A     0.861     0    0.056   0.163     1.565   85.952   81.508
LGA    Y    72_A      Y    72_A     1.309     0    0.599   0.470     3.082   73.571   78.175
LGA    K    73_A      K    73_A     2.008     0    0.231   1.292     5.681   63.095   60.265
LGA    T    74_A      T    74_A     1.715     0    0.053   0.252     2.461   77.143   74.150
LGA    V    75_A      V    75_A     1.259     0    0.109   1.247     2.791   83.690   76.871
LGA    E    76_A      E    76_A     1.434     0    0.112   1.177     4.724   85.952   66.349
LGA    A    77_A      A    77_A     1.092     0    0.025   0.034     1.627   85.952   83.333
LGA    F    78_A      F    78_A     0.549     0    0.018   0.140     0.927   95.238   94.805
LGA    D    79_A      D    79_A     0.500     0    0.063   0.640     2.036   95.238   90.833
LGA    A    80_A      A    80_A     0.768     0    0.065   0.064     0.995   90.476   90.476
LGA    D    81_A      D    81_A     0.863     0    0.021   0.666     2.180   90.476   82.798
LGA    M    82_A      M    82_A     0.682     0    0.008   0.605     1.885   90.476   87.143
LGA    L    83_A      L    83_A     0.364     0    0.060   0.155     0.778  100.000   97.619
LGA    K    84_A      K    84_A     0.478     0    0.019   0.999     2.420   92.857   83.862
LGA    V    85_A      V    85_A     0.867     0    0.064   1.072     2.657   90.476   81.905
LGA    F    86_A      F    86_A     0.655     0    0.032   0.089     0.812   90.476   95.671
LGA    R    87_A      R    87_A     0.782     0    0.031   1.283     3.308   88.214   78.918
LGA    N    88_A      N    88_A     1.320     0    0.111   1.212     3.861   83.690   74.583
LGA    A    89_A      A    89_A     1.089     0    0.047   0.048     1.245   81.429   81.429
LGA    E    90_A      E    90_A     1.027     0    0.047   0.354     1.344   81.429   83.439
LGA    K    91_A      K    91_A     1.114     0    0.118   1.049     5.934   81.548   68.095
LGA    Y    92_A      Y    92_A     2.067     0    0.182   0.261     7.202   75.119   43.968
LGA    Y    93_A      Y    93_A     1.119     0    0.073   0.342     2.109   75.119   81.587
LGA    G    94_A      G    94_A     2.717     0    0.294   0.294     5.495   48.333   48.333
LGA    R    95_A      R    95_A     5.992     0    0.236   0.327    12.363   20.357    9.351
LGA    K    96_A      K    96_A     5.482     0    0.149   1.038     7.370   23.690   35.079
LGA    S    97_A      S    97_A     4.979     0    0.289   0.384     6.809   37.262   29.921
LGA    P    98_A      P    98_A     5.124     0    0.071   0.314     8.297   36.429   24.830
LGA    I    99_A      I    99_A     1.799     0    0.227   1.250     4.421   71.071   63.036
LGA    G   100_A      G   100_A     1.942     0    0.111   0.111     1.942   72.857   72.857
LGA    R   101_A      R   101_A     1.522     0    0.069   0.897     5.678   77.143   59.654
LGA    D   102_A      D   102_A     0.615     0    0.032   1.094     3.232   90.476   80.000
LGA    V   103_A      V   103_A     1.124     0    0.092   1.239     3.453   83.690   77.007
LGA    C   104_A      C   104_A     1.137     0    0.065   0.651     1.818   85.952   83.016
LGA    R   105_A      R   105_A     0.583     0    0.024   1.062     7.445   90.476   61.688
LGA    L   106_A      L   106_A     0.864     0    0.024   0.165     0.979   90.476   91.667
LGA    R   107_A      R   107_A     0.825     0    0.035   0.261     1.420   90.476   88.009
LGA    K   108_A      K   108_A     0.566     0    0.026   1.102     4.517   90.476   77.619
LGA    A   109_A      A   109_A     0.789     0    0.087   0.097     1.109   90.476   88.667
LGA    Y   110_A      Y   110_A     0.530     0    0.021   0.254     0.664   95.238   93.651
LGA    Y   111_A      Y   111_A     0.374     0    0.055   0.077     0.430  100.000  100.000
LGA    S   112_A      S   112_A     0.359     0    0.030   0.063     0.414  100.000  100.000
LGA    A   113_A      A   113_A     0.529     0    0.027   0.042     0.738   97.619   96.190
LGA    R   114_A      R   114_A     0.090     0    0.035   0.883     3.083  100.000   88.701
LGA    H   115_A      H   115_A     0.201     0    0.023   1.152     2.429  100.000   90.095
LGA    E   116_A      E   116_A     0.727     0    0.131   1.188     4.488   88.214   75.132
LGA    A   117_A      A   117_A     0.724     0    0.047   0.045     0.744   90.476   90.476
LGA    S   118_A      S   118_A     0.549     0    0.139   0.624     2.981   95.238   88.095
LGA    A   119_A      A   119_A     1.048     0    0.125   0.124     1.829   90.595   87.048
