
#######################################################
#                                                     #
#                        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       4.42    18.95
  LCS_AVERAGE:     50.99

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   126       1_A - 126_A       1.79    19.05
  LONGEST_CONTINUOUS_SEGMENT:   126       2_A - 127_A       1.93    19.02
  LCS_AVERAGE:     44.79

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:    47     151_A - 197_A       0.84    32.41
  LCS_AVERAGE:     15.56

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      3    4   29   76  100  109  113  118  122  124  126  126  126  126  127  130  133  136  137  139 
LCS_GDT     M     2_A     M     2_A      3  126  133      3    4    5   54  109  117  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     N     3_A     N     3_A     39  126  133     13   29   78   99  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     I     4_A     I     4_A     39  126  133     13   38   83  101  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     E     5_A     E     5_A     39  126  133     13   46   84  103  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     V     6_A     V     6_A     39  126  133     13   54   89  104  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     A     7_A     A     7_A     39  126  133     13   53   88  104  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     R     8_A     R     8_A     39  126  133     13   51   89  104  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     A     9_A     A     9_A     39  126  133     13   63   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     A    10_A     A    10_A     39  126  133     25   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     R    11_A     R    11_A     39  126  133     25   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     L    12_A     L    12_A     39  126  133     21   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     A    13_A     A    13_A     39  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     Q    14_A     Q    14_A     39  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     I    15_A     I    15_A     39  126  133     18   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     F    16_A     F    16_A     39  126  133     14   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     K    17_A     K    17_A     39  126  133     25   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     E    18_A     E    18_A     39  126  133     18   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     I    19_A     I    19_A     39  126  133     19   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     C    20_A     C    20_A     39  126  133     25   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     D    21_A     D    21_A     39  126  133     30   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     G    22_A     G    22_A     39  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     I    23_A     I    23_A     39  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     I    24_A     I    24_A     39  126  133     25   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     S    25_A     S    25_A     39  126  133     13   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     Y    26_A     Y    26_A     39  126  133     25   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     R    27_A     R    27_A     39  126  133     25   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     D    28_A     D    28_A     39  126  133     11   62   89  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     S    29_A     S    29_A     39  126  133      6   41   83  102  114  119  121  122  124  125  126  126  126  127  127  128  129  135  136  138 
LCS_GDT     S    30_A     S    30_A     39  126  133     10   54   87  104  114  119  121  122  124  125  126  126  126  127  127  129  133  135  137  139 
LCS_GDT     Q    31_A     Q    31_A     39  126  133     12   55   88  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     Q    32_A     Q    32_A     39  126  133     24   65   90  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     T    33_A     T    33_A     39  126  133     24   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     L    34_A     L    34_A     39  126  133     24   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     A    35_A     A    35_A     39  126  133     24   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     A    36_A     A    36_A     39  126  133     24   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     P    37_A     P    37_A     39  126  133     24   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     L    38_A     L    38_A     39  126  133     24   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     L    39_A     L    39_A     39  126  133      4   61   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     N    40_A     N    40_A     39  126  133     23   65   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     L    41_A     L    41_A     39  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     P    42_A     P    42_A     39  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     P    43_A     P    43_A     35  126  133      7   60   91  104  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     K    44_A     K    44_A     16  126  133     27   65   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     K    45_A     K    45_A     16  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     K    46_A     K    46_A     16  126  133     11   54   86  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     N    47_A     N    47_A     16  126  133      5   42   86  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     A    48_A     A    48_A     16  126  133      5   25   85  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     