
#######################################################
#                                                     #
#                        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  131 (  981),  selected  121 , name one
# Molecule2: number of CA atoms  121 (  907),  selected  121 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:B  -ch2:C  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   121      11_C - 131_C       1.20     1.20
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   121      11_C - 131_C       1.20     1.20
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   103      28_C - 130_C       0.98     1.22
  LCS_AVERAGE:     74.97

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  121
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     H    11_B     H    11_C     16  121  121     10   22   98  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     T    12_B     T    12_C     16  121  121     11   65  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     D    13_B     D    13_C     16  121  121     14   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     K    14_B     K    14_C     16  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     L    15_B     L    15_C     16  121  121     38   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     W    16_B     W    16_C     16  121  121     28   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     Y    17_B     Y    17_C     16  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     I    18_B     I    18_C     16  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     L    19_B     L    19_C     16  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     Q    20_B     Q    20_C     16  121  121     34   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     E    21_B     E    21_C     16  121  121     17   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     L    22_B     L    22_C     16  121  121     11   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     T    23_B     T    23_C     16  121  121     38   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     S    24_B     S    24_C     16  121  121      7   36   88  112  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     N    25_B     N    25_C     16  121  121      8   17   30   92  114  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     R    26_B     R    26_C     16  121  121      4   10   21   32   47   95  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     G    27_B     G    27_C     84  121  121      3    6   20   72   88  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     D    28_B     D    28_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     I    29_B     I    29_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     Q    30_B     Q    30_C    103  121  121     18   84  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     G    31_B     G    31_C    103  121  121     39   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     C    32_B     C    32_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     T    33_B     T    33_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     I    34_B     I    34_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     V    35_B     V    35_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     T    36_B     T    36_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     T    37_B     T    37_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     Q    38_B     Q    38_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     G    39_B     G    39_C    103  121  121     31   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     L    40_B     L    40_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     P    41_B     P    41_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     I    42_B     I    42_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     T    43_B     T    43_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     S    44_B     S    44_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     L    45_B     L    45_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     L    46_B     L    46_C    103  121  121      8   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     A    47_B     A    47_C    103  121  121      9   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     D    48_B     D    48_C    103  121  121      5   71  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     D    49_B     D    49_C    103  121  121      5   65  104  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     A    50_B     A    50_C    103  121  121      5   65  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     N    51_B     N    51_C    103  121  121     29   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     V    52_B     V    52_C    103  121  121     26   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     S    53_B     S    53_C    103  121  121     11   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     L    54_B     L    54_C    103  121  121     11   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     I    55_B     I    55_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     