LGA    Q   120_A      Q   120_A     0.728     0    0.038   0.952     5.898   88.214   63.386
LGA    I   121_A      I   121_A     0.771     0    0.058   0.257     1.447   88.214   87.083
LGA    D   122_A      D   122_A     0.779     0    0.011   0.879     3.588   90.476   75.179
LGA    E   123_A      E   123_A     0.455     0    0.136   0.616     2.034   95.238   83.862
LGA    I   124_A      I   124_A     0.871     0    0.146   0.240     1.385   88.214   87.083
LGA    V   125_A      V   125_A     0.859     0    0.036   0.117     1.719   81.667   80.340
LGA    G   126_A      G   126_A     2.987     0    0.489   0.489     7.534   37.619   37.619
LGA    E   127_A      E   127_A    10.225     0    0.130   0.527    16.840    2.500    1.111
LGA    T   128_A      T   128_A     9.579     0    0.090   1.051    12.683    0.476    6.667
LGA    A   129_A      A   129_A    13.006     0    0.188   0.195    17.361    0.000    0.000
LGA    S   130_A      S   130_A    17.171     0    0.586   0.866    20.171    0.000    0.000
LGA    E   131_A      E   131_A    21.766     0    0.180   0.591    25.715    0.000    0.000
LGA    A   132_A      A   132_A    25.156     0    0.328   0.314    28.697    0.000    0.000
LGA    D   133_A      D   133_A    29.542     0    0.169   0.425    33.060    0.000    0.000
LGA    S   134_A      S   134_A    35.225     0    0.026   0.145    39.357    0.000    0.000
LGA    S   135_A      S   135_A    39.659     0    0.390   0.489    41.045    0.000    0.000
LGA    E   136_A      E   136_A    43.008     0    0.246   0.875    48.688    0.000    0.000
LGA    T   137_A      T   137_A    43.564     0    0.572   1.254    46.579    0.000    0.000
LGA    S   138_A      S   138_A    42.267     0    0.521   1.052    46.655    0.000    0.000
LGA    V   139_A      V   139_A    36.883     0    0.226   0.622    38.586    0.000    0.000
LGA    S   140_A      S   140_A    32.096     0    0.536   0.886    33.290    0.000    0.000
LGA    E   141_A      E   141_A    26.886     0    0.556   1.274    28.325    0.000    0.000
LGA    K   142_A      K   142_A    26.118     0    0.532   0.836    33.959    0.000    0.000
LGA    E   143_A      E   143_A    21.821     0    0.543   1.350    23.583    0.000    0.000
LGA    S   144_A      S   144_A    16.741     0    0.045   0.573    18.819    0.000    0.000
LGA    G   145_A      G   145_A    14.187     0    0.495   0.495    15.670    0.000    0.000
LGA    H   146_A      H   146_A    18.562     0    0.569   1.200    21.829    0.000    0.000
LGA    E   147_A      E   147_A    18.418     0    0.167   0.807    19.057    0.000    0.000
LGA    K   148_A      K   148_A    20.708     0    0.211   1.158    22.315    0.000    0.000
LGA    D   149_A      D   149_A    22.963     0    0.508   1.085    27.288    0.000    0.000
LGA    D   150_A      D   150_A    21.527     0    0.565   0.999    22.952    0.000    0.000
LGA    D   151_A      D   151_A    24.066     0    0.449   0.962    29.658    0.000    0.000
LGA    V   152_A      V   152_A    19.151     0    0.137   1.090    20.561    0.000    0.000
LGA    I   153_A      I   153_A    20.678     0    0.087   0.638    25.812    0.000    0.000
LGA    R   154_A      R   154_A    17.831     0    0.074   1.181    19.884    0.000    0.000
LGA    C   155_A      C   155_A    23.183     0    0.028   0.134    28.048    0.000    0.000
LGA    I   156_A      I   156_A    24.955     0    0.040   0.250    30.888    0.000    0.000
LGA    C   157_A      C   157_A    26.129     0    0.184   0.815    29.101    0.000    0.000
LGA    G   158_A      G   158_A    20.407     0    0.025   0.025    22.227    0.000    0.000
LGA    L   159_A      L   159_A    23.877     0    0.614   0.460    29.125    0.000    0.000
LGA    Y   160_A      Y   160_A    21.989     0    0.057   1.418    24.562    0.000    0.000
LGA    K   161_A      K   161_A    28.322     0    0.024   0.873    34.116    0.000    0.000
LGA    D   162_A      D   162_A    32.499     0    0.274   1.114    36.672    0.000    0.000
LGA    E   163_A      E   163_A    37.202     0    0.116   1.264    39.226    0.000    0.000
LGA    G   164_A      G   164_A    41.436     0    0.063   0.063    41.436    0.000    0.000
LGA    L   165_A      L   165_A    40.826     0    0.094   0.630    46.847    0.000    0.000
LGA    M   166_A      M   166_A    34.633     0    0.029   0.891    37.022    0.000    0.000
LGA    I   167_A      I   167_A    31.338     0    0.152   1.335    34.136    0.000    0.000