D    49_A     D    49_A     16  126  133      6   16   62  101  110  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     Y    50_A     Y    50_A     16  126  133      6   23   86  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     Y    51_A     Y    51_A     16  126  133     14   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     E    52_A     E    52_A     16  126  133      6   27   72  101  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     K    53_A     K    53_A     16  126  133      3   14   54   86  108  115  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     I    54_A     I    54_A     40  126  133     13   65   90  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     S    55_A     S    55_A     40  126  133      4   29   84  101  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     D    56_A     D    56_A     40  126  133      7   61   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     P    57_A     P    57_A     40  126  133      5   51   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     L    58_A     L    58_A     40  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     D    59_A     D    59_A     40  126  133     11   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     L    60_A     L    60_A     40  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     S    61_A     S    61_A     40  126  133     14   65   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     T    62_A     T    62_A     40  126  133     13   58   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     I    63_A     I    63_A     40  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     E    64_A     E    64_A     40  126  133     23   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     K    65_A     K    65_A     40  126  133     11   61   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     Q    66_A     Q    66_A     40  126  133     19   65   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     I    67_A     I    67_A     40  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     L    68_A     L    68_A     40  126  133      9   50   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     I    69_A     I    69_A     40  126  133     21   65   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     G    70_A     G    70_A     40  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     Y    71_A     Y    71_A     40  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     Y    72_A     Y    72_A     40  126  133     11   64   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     K    73_A     K    73_A     40  126  133     12   59   90  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     T    74_A     T    74_A     40  126  133     13   63   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     V    75_A     V    75_A     40  126  133     14   65   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     E    76_A     E    76_A     40  126  133     11   64   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     A    77_A     A    77_A     40  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     F    78_A     F    78_A     40  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     D    79_A     D    79_A     40  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     A    80_A     A    80_A     40  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     D    81_A     D    81_A     40  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     M    82_A     M    82_A     40  126  133     29   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     L    83_A     L    83_A     40  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     K    84_A     K    84_A     40  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     V    85_A     V    85_A     40  126  133     25   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     F    86_A     F    86_A     40  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     R    87_A     R    87_A     40  126  133     25   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     N    88_A     N    88_A     40  126  133     24   62   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     A    89_A     A    89_A     40  126  133     24   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     E    90_A     E    90_A     40  126  133     22   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     K    91_A     K    91_A     40  126  133     25   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     Y    92_A     Y    92_A     40  126  133      3   40   86  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     Y    93_A     Y    93_A     40  126  133     10   65   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     G    94_A     G    94_A     39  126  133      3    9   51  101  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     R    95_A     R    95_A      4  126  133      3    4    4   17   18   26   85  119  122  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     K    96_A     K    96_A      4  126  133      3   14   26   58   89  109  117  120  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     S    97_A     S    97_A      4  126  133      3    5   30   53   91  106  116  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     P    98_A     P    98_A      4  126  133      4   16   26   58   93  109  117  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     I    99_A     I    99_A     28  126  133      8   60   90  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     G   100_A     G   100_A     28  126  133      6   54   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     R   101_A     R   101_A     28  126  133      6   65   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     D   102_A     D   102_A     28  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     V   103_A     V   103_A     28  126  133     10   