S    56_B     S    56_C    103  121  121     17   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     A    57_B     A    57_C    103  121  121     17   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     M    58_B     M    58_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     S    59_B     S    59_C    103  121  121     25   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     A    60_B     A    60_C    103  121  121     43   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     A    61_B     A    61_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     I    62_B     I    62_C    103  121  121     16   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     I    63_B     I    63_C    103  121  121     26   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     S    64_B     S    64_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     V    65_B     V    65_C    103  121  121     11   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     A    66_B     A    66_C    103  121  121     11   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     E    67_B     E    67_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     S    68_B     S    68_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     A    69_B     A    69_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     S    70_B     S    70_C    103  121  121     29   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     Q    71_B     Q    71_C    103  121  121     27   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     E    72_B     E    72_C    103  121  121     31   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     L    73_B     L    73_C    103  121  121     26   80  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     Q    74_B     Q    74_C    103  121  121      6   70  104  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     R    75_B     R    75_C    103  121  121     28   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     G    76_B     G    76_C    103  121  121     28   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     Y    77_B     Y    77_C    103  121  121     17   70  104  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     L    78_B     L    78_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     Q    79_B     Q    79_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     R    80_B     R    80_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     I    81_B     I    81_C    103  121  121     32   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     L    82_B     L    82_C    103  121  121     21   86  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     L    83_B     L    83_C    103  121  121     27   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     E    84_B     E    84_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     G    85_B     G    85_C    103  121  121     10   83  104  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     E    86_B     E    86_C    103  121  121     10   64  100  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     L    87_B     L    87_C    103  121  121     17   84  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     G    88_B     G    88_C    103  121  121     40   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     T    89_B     T    89_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     I    90_B     I    90_C    103  121  121     43   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     I    91_B     I    91_C    103  121  121     23   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     I    92_B     I    92_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     S    93_B     S    93_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     K    94_B     K    94_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     A    95_B     A    95_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     G    96_B     G    96_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     P    97_B     P    97_C    103  121  121     17   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     H    98_B     H    98_C    103  121  121      4   29   83  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     A    99_B     A    99_C    103  121  121     18   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     I   100_B     I   100_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     L   101_B     L   101_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     V   102_B     V   102_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     S   103_B     S   103_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     L   104_B     L   104_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     V   105_B     V   105_C    103  121  121     43   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     D   106_B     D   106_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     K   107_B     K   107_C    103  121  121     28   70  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     D   108_B     D   108_C    103  121  121      5   38   92  113  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     A   