LGA    Q   168_A      Q   168_A    25.436     0    0.032   1.138    27.890    0.000    0.000
LGA    C   169_A      C   169_A    21.484     0    0.077   0.120    22.471    0.000    0.000
LGA    D   170_A      D   170_A    20.346     0    0.112   1.278    22.332    0.000    0.000
LGA    K   171_A      K   171_A    15.574     0    0.031   0.739    18.016    0.000    0.000
LGA    C   172_A      C   172_A    14.107     0    0.134   0.761    15.061    0.000    0.000
LGA    M   173_A      M   173_A    17.107     0    0.154   1.324    18.654    0.000    0.000
LGA    V   174_A      V   174_A    17.789     0    0.075   0.080    21.057    0.000    0.000
LGA    W   175_A      W   175_A    23.791     0    0.068   0.194    30.751    0.000    0.000
LGA    Q   176_A      Q   176_A    26.538     0    0.061   0.182    30.462    0.000    0.000
LGA    H   177_A      H   177_A    32.724     0    0.024   0.195    34.194    0.000    0.000
LGA    C   178_A      C   178_A    37.678     0    0.051   0.855    40.824    0.000    0.000
LGA    D   179_A      D   179_A    41.174     0    0.094   0.838    45.632    0.000    0.000
LGA    C   180_A      C   180_A    36.067     0    0.068   0.276    37.445    0.000    0.000
LGA    M   181_A      M   181_A    35.142     0    0.050   0.303    37.747    0.000    0.000
LGA    G   182_A      G   182_A    41.656     0    0.038   0.038    42.886    0.000    0.000
LGA    V   183_A      V   183_A    40.717     0    0.189   0.305    43.892    0.000    0.000
LGA    N   184_A      N   184_A    45.609     0    0.592   1.189    49.566    0.000    0.000
LGA    T   185_A      T   185_A    43.679     0    0.196   0.215    47.664    0.000    0.000
LGA    D   186_A      D   186_A    45.027     0    0.148   1.344    50.099    0.000    0.000
LGA    V   187_A      V   187_A    38.797     0    0.072   1.041    40.966    0.000    0.000
LGA    E   188_A      E   188_A    35.216     0    0.043   1.107    38.490    0.000    0.000
LGA    H   189_A      H   189_A    29.677     0    0.260   1.044    32.044    0.000    0.000
LGA    Y   190_A      Y   190_A    28.994     0    0.069   1.362    29.835    0.000    0.000
LGA    L   191_A      L   191_A    25.040     0    0.091   0.175    27.417    0.000    0.000
LGA    C   192_A      C   192_A    23.853     0    0.044   0.039    24.806    0.000    0.000
LGA    E   193_A      E   193_A    26.574     0    0.240   0.640    27.407    0.000    0.000
LGA    Q   194_A      Q   194_A    22.041     0    0.210   0.723    23.073    0.000    0.000
LGA    C   195_A      C   195_A    21.086     0    0.110   0.200    23.964    0.000    0.000
LGA    D   196_A      D   196_A    26.937     0    0.060   1.037    31.344    0.000    0.000
LGA    P   197_A      P   197_A    29.961     0    0.037   0.382    33.916    0.000    0.000
LGA    R   198_A      R   198_A    34.162     0    0.145   1.240    36.080    0.000    0.000
LGA    P   199_A      P   199_A    38.984     0    0.072   0.354    41.254    0.000    0.000
LGA    V   200_A      V   200_A    40.052     0    0.189   0.915    41.811    0.000    0.000
LGA    D   201_A      D   201_A    45.353     0    0.286   1.018    48.448    0.000    0.000
LGA    R   202_A      R   202_A    43.997     0    0.492   1.249    45.882    0.000    0.000
LGA    E   203_A      E   203_A    50.453     0    0.140   1.173    53.570    0.000    0.000
LGA    V   204_A      V   204_A    49.566     0    0.109   0.144    51.828    0.000    0.000
LGA    P   205_A      P   205_A    55.849     0    0.466   0.503    57.572    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      205     820    820  100.00    1624   1624  100.00               205
SUMMARY(RMSD_GDC):    13.946         13.926                 14.164           49.355   45.461

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  205  205    4.0    122    1.56    51.463    52.213     7.352

LGA_LOCAL      RMSD:   1.559  Number of atoms:  122  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  19.427  Number of assigned atoms:  205 
Std_ASGN_ATOMS RMSD:  13.946  Standard rmsd on all 205 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.630457 * X  +  -0.706309 * Y  +  -0.321950 * Z  +   9.640429
  Y_new =  -0.520075 * X  +   0.076461 * Y  +   0.850691 * Z  +  -1.342833
  Z_new =  -0.576235 * X  +   0.703762 * Y  +  -0.415539 * Z  +   0.919410 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -2.451841  0.614114  2.104167   [DEG: -140.4802   35.1861  120.5599 ]
ZXZ: -2.779795  1.999332 -0.686095   [DEG: -159.2705  114.5533  -39.3104 ]
 
# END of job