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     C   104_A     C   104_A     28  126  133      9   63   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     R   105_A     R   105_A     28  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     L   106_A     L   106_A     28  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     R   107_A     R   107_A     28  126  133     27   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     K   108_A     K   108_A     28  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     A   109_A     A   109_A     28  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     Y   110_A     Y   110_A     28  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     Y   111_A     Y   111_A     28  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     S   112_A     S   112_A     28  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     A   113_A     A   113_A     28  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     R   114_A     R   114_A     28  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     H   115_A     H   115_A     28  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     E   116_A     E   116_A     28  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     A   117_A     A   117_A     28  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     S   118_A     S   118_A     28  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     A   119_A     A   119_A     28  126  133     13   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     Q   120_A     Q   120_A     28  126  133     31   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     I   121_A     I   121_A     28  126  133     24   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     D   122_A     D   122_A     28  126  133     12   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     E   123_A     E   123_A     28  126  133     27   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     I   124_A     I   124_A     28  126  133     23   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     V   125_A     V   125_A     28  126  133     21   68   91  105  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     G   126_A     G   126_A     28  126  133      8   21   71  101  114  119  121  122  124  125  126  126  126  127  127  130  133  136  137  139 
LCS_GDT     E   127_A     E   127_A      5  126  133      3    5    5   10   19   31   45   71   98  117  123  125  126  127  127  130  133  136  137  139 
LCS_GDT     T   128_A     T   128_A      5    8  133      3    5    7   10   19   29   48   71  102  117  123  125  126  127  127  130  133  136  137  139 
LCS_GDT     A   129_A     A   129_A      5    8  133      3    5    5    6    6   11   14   20   23   28   37   50   60   89  120  126  128  130  135  139 
LCS_GDT     S   130_A     S   130_A      5    8  133      4    5    5    6    6    9   12   13   21   26   29   36   54   69   94  116  123  130  131  132 
LCS_GDT     E   131_A     E   131_A      3    4  133      4    4    4    5    6    9   11   13   15   16   19   21   26   29   32   39   50   66   90  111 
LCS_GDT     A   132_A     A   132_A      3    5  133      4    4    4    5    7    9   11   13   15   16   19   21   24   29   30   35   40   47   51   56 
LCS_GDT     D   133_A     D   133_A      3    6  133      3    3    4    5    7    8   11   13   15   16   19   21   24   26   30   32   36   43   49   50 
LCS_GDT     S   134_A     S   134_A      4    6   20      3    4    4    5    6    8   11   13   15   16   17   18   18   21   23   26   26   32   35   38 
LCS_GDT     S   135_A     S   135_A      4    6   20      3    4    4    5    6    9   10   13   15   16   17   18   19   20   22   22   24   28   32   37 
LCS_GDT     E   136_A     E   136_A      4    6   20      3    4    4    5    6    9   11   13   15   16   17   18   19   21   23   26   26   30   32   34 
LCS_GDT     T   137_A     T   137_A      4    6   20      3    4    4    5    6    9   11   13   15   16   17   18   19   20   22   24   24   28   32   34 
LCS_GDT     S   138_A     S   138_A      4    6   20      3    4    4    5    6    9   11   13   15   16   17   18   19   21   23   26   26   30   32   35 
LCS_GDT     V   139_A     V   139_A      3    5   20      0    3    4    5    6    6    8   11   15   16   17   18   19   20   23   28   30   31   35   38 
LCS_GDT     S   140_A     S   140_A      3    5   20      2    3    4    4    5    5    7    8    9    9   10   12   12   13   17   22   24   25   32   34 
LCS_GDT     E   141_A     E   141_A      0    5   19      0    2    4    4    5    5    7    8    9    9   10   12   12   13   21   22   24   27   42   51 
LCS_GDT     K   142_A     K   142_A      3    5   17      0    2    4    4    5    5    7    8    9   11   14   26   29   31   39   41   49   52   63   66 
LCS_GDT     E   143_A     E   143_A      3    5   13      0    2    4    4    5    5    7   14   22   23   26   40   47   55   65   70   84   88  108  118 
LCS_GDT     S   144_A     S   144_A      3    5   13      3    3    3    4    5    8   19   26   37   43   59   72   98  113  121  125  128  130  131  132 
LCS_GDT     G   145_A     G   145_A      3    7   56      3    3    5    6   13   15   19   29   56   73   95  113  118  123  125  126  128  130  131  132 
LCS_GDT     H   146_A     H   146_A      3    7   58      3    3    5    9   13   15   16   40   42   51   55   74   98  117  123  126  128  130  131  132 
LCS_GDT     E   147_A     E   147_A      3    7   58      4    4    4    5    7    8   16   17   23   51   55   62   69   89  112  123  128  130  131  132 
LCS_GDT     K   148_A     K   148_A      4    7   58      3    4    4    6   13   15   16   17   27   33   39   41   50   74   95  118  126  130  131  132 
LCS_GDT     D   149_A     D   149_A      4   51   58      3    4    5   12   19   37   45   50   50   51   52   52   52   53   55   57   59   62   96  100 