109_B     A   109_C    103  121  121     10   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     K   110_B     K   110_C    103  121  121     13   79  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     L   111_B     L   111_C    103  121  121     13   57  104  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     G   112_B     G   112_C    103  121  121     13   47  102  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     I   113_B     I   113_C    103  121  121     13   47  102  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     I   114_B     I   114_C    103  121  121     13   51  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     L   115_B     L   115_C    103  121  121     14   57  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     M   116_B     M   116_C    103  121  121     15   61  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     L   117_B     L   117_C    103  121  121     18   77  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     I   118_B     I   118_C    103  121  121     31   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     D   119_B     D   119_C    103  121  121     21   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     K   120_B     K   120_C    103  121  121     26   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     A   121_B     A   121_C    103  121  121     37   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     I   122_B     I   122_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     K   123_B     K   123_C    103  121  121     29   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     Q   124_B     Q   124_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     I   125_B     I   125_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     A   126_B     A   126_C    103  121  121     25   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     E   127_B     E   127_C    103  121  121     26   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     L   128_B     L   128_C    103  121  121     44   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     M   129_B     M   129_C    103  121  121     32   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     D   130_B     D   130_C    103  121  121     18   88  105  115  117  119  120  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_GDT     A   131_B     A   131_C     27  121  121      0    3   25   69   92  118  119  121  121  121  121  121  121  121  121  121  121  121  121  121 
LCS_AVERAGE  LCS_A:  91.66  (  74.97  100.00  100.00 )

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     44     88    105    115    117    119    120    121    121    121    121    121    121    121    121    121    121    121    121    121 
GDT PERCENT_AT  36.36  72.73  86.78  95.04  96.69  98.35  99.17 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00
GDT RMS_LOCAL    0.34   0.63   0.81   0.95   0.99   1.09   1.16   1.20   1.20   1.20   1.20   1.20   1.20   1.20   1.20   1.20   1.20   1.20   1.20   1.20
GDT RMS_ALL_AT   1.34   1.26   1.22   1.21   1.21   1.21   1.21   1.20   1.20   1.20   1.20   1.20   1.20   1.20   1.20   1.20   1.20   1.20   1.20   1.20

# Checking swapping
#   possible swapping detected:  E    72_B      E    72_C
#   possible swapping detected:  E   127_B      E   127_C

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    H    11_B      H    11_C     1.718     0    0.545   1.463    10.126   81.548   40.429
LGA    T    12_B      T    12_C     1.210     0    0.097   1.117     2.853   85.952   80.544
LGA    D    13_B      D    13_C     0.769     0    0.045   1.118     4.200   90.476   77.381
LGA    K    14_B      K    14_C     0.692     0    0.042   1.218     5.611   90.476   76.243
LGA    L    15_B      L    15_C     0.812     0    0.038   1.107     3.339   90.476   83.214
LGA    W    16_B      W    16_C     0.968     0    0.062   0.361     3.283   90.476   71.259
LGA    Y    17_B      Y    17_C     0.698     0    0.060   1.275     7.937   90.476   58.492
LGA    I    18_B      I    18_C     0.632     0    0.024   0.093     0.705   90.476   90.476
LGA    L    19_B      L    19_C     0.693     0    0.040   0.118     1.067   90.476   89.345
LGA    Q    20_B      Q    20_C     0.375     0    0.065   1.151     3.666   95.238   83.492
LGA    E    21_B      E    21_C     0.951     0    0.040   0.752     2.553   90.476   78.095
LGA    L    22_B      L    22_C     0.888     0    0.062   0.864     2.967   92.857   80.952
LGA    T    23_B      T    23_C     0.617     0    0.044   1.314     4.457   90.595   75.646
LGA    S    24_B      S    24_C     2.231     0    0.105   0.626     5.539   65.238   55.397
LGA    N    25_B      N    25_C     3.161     0    0.679   1.052     4.370   48.810   48.571
LGA    R    26_B      R    26_C     4.428     0    0.607   1.266     8.185   33.214   23.636
LGA    G    27_B      G    27_C     3.755     0    0.702   0.702     4.543   43.810   43.810
LGA    D    28_B      D    28_C     0.977     0    0.158   0.857     4.541   85.952   68.750
LGA    I    29_B      I    29_C     1.067     0    0.070   1.300     3.406   83.690   73.631
LGA    Q    30_B      Q    30_C     1.470     0    0.068   0.814     2.397   79.286   73.016