LCS_GDT     D   150_A     D   150_A      4   51   58      3    4    5   10   15   37   43   47   50   51   52   52   52   53   55   57   59   94  131  132 
LCS_GDT     D   151_A     D   151_A     47   51   58     21   40   46   46   47   48   49   50   50   51   52   52   52   53   55   57   59   72   79   84 
LCS_GDT     V   152_A     V   152_A     47   51   58     20   40   46   46   47   48   49   50   50   51   52   52   52   65   94  104  111  129  133  136 
LCS_GDT     I   153_A     I   153_A     47   51   58     22   40   46   46   47   48   49   50   50   51   61   84   96  104  111  129  133  136  137  139 
LCS_GDT     R   154_A     R   154_A     47   51   58     14   40   46   46   47   48   49   50   50   51   58  113  121  123  127  130  133  136  137  139 
LCS_GDT     C   155_A     C   155_A     47   51   58     22   40   46   46   47   48   49   50   50   59   66   72  103  118  125  127  131  136  137  139 
LCS_GDT     I   156_A     I   156_A     47   51   58     19   40   46   46   47   48   49   50   50   51   52   52   52   59   73  107  116  127  130  133 
LCS_GDT     C   157_A     C   157_A     47   51   58     11   40   46   46   47   48   49   50   50   51   66   72   81  116  124  127  131  132  137  138 
LCS_GDT     G   158_A     G   158_A     47   51   58     19   40   46   46   47   48   49   50   50   59   68   86   90  102  125  126  130  133  136  138 
LCS_GDT     L   159_A     L   159_A     47   51   58      7   40   46   46   47   48   49   50   50   51   52   52  110  120  127  130  133  136  137  139 
LCS_GDT     Y   160_A     Y   160_A     47   51   58     21   40   46   46   47   48   49   50   50   51   66   84  109  115  122  130  133  135  137  139 
LCS_GDT     K   161_A     K   161_A     47   51   58     21   40   46   46   47   48   49   50   50   51   52   52   63   88   94  104  122  130  136  138 
LCS_GDT     D   162_A     D   162_A     47   51   58     21   40   46   46   47   48   49   50   50   51   52   52   52   53   55   86   92  100  111  116 
LCS_GDT     E   163_A     E   163_A     47   51   58     21   40   46   46   47   48   49   50   50   51   52   52   52   53   76   83   94  100  111  116 
LCS_GDT     G   164_A     G   164_A     47   51   58     21   40   46   46   47   48   49   50   50   51   52   52   52   53   55   57   59   62   66   69 
LCS_GDT     L   165_A     L   165_A     47   51   58     21   40   46   46   47   48   49   50   50   51   52   52   52   53   55   57   59   62   66   69 
LCS_GDT     M   166_A     M   166_A     47   51   58      8   40   46   46   47   48   49   50   50   51   52   52   52   53   55   57   59   62   79   92 
LCS_GDT     I   167_A     I   167_A     47   51   58     22   40   46   46   47   48   49   50   50   51   52   52   52   53   55   57   66   75   85  105 
LCS_GDT     Q   168_A     Q   168_A     47   51   58     22   40   46   46   47   48   49   50   50   51   52   52   52   57   80   95  102  114  122  133 
LCS_GDT     C   169_A     C   169_A     47   51   58     22   40   46   46   47   48   49   50   50   51   54   61   73   83   94  108  119  127  137  138 
LCS_GDT     D   170_A     D   170_A     47   51   58     22   40   46   46   47   48   49   50   50   51   52   52   62   74   82   95  107  117  125  137 
LCS_GDT     K   171_A     K   171_A     47   51   58     22   40   46   46   47   48   49   50   50   51   66   72   81   93  105  127  131  136  137  139 
LCS_GDT     C   172_A     C   172_A     47   51   58      6   40   46   46   47   48   49   50   50   51   57   72   94  120  126  130  133  136  137  139 
LCS_GDT     M   173_A     M   173_A     47   51   58     20   40   46   46   47   48   49   50   50   51   52   60   78   95  118  129  133  136  137  139 
LCS_GDT     V   174_A     V   174_A     47   51   58     14   40   46   46   47   48   49   50   50   51   57   79   96  116  127  130  133  136  137  139 
LCS_GDT     W   175_A     W   175_A     47   51   58     22   40   46   46   47   48   49   50   50   51   52   60   73   84  103  119  131  136  137  139 
LCS_GDT     Q   176_A     Q   176_A     47   51   58     22   40   46   46   47   48   49   50   50   52   58   66   77   93  103  119  127  136  137  139 
LCS_GDT     H   177_A     H   177_A     47   51   58     22   40   46   46   47   48   49   50   50   51   52   60   70   79   91   99  107  118  123  137 
LCS_GDT     C   178_A     C   178_A     47   51   58     22   40   46   46   47   48   49   50   50   51   52   52   52   53   73   80   87   91   98  105 
LCS_GDT     D   179_A     D   179_A     47   51   58     22   40   46   46   47   48   49   50   50   51   52   52   60   65   73   80   87   91   98  105 
LCS_GDT     C   180_A     C   180_A     47   51   58     22   40   46   46   47   48   49   50   50   51   52   56   62   74   82   86   95  103  122  130 
LCS_GDT     M   181_A     M   181_A     47   51   58     22   40   46   46   47   48   49   50   50   51   52   52   52   53   73   80   87   91   98  118 
LCS_GDT     G   182_A     G   182_A     47   51   58     22   40   46   46   47   48   49   50   50   51   52   52   52   53   55   57   59   62   66   69 
LCS_GDT     V   183_A     V   183_A     47   51   58     22   40   46   46   47   48   49   50   50   51   52   52   52   53   55   57   59   62   66   69 
LCS_GDT     N   184_A     N   184_A     47   51   58     22   40   46   46   47   48   49   50   50   51   52   52   52   53   55   57   59   62   66   69 
LCS_GDT     T   185_A     T   185_A     47   51   58      5    6   46   46   47   48   49   50   50   51   52   52   52   53   55   57   59   62   66   69 
LCS_GDT     D   186_A     D   186_A     47   51   58      5    6   46   46   47   48   49   50   50   51   52   52   52   53   55   57   59   62   66   69 
LCS_GDT     V   187_A     V   187_A     47   51   58      5   31   46   46   47   48   49   50   50   51   52   52   52   53   55   57   59   62   66   69 
LCS_GDT     E   188_A     E   188_A     47   51   58      5   31   46   46   47   48   49   50   50   51   52   52   52   53   55   57   59   62   66   69 
LCS_GDT     H   189_A     H   189_A     47   51   58      5   31   46   46   47   48   49   50   50   51   52   52   52   53   55   57   59   62   66   69 
LCS_GDT     Y   190_A     Y   190_A     47   51   58     22   40   46   46   47   48   49   50   50   51   52   52   52   53   55   57   59   62   66   69 
LCS_GDT     L   191_A     L   191_A     47   51   58     22   40   46   46   47   48   49   50   50   51   52   52   52   53   55   80   87   91   98  118 
LCS_GDT     C   192_A     C   192_A     47   51   58     22   40   46   46   47   48   49   50   50   51   52   52   52   53   55   57   89  113  122  133 
LCS_GDT     E   193_A     E   193_A     47   51   58     22   40   46   46   47   48   49   50   50   51   52   52   52   53   55   57   59   62   66   69 
LCS_GDT     Q   194_A     Q   194_A     47   51   58     21   40   46   46   47   48   49   50   50   51   52   52   52   53   55   57   64   67   75   82 
LCS_GDT     C   195_A     C   195_A     47   51   58     10   40   46   46   47   48   49   50   50   51   52   52   52   53   55   57   59   62   75   82 
LCS_GDT     D   196_A     D   196_A     47   51   58     22   40   46   46   47   48   49   50   50   51   52   52   52   53   55   57   59   62   66   69 
LCS_GDT     P   197_A     P   197_A     47   51   58      4    5    9   41   47   48   49   50   50   51   52   52   52   53   55   57   59   62   66   69 
LCS_GDT     R   198_A     R   198_A      6   51   58      5    6   11   20   41   48   49   50   50   51   52   52   52   53   55   57   59   62   66   69 
LCS_GDT     P   199_A     P   199_A      6   51   58      5    6   15   25   41   46   49   50   50   51   52   52   52   53   55   57   59   62   66   69 
LCS_GDT     V   200_A     V   200_A      6   51   58      5    6    6    7   15   20   34   41   47   51   52   52   52   53   55   57   59   62   66   69 
LCS_GDT     D   201_A     D   201_A      6    8   58      5    6    6    7   11   14   21   28   36   40   46   48   51   53   53   57   59   62   66   69 
LCS_GDT     R   202_A     R   202_A      6    8   58      4    6    6    7    8   11   14   19   22   26   32   36   40   41   43   52   53   56   63   69 
LCS_GDT     E   203_A     E   203_A      6    8   58      5    6    6    7    9   11   15   19   22   26   30   36   37   41   43   47   50   54   55   61 
LCS_GDT     V   204_A     V   204_A      4    8   58      3    4    4    5    7    8    9   14   17   19   22   26   32   35   41   42   46   46   51   55 
LCS_GDT     P   205_A     P   205_A      4    8   58      3    4    4    5    7    8    9   10   10   10   12   13   15   18   21   21   34   39   41   43 
LCS_AVERAGE  LCS_A:  37.11  (  15.56   44.79   50.99 )

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     68     91    105    114    119    121    122    124    125    126    126    126    127    127    130    133    136    137    139 
GDT PERCENT_AT  15.12  33.17  44.39  51.22  55.61  58.05  59.02  59.51  60.49  60.98  61.46  61.46  61.46  61.95  61.95  63.41  64.88  66.34  66.83  67.80
GDT RMS_LOCAL    0.34   0.67   0.86   1.07   1.24   1.37   1.44   1.54   1.64   1.72   1.79   1.79   1.79   2.09   2.09   3.21   3.58   4.46   4.31   4.62
GDT RMS_ALL_AT  19.07  19.26  19.13  19.24  19.24  19.23  19.20  19.15  19.11  19.07  19.05  19.05  19.05  19.00  19.00  17.91  17.65  16.87  17.06  16.86

# Checking swapping
#   possible swapping detected:  D    21_A      D    21_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:  D    79_A      D    79_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   143_A      E   143_A
#   possible swapping detected:  D   149_A      D   149_A
#   possible swapping detected:  D   150_A      D   150_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   203_A      E   203_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    S     1_A      S     1_A     6.139     0    0.491   0.562     7.126   22.619   23.016
LGA    M     2_A      M     2_A     3.281     0    0.631   0.959    11.977   50.476   29.762
LGA    N     3_A      N     3_A     3.970     0    0.645   0.763     6.844   52.381   34.345
LGA    I     4_A      I     4_A     3.139     0    0.069   0.471     3.882   53.571   49.286
LGA    E     5_A      E     5_A     2.592     0    0.010   0.967     4.368   60.952   58.360
LGA    V     6_A      V     6_A     2.205     0    0.098   0.915     3.313   68.929   66.190
LGA    A     7_A      A     7_A     2.239     0    0.040   0.038     2.639   68.810   66.476
LGA    R     8_A      R     8_A     1.938     0    0.032   1.125     2.800   70.833   67.879
LGA    A     9_A      A     9_A     1.398     0    0.054   0.053     1.598   79.286   79.714
LGA    A    10_A      A    10_A     1.192     0    0.073   0.082     1.414   85.952   85.048
LGA    R    11_A      R    11_A     0.956     0    0.079   1.305     6.521   92.976   63.117
LGA    L    12_A      L    12_A     0.718     0    0.080   0.236     1.275   90.476   88.214
LGA    A    13_A      A    13_A     0.131     0    0.082   0.084     0.349  100.000  100.000
LGA    Q    14_A      Q    14_A     0.749     0    0.136   1.316     6.622   90.595   66.825
LGA    I    15_A      I    15_A     0.990     0    0.041   0.093     1.731   88.214   83.750
LGA    F    16_A      F    16_A     0.843     0    0.044   0.116     1.362   85.952   88.831
LGA    K    17_A      K    17_A     0.857     0    0.012   0.718     2.126   88.214   86.667
LGA    E    18_A      E    18_A     0.905     0    0.044   1.271     4.084   90.476   71.111
LGA    I    19_A      I    19_A     0.979     0    0.014   0.109     1.175   88.214   85.952
LGA    C    20_A      C    20_A     0.885     0    0.110   0.728     3.163   90.476   83.730
LGA    D    21_A      D    21_A     0.835     0    0.025   0.909     3.967   90.476   75.357
LGA    G    22_A      G    22_A     0.651     0    0.075   0.075     0.652   92.857   92.857