LGA    G    31_B      G    31_C     1.012     0    0.036   0.036     1.100   85.952   85.952
LGA    C    32_B      C    32_C     0.440     0    0.034   0.650     2.217   92.857   89.365
LGA    T    33_B      T    33_C     0.376     0    0.046   0.175     0.760   97.619   95.918
LGA    I    34_B      I    34_C     0.260     0    0.035   0.635     1.699  100.000   95.417
LGA    V    35_B      V    35_C     0.178     0    0.028   0.058     0.438  100.000  100.000
LGA    T    36_B      T    36_C     0.521     0    0.055   1.091     2.948   97.619   86.122
LGA    T    37_B      T    37_C     0.516     0    0.076   1.043     2.881   95.238   83.673
LGA    Q    38_B      Q    38_C     0.518     0    0.145   0.871     4.967   92.857   74.974
LGA    G    39_B      G    39_C     0.603     0    0.086   0.086     0.634   90.476   90.476
LGA    L    40_B      L    40_C     0.530     0    0.021   0.826     2.879   95.238   87.560
LGA    P    41_B      P    41_C     0.256     0    0.059   0.151     0.655   97.619   95.918
LGA    I    42_B      I    42_C     0.327     0    0.022   0.096     0.592  100.000   97.619
LGA    T    43_B      T    43_C     0.408     0    0.042   0.125     0.427  100.000  100.000
LGA    S    44_B      S    44_C     0.421     0    0.054   0.091     0.479  100.000  100.000
LGA    L    45_B      L    45_C     0.701     0    0.336   1.103     2.605   86.071   82.976
LGA    L    46_B      L    46_C     0.981     0    0.051   0.150     1.391   85.952   85.952
LGA    A    47_B      A    47_C     0.820     0    0.071   0.080     1.030   88.214   88.667
LGA    D    48_B      D    48_C     1.431     0    0.060   0.919     4.736   77.143   60.952
LGA    D    49_B      D    49_C     1.623     0    0.078   0.639     2.299   75.000   71.905
LGA    A    50_B      A    50_C     1.417     0    0.022   0.040     1.745   79.286   78.000
LGA    N    51_B      N    51_C     0.673     0    0.099   0.199     0.962   90.476   92.857
LGA    V    52_B      V    52_C     0.734     0    0.025   1.021     2.636   90.476   82.041
LGA    S    53_B      S    53_C     0.977     0    0.051   0.635     1.207   88.214   85.952
LGA    L    54_B      L    54_C     0.869     0    0.042   0.066     1.711   90.476   84.881
LGA    I    55_B      I    55_C     0.312     0    0.042   1.540     4.590  100.000   80.476
LGA    S    56_B      S    56_C     0.766     0    0.030   0.067     1.025   90.476   88.968
LGA    A    57_B      A    57_C     0.761     0    0.037   0.050     1.073   95.238   92.476
LGA    M    58_B      M    58_C     0.295     0    0.028   1.217     4.785  100.000   78.631
LGA    S    59_B      S    59_C     0.679     0    0.044   0.048     1.334   95.238   90.635
LGA    A    60_B      A    60_C     0.428     0    0.036   0.049     0.643  100.000   98.095
LGA    A    61_B      A    61_C     0.286     0    0.032   0.050     0.610  100.000   98.095
LGA    I    62_B      I    62_C     0.866     0    0.019   0.699     1.723   90.476   84.881
LGA    I    63_B      I    63_C     0.721     0    0.028   0.893     3.401   90.476   79.048
LGA    S    64_B      S    64_C     0.543     0    0.059   0.107     0.657   90.476   90.476
LGA    V    65_B      V    65_C     1.137     0    0.026   1.217     4.166   83.690   74.014
LGA    A    66_B      A    66_C     1.154     0    0.043   0.042     1.391   85.952   85.048
LGA    E    67_B      E    67_C     0.588     0    0.039   0.888     3.145   90.476   80.317
LGA    S    68_B      S    68_C     0.607     0    0.029   0.706     2.383   90.476   86.190
LGA    A    69_B      A    69_C     0.730     0    0.040   0.048     1.131   90.476   88.667
LGA    S    70_B      S    70_C     0.814     0    0.052   0.049     1.128   90.476   88.968
LGA    Q    71_B      Q    71_C     0.625     0    0.028   1.091     3.207   90.476   74.074
LGA    E    72_B      E    72_C     0.511     0    0.087   1.016     4.367   90.595   72.381
LGA    L    73_B      L    73_C     1.172     0    0.208   0.294     2.244   79.524   77.262
LGA    Q    74_B      Q    74_C     1.574     0    0.101   1.221     4.331   79.286   68.201
LGA    R    75_B      R    75_C     0.517     0    0.259   1.276     2.869   81.786   78.788
LGA    G    76_B      G    76_C     1.424     0    0.087   0.087     1.424   83.690   83.690
LGA    Y    77_B      Y    77_C     1.778     0    0.046   1.274     7.783   77.143   50.000
LGA    L    78_B      L    78_C     0.710     0    0.034   1.048     2.832   88.214   83.155
LGA    Q    79_B      Q    79_C     0.723     0    0.104   1.029     3.490   90.476   72.487
LGA    R    80_B      R    80_C     0.586     0    0.069   0.598     4.706   92.857   64.632
LGA    I    81_B      I    81_C     0.516     0    0.025   1.120     3.241   90.476   80.179
LGA    L    82_B      L    82_C     1.118     0    0.124   1.379     3.970   81.429   69.702
LGA    L    83_B      L    83_C     0.997     0    0.062   0.892     3.344   88.214   79.821
LGA    E    84_B      E    84_C     0.969     0    0.130   0.737     3.411   83.690   76.402
LGA    G    85_B      G    85_C     1.605     0    0.060   0.060     1.683   75.000   75.000
LGA    E    86_B      E    86_C     2.129     0    0.137   0.171     3.752   68.810   59.206