LGA    I    23_A      I    23_A     0.481     0    0.024   0.460     1.044   97.619   92.917
LGA    I    24_A      I    24_A     0.412     0    0.068   0.102     0.902   97.619   95.238
LGA    S    25_A      S    25_A     0.869     0    0.224   0.580     3.826   88.214   79.603
LGA    Y    26_A      Y    26_A     0.771     0    0.049   0.039     1.298   90.476   87.460
LGA    R    27_A      R    27_A     1.105     0    0.008   1.048     4.446   81.548   72.857
LGA    D    28_A      D    28_A     1.793     0    0.054   0.751     3.875   70.952   66.190
LGA    S    29_A      S    29_A     3.163     0    0.077   0.655     5.973   50.119   44.206
LGA    S    30_A      S    30_A     2.514     0    0.024   0.065     2.649   60.952   60.952
LGA    Q    31_A      Q    31_A     1.927     0    0.218   0.359     2.634   70.833   67.513
LGA    Q    32_A      Q    32_A     1.171     0    0.043   0.866     4.881   81.429   64.233
LGA    T    33_A      T    33_A     0.966     0    0.067   0.713     2.218   85.952   81.633
LGA    L    34_A      L    34_A     0.203     0    0.017   0.182     1.018  100.000   97.679
LGA    A    35_A      A    35_A     0.666     0    0.089   0.093     0.894   92.857   92.381
LGA    A    36_A      A    36_A     0.844     0    0.023   0.031     1.094   88.214   88.667
LGA    P    37_A      P    37_A     0.944     0    0.024   0.044     1.085   90.476   89.184
LGA    L    38_A      L    38_A     0.775     0    0.090   1.005     2.607   90.476   84.286
LGA    L    39_A      L    39_A     1.067     0    0.179   1.410     2.710   88.214   79.762
LGA    N    40_A      N    40_A     1.493     0    0.060   0.938     5.027   83.690   70.536
LGA    L    41_A      L    41_A     1.096     0    0.035   0.284     1.854   79.286   78.214
LGA    P    42_A      P    42_A     0.974     0    0.120   0.297     1.662   83.810   86.667
LGA    P    43_A      P    43_A     2.209     0    0.039   0.235     3.558   72.976   65.306
LGA    K    44_A      K    44_A     1.613     0    0.027   0.723     3.914   79.405   64.868
LGA    K    45_A      K    45_A     0.917     0    0.086   0.684     4.396   85.952   66.561
LGA    K    46_A      K    46_A     1.999     0    0.222   0.775     5.288   72.976   55.503
LGA    N    47_A      N    47_A     2.006     0    0.056   0.133     3.165   68.810   64.940
LGA    A    48_A      A    48_A     2.037     0    0.037   0.036     2.303   66.786   66.381
LGA    D    49_A      D    49_A     2.840     0    0.114   0.688     6.104   57.143   44.821
LGA    Y    50_A      Y    50_A     1.817     0    0.008   0.482     5.142   75.119   59.127
LGA    Y    51_A      Y    51_A     0.733     0    0.045   0.508     2.691   83.810   78.849
LGA    E    52_A      E    52_A     2.663     0    0.105   1.206     7.895   55.833   41.534
LGA    K    53_A      K    53_A     3.451     0    0.104   1.299     7.653   51.905   41.429
LGA    I    54_A      I    54_A     1.109     0    0.144   0.157     1.947   79.286   81.667
LGA    S    55_A      S    55_A     2.735     0    0.156   0.142     3.758   59.048   53.810
LGA    D    56_A      D    56_A     1.985     0    0.099   0.346     2.308   75.119   71.964
LGA    P    57_A      P    57_A     2.003     0    0.622   0.724     4.664   58.452   60.068
LGA    L    58_A      L    58_A     0.864     0    0.074   1.225     2.773   83.810   77.500
LGA    D    59_A      D    59_A     0.974     0    0.185   0.671     2.132   88.214   81.667
LGA    L    60_A      L    60_A     0.206     0    0.022   0.077     0.989   95.238   94.048
LGA    S    61_A      S    61_A     1.578     0    0.051   0.649     1.995   75.000   77.222
LGA    T    62_A      T    62_A     1.938     0    0.035   0.127     2.867   72.857   67.211
LGA    I    63_A      I    63_A     0.825     0    0.026   0.079     1.425   90.595   88.274
LGA    E    64_A      E    64_A     0.879     0    0.052   1.094     4.468   85.952   73.333
LGA    K    65_A      K    65_A     1.740     0    0.030   1.322     4.649   75.000   65.291
LGA    Q    66_A      Q    66_A     1.286     0    0.124   0.509     2.700   85.952   77.884
LGA    I    67_A      I    67_A     0.589     0    0.012   0.122     0.843   90.476   90.476
LGA    L    68_A      L    68_A     1.367     0    0.021   0.097     2.657   81.429   73.155
LGA    I    69_A      I    69_A     1.139     0    0.055   0.080     1.644   85.952   82.619
LGA    G    70_A      G    70_A     0.405     0    0.019   0.019     0.728   92.857   92.857
LGA    Y    71_A      Y    71_A     0.842     0    0.040   0.139     1.573   88.214   82.976
LGA    Y    72_A      Y    72_A     1.275     0    0.592   0.456     2.979   77.619   78.056
LGA    K    73_A      K    73_A     2.066     0    0.234   1.275     5.327   63.095   62.540
LGA    T    74_A      T    74_A     1.714     0    0.039   0.255     2.553   77.143   73.061
LGA    V    75_A      V    75_A     1.163     0    0.085   1.192     2.307   83.690   77.959
LGA    E    76_A      E    76_A     1.462     0    0.106   1.231     5.012   85.952   65.767
LGA    A    77_A      A    77_A     1.078     0    0.029   0.038     1.611   85.952   83.333
LGA    F    78_A      F    78_A     0.480     0    0.038   0.115     0.867   97.619   95.671
LGA    D    79_A      D    79_A     0.396     0    0.051   0.699     1.535  100.000   94.286
LGA    A    80_A      A    80_A     0.722     0    0.070   0.069     0.962   90.476   90.476
LGA    D    81_A      D    81_A     0.809     0    0.019   0.667     2.172   90.476   82.798
LGA    M    82_A      M    82_A     0.647     0    0.015   0.613     1.879   90.476   87.143
LGA    L    83_A      L    83_A     0.372     0    0.057   0.135     0.599   97.619   97.619
LGA    K    84_A      K    84_A     0.486     0    0.014   1.159     2.377   92.857   82.857
LGA    V    85_A      V    85_A     0.778     0    0.060   1.072     2.606   90.476   83.197
LGA    F    86_A      F    86_A     0.617     0    0.013   0.119     0.685   90.476   95.671