LGA    L    87_B      L    87_C     1.524     0    0.181   0.961     3.656   77.143   74.583
LGA    G    88_B      G    88_C     1.048     0    0.053   0.053     1.191   83.690   83.690
LGA    T    89_B      T    89_C     0.883     0    0.061   0.925     2.576   90.476   82.041
LGA    I    90_B      I    90_C     0.833     0    0.041   1.189     2.520   90.476   79.881
LGA    I    91_B      I    91_C     0.817     0    0.078   1.108     3.338   90.476   81.012
LGA    I    92_B      I    92_C     0.597     0    0.116   0.162     1.202   90.595   89.405
LGA    S    93_B      S    93_C     0.481     0    0.063   0.148     0.861   95.238   93.651
LGA    K    94_B      K    94_C     0.559     0    0.017   0.866     2.599   92.857   85.873
LGA    A    95_B      A    95_C     0.218     0    0.055   0.074     0.436  100.000  100.000
LGA    G    96_B      G    96_C     0.168     0    0.046   0.046     0.629   97.619   97.619
LGA    P    97_B      P    97_C     1.051     0    0.161   0.156     2.277   77.381   85.714
LGA    H    98_B      H    98_C     2.219     0    0.243   1.148     6.460   75.119   50.905
LGA    A    99_B      A    99_C     0.888     0    0.045   0.047     1.295   88.214   86.857
LGA    I   100_B      I   100_C     0.252     0    0.034   1.222     3.144  100.000   85.952
LGA    L   101_B      L   101_C     0.100     0    0.027   0.139     0.727  100.000   98.810
LGA    V   102_B      V   102_C     0.276     0    0.050   0.083     0.473  100.000  100.000
LGA    S   103_B      S   103_C     0.801     0    0.111   0.693     2.392   90.476   84.683
LGA    L   104_B      L   104_C     0.668     0    0.101   0.866     2.741   92.857   86.369
LGA    V   105_B      V   105_C     1.127     0    0.057   1.193     3.037   81.429   73.469
LGA    D   106_B      D   106_C     1.059     0    0.093   0.887     3.283   81.429   71.488
LGA    K   107_B      K   107_C     1.460     0    0.064   0.970     3.177   75.119   69.735
LGA    D   108_B      D   108_C     2.475     0    0.246   0.343     4.736   70.833   54.881
LGA    A   109_B      A   109_C     1.279     0    0.052   0.071     1.735   81.548   81.524
LGA    K   110_B      K   110_C     1.152     0    0.083   1.740     7.456   83.690   63.757
LGA    L   111_B      L   111_C     1.548     0    0.076   0.187     1.637   75.000   76.071
LGA    G   112_B      G   112_C     2.043     0    0.047   0.047     2.043   66.786   66.786
LGA    I   113_B      I   113_C     1.941     0    0.028   0.675     4.042   72.857   67.381
LGA    I   114_B      I   114_C     1.556     0    0.023   1.503     4.728   77.143   64.167
LGA    L   115_B      L   115_C     1.506     0    0.044   1.017     3.316   77.143   72.143
LGA    M   116_B      M   116_C     1.564     0    0.025   0.814     4.011   77.143   63.155
LGA    L   117_B      L   117_C     1.203     0    0.023   1.012     3.528   85.952   76.845
LGA    I   118_B      I   118_C     0.520     0    0.046   1.089     2.612   92.857   82.083
LGA    D   119_B      D   119_C     0.914     0    0.043   1.018     3.058   90.476   76.012
LGA    K   120_B      K   120_C     0.840     0    0.028   1.013     5.412   90.476   76.085
LGA    A   121_B      A   121_C     0.530     0    0.025   0.043     0.661   95.238   94.286
LGA    I   122_B      I   122_C     0.401     0    0.034   1.463     4.677   97.619   80.476
LGA    K   123_B      K   123_C     0.496     0    0.032   1.308     6.145  100.000   78.466
LGA    Q   124_B      Q   124_C     0.285     0    0.036   1.144     4.962  100.000   81.799
LGA    I   125_B      I   125_C     0.536     0    0.048   1.092     3.117   97.619   83.571
LGA    A   126_B      A   126_C     0.618     0    0.033   0.040     0.831   92.857   92.381
LGA    E   127_B      E   127_C     0.750     0    0.024   0.833     3.883   95.238   76.931
LGA    L   128_B      L   128_C     0.360     0    0.078   1.206     3.296  100.000   86.845
LGA    M   129_B      M   129_C     0.729     0    0.156   1.075     3.834   88.214   78.155
LGA    D   130_B      D   130_C     0.744     0    0.585   0.612     1.799   83.810   83.810
LGA    A   131_B      A   131_C     3.841     0    0.376   0.407     5.479   39.167   40.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      121     484    484  100.00     907    907  100.00               121
SUMMARY(RMSD_GDC):     1.204          1.221                  2.109           87.063   79.164

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  131  121    4.0    121    1.20    91.942    96.147     9.277

LGA_LOCAL      RMSD:   1.204  Number of atoms:  121  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   1.204  Number of assigned atoms:  121 
Std_ASGN_ATOMS RMSD:   1.204  Standard rmsd on all 121 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.343529 * X  +  -0.773103 * Y  +  -0.533198 * Z  +   7.431809
  Y_new =   0.917707 * X  +   0.155731 * Y  +   0.365460 * Z  + -52.918766
  Z_new =  -0.199503 * X  +  -0.614866 * Y  +   0.762980 * Z  +  22.349672 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  1.212610  0.200850 -0.678313   [DEG:   69.4774   11.5079  -38.8644 ]
ZXZ: -2.171664  0.702886 -2.827845   [DEG: -124.4272   40.2724 -162.0236 ]
 
# END of job