LGA    R    87_A      R    87_A     0.879     0    0.037   1.278     3.511   88.214   76.667
LGA    N    88_A      N    88_A     1.301     0    0.118   1.214     3.812   83.690   75.655
LGA    A    89_A      A    89_A     0.936     0    0.059   0.059     1.082   88.214   86.857
LGA    E    90_A      E    90_A     0.903     0    0.040   0.476     1.444   90.476   89.524
LGA    K    91_A      K    91_A     1.006     0    0.121   1.042     5.956   81.548   68.095
LGA    Y    92_A      Y    92_A     1.798     0    0.178   0.274     7.124   79.286   46.746
LGA    Y    93_A      Y    93_A     1.020     0    0.072   0.327     2.228   75.119   80.873
LGA    G    94_A      G    94_A     2.844     0    0.283   0.283     5.458   48.333   48.333
LGA    R    95_A      R    95_A     6.036     0    0.237   1.185    13.736   19.286    8.485
LGA    K    96_A      K    96_A     5.461     0    0.143   1.025     7.362   25.238   34.921
LGA    S    97_A      S    97_A     4.863     0    0.288   0.382     6.649   38.929   31.032
LGA    P    98_A      P    98_A     4.949     0    0.085   0.310     8.108   40.714   27.755
LGA    I    99_A      I    99_A     1.635     0    0.216   1.256     4.292   73.214   64.881
LGA    G   100_A      G   100_A     1.826     0    0.114   0.114     1.826   72.857   72.857
LGA    R   101_A      R   101_A     1.504     0    0.074   0.619     3.961   77.143   62.121
LGA    D   102_A      D   102_A     0.722     0    0.029   1.079     3.060   88.214   79.940
LGA    V   103_A      V   103_A     1.254     0    0.093   1.249     3.727   83.690   74.830
LGA    C   104_A      C   104_A     1.164     0    0.043   0.640     1.841   83.690   81.508
LGA    R   105_A      R   105_A     0.597     0    0.031   0.947     6.727   90.476   62.381
LGA    L   106_A      L   106_A     0.906     0    0.023   0.168     0.984   90.476   90.476
LGA    R   107_A      R   107_A     0.840     0    0.024   1.101     4.019   90.476   82.424
LGA    K   108_A      K   108_A     0.440     0    0.020   1.182     5.084   97.619   81.270
LGA    A   109_A      A   109_A     0.780     0    0.102   0.113     1.163   90.476   88.667
LGA    Y   110_A      Y   110_A     0.437     0    0.025   0.182     0.583   97.619   97.619
LGA    Y   111_A      Y   111_A     0.351     0    0.044   0.208     0.762  100.000   95.238
LGA    S   112_A      S   112_A     0.314     0    0.016   0.637     1.896  100.000   95.476
LGA    A   113_A      A   113_A     0.525     0    0.028   0.045     0.733   97.619   96.190
LGA    R   114_A      R   114_A     0.137     0    0.068   0.852     2.604  100.000   87.706
LGA    H   115_A      H   115_A     0.187     0    0.028   1.147     2.208  100.000   88.381
LGA    E   116_A      E   116_A     0.689     0    0.097   1.158     4.473   90.595   76.190
LGA    A   117_A      A   117_A     0.670     0    0.043   0.041     0.689   90.476   90.476
LGA    S   118_A      S   118_A     0.519     0    0.140   0.608     2.807   95.238   88.095
LGA    A   119_A      A   119_A     1.020     0    0.117   0.117     1.810   90.595   87.048
LGA    Q   120_A      Q   120_A     0.804     0    0.028   1.010     6.412   88.214   62.116
LGA    I   121_A      I   121_A     0.853     0    0.051   0.231     1.549   88.214   83.750
LGA    D   122_A      D   122_A     0.805     0    0.015   0.911     3.967   90.476   74.226
LGA    E   123_A      E   123_A     0.458     0    0.136   0.619     1.791   95.238   86.667
LGA    I   124_A      I   124_A     0.984     0    0.173   0.264     1.573   86.071   84.881
LGA    V   125_A      V   125_A     0.945     0    0.030   0.131     1.849   81.667   80.340
LGA    G   126_A      G   126_A     2.961     0    0.476   0.476     7.477   38.333   38.333
LGA    E   127_A      E   127_A    10.254     0    0.162   0.548    16.996    2.500    1.111
LGA    T   128_A      T   128_A     9.843     0    0.051   1.047    12.155    0.476    3.741
LGA    A   129_A      A   129_A    12.159     0    0.188   0.196    16.421    0.000    0.000
LGA    S   130_A      S   130_A    16.486     0    0.585   0.544    18.859    0.000    0.000
LGA    E   131_A      E   131_A    21.261     0    0.085   0.556    24.989    0.000    0.000
LGA    A   132_A      A   132_A    24.018     0    0.406   0.389    27.450    0.000    0.000
LGA    D   133_A      D   133_A    27.685     0    0.279   0.578    31.123    0.000    0.000
LGA    S   134_A      S   134_A    32.898     0    0.110   0.436    37.362    0.000    0.000
LGA    S   135_A      S   135_A    37.901     0    0.671   0.848    38.700    0.000    0.000
LGA    E   136_A      E   136_A    40.720     0    0.322   1.312    42.431    0.000    0.000
LGA    T   137_A      T   137_A    43.631     0    0.568   1.376    47.680    0.000    0.000
LGA    S   138_A      S   138_A    43.054     0    0.504   0.977    46.592    0.000    0.000
LGA    V   139_A      V   139_A    38.291     0    0.378   0.579    41.231    0.000    0.000
LGA    S   140_A      S   140_A    34.202     0    0.540   0.811    35.497    0.000    0.000
LGA    E   141_A      E   141_A    29.503     0    0.548   1.209    30.957    0.000    0.000
LGA    K   142_A      K   142_A    29.394     0    0.490   0.742    38.394    0.000    0.000
LGA    E   143_A      E   143_A    24.933     0    0.524   1.068    29.532    0.000    0.000
LGA    S   144_A      S   144_A    17.878     0    0.246   0.304    20.441    0.000    0.000
LGA    G   145_A      G   145_A    16.667     0    0.659   0.659    17.838    0.000    0.000
LGA    H   146_A      H   146_A    17.364     0    0.575   1.217    17.586    0.000    0.000
LGA    E   147_A      E   147_A    17.424     0    0.169   0.844    19.408    0.000    0.000
LGA    K   148_A      K   148_A    16.336     0    0.342   1.277    16.624    0.000    0.000
LGA    D   149_A      D   149_A    18.474     0    0.263   1.165    23.907    0.000    0.000
LGA    D   150_A      D   150_A    16.500     0    0.542   1.316    18.071    0.000    0.000
LGA    D   151_A      D   151_A    18.970     0    0.443   0.990    24.463    0.000    0.000
LGA    V   152_A      V   152_A    14.582     0    0.143   1.083    15.821    0.000    0.000
LGA    I   153_A      I   153_A    15.744     0    0.045   0.622    18.510    0.000    0.000
LGA    R   154_A      R   154_A    15.875     0    0.014   1.239    20.744    0.000    0.000
LGA    C   155_A      C   155_A    21.373     0    0.028   0.105    25.582    0.000    0.000
LGA    I   156_A      I   156_A    25.514     0    0.046   0.264    31.700    0.000    0.000
LGA    C   157_A      C   157_A    24.041     0    0.183   0.819    24.708    0.000    0.000
LGA    G   158_A      G   158_A    18.531     0    0.023   0.023    20.328    0.000    0.000
LGA    L   159_A      L   159_A    17.121     0    0.602   0.451    20.648    0.000    0.000
LGA    Y   160_A      Y   160_A    14.135     0    0.080   1.372    15.160    0.000    0.635
LGA    K   161_A      K   161_A    18.378     0    0.021   0.860    21.140    0.000    0.000
LGA    D   162_A      D   162_A    23.646     0    0.081   0.756    27.369    0.000    0.000
LGA    E   163_A      E   163_A    27.848     0    0.155   1.268    29.560    0.000    0.000
LGA    G   164_A      G   164_A    34.086     0    0.021   0.021    34.448    0.000    0.000
LGA    L   165_A      L   165_A    35.831     0    0.052   0.765    42.340    0.000    0.000
LGA    M   166_A      M   166_A    30.689     0    0.045   0.883    32.732    0.000    0.000
LGA    I   167_A      I   167_A    29.708     0    0.152   1.341    33.615    0.000    0.000
LGA    Q   168_A      Q   168_A    24.549     0    0.052   1.126    26.819    0.000    0.000
LGA    C   169_A      C   169_A    22.416     0    0.071   0.120    22.595    0.000    0.000
LGA    D   170_A      D   170_A    22.523     0    0.071   1.408    25.678    0.000    0.000
LGA    K   171_A      K   171_A    18.139     0    0.097   0.759    21.839    0.000    0.000
LGA    C   172_A      C   172_A    15.627     0    0.130   0.757    16.846    0.000    0.000
LGA    M   173_A      M   173_A    16.800     0    0.120   1.373    17.190    0.000    0.000
LGA    V   174_A      V   174_A    16.476     0    0.098   1.218    19.964    0.000    0.000
LGA    W   175_A      W   175_A    20.789     0    0.050   0.169    27.829    0.000    0.000
LGA    Q   176_A      Q   176_A    23.957     0    0.060   0.199    27.600    0.000    0.000
LGA    H   177_A      H   177_A    28.786     0    0.039   0.195    31.288    0.000    0.000
LGA    C   178_A      C   178_A    35.270     0    0.048   0.854    38.471    0.000    0.000
LGA    D   179_A      D   179_A    38.180     0    0.082   0.860    40.453    0.000    0.000
LGA    C   180_A      C   180_A    34.129     0    0.085   0.277    35.857    0.000    0.000
LGA    M   181_A      M   181_A    35.178     0    0.071   0.309    38.829    0.000    0.000
LGA    G   182_A      G   182_A    41.810     0    0.020   0.020    43.977    0.000    0.000
LGA    V   183_A      V   183_A    41.059     0    0.151   0.190    42.975    0.000    0.000
LGA    N   184_A      N   184_A    45.605     0    0.610   1.385    50.926    0.000    0.000
LGA    T   185_A      T   185_A    43.166     0    0.185   0.211    46.799    0.000    0.000
LGA    D   186_A      D   186_A    46.472     0    0.154   1.369    52.039    0.000    0.000
LGA    V   187_A      V   187_A    40.932     0    0.104   1.078    42.661    0.000    0.000
LGA    E   188_A      E   188_A    38.554     0    0.048   1.097    44.200    0.000    0.000
LGA    H   189_A      H   189_A    33.249     0    0.272   0.982    35.523    0.000    0.000
LGA    Y   190_A      Y   190_A    31.347     0    0.085   1.393    31.759    0.000    0.000
LGA    L   191_A      L   191_A    27.697     0    0.089   0.186    29.910    0.000    0.000
LGA    C   192_A      C   192_A    25.932     0    0.042   0.044    27.815    0.000    0.000
LGA    E   193_A      E   193_A    29.732     0    0.234   1.129    30.634    0.000    0.000
LGA    Q   194_A      Q   194_A    25.961     0    0.202   0.717    26.689    0.000    0.000
LGA    C   195_A      C   195_A    24.496     0    0.125   0.193    27.524    0.000    0.000
LGA    D   196_A      D   196_A    30.745     0    0.041   1.050    34.802    0.000    0.000
LGA    P   197_A      P   197_A    34.576     0    0.042   0.369    38.482    0.000    0.000
LGA    R   198_A      R   198_A    38.538     0    0.164   1.175    39.630    0.000    0.000
LGA    P   199_A      P   199_A    42.977     0    0.070   0.323    45.314    0.000    0.000
LGA    V   200_A      V   200_A    42.899     0    0.171   0.884    44.451    0.000    0.000
LGA    D   201_A      D   201_A    47.443     0    0.297   1.028    50.121    0.000    0.000
LGA    R   202_A      R   202_A    45.403     0    0.489   1.329    46.884    0.000    0.000
LGA    E   203_A      E   203_A    50.997     0    0.227   0.683    55.363    0.000    0.000
LGA    V   204_A      V   204_A    49.388     0    0.074   0.102    51.988    0.000    0.000
LGA    P   205_A      P   205_A    55.626     0    0.470   0.515    57.142    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):    14.456         14.463                 14.689           49.533   45.624

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  205  205    4.0    122    1.54    51.829    52.332     7.449

LGA_LOCAL      RMSD:   1.538  Number of atoms:  122  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  19.152  Number of assigned atoms:  205 
Std_ASGN_ATOMS RMSD:  14.456  Standard rmsd on all 205 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.278536 * X  +   0.511636 * Y  +   0.812802 * Z  +   7.002330
  Y_new =  -0.727559 * X  +  -0.440048 * Y  +   0.526322 * Z  +  -2.338093
  Z_new =   0.626957 * X  +  -0.737961 * Y  +   0.249677 * Z  +   1.731188 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -1.205174 -0.677642 -1.244553   [DEG:  -69.0514  -38.8260  -71.3076 ]
ZXZ:  2.145441  1.318450  2.437342   [DEG:  122.9247   75.5416  139.6494 ]
 
# END of job
