
#######################################################
#                                                     #
#                        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  241 ( 1932),  selected  226 , name one
# Molecule2: number of CA atoms  226 ( 1803),  selected  226 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:B  -ch2:B  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   226      23_B - 248_B       1.48     1.48
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   226      23_B - 248_B       1.48     1.48
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   149      24_B - 172_B       0.98     1.58
  LCS_AVERAGE:     52.92

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  226
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     R    23_B     R    23_B    148  226  226      3   17   69  110  182  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     Y    24_B     Y    24_B    149  226  226      4   43  138  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     K    25_B     K    25_B    149  226  226     45  154  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     A    26_B     A    26_B    149  226  226     45  154  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E    27_B     E    27_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     I    28_B     I    28_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     G    29_B     G    29_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S    30_B     S    30_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     V    31_B     V    31_B    149  226  226     71  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S    32_B     S    32_B    149  226  226     62  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     P    33_B     P    33_B    149  226  226     36  153  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     T    34_B     T    34_B    149  226  226     48  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     T    35_B     T    35_B    149  226  226      6   40  166  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S    36_B     S    36_B    149  226  226      6   40  156  201  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     R    37_B     R    37_B    149  226  226      4   40  165  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     D    38_B     D    38_B    149  226  226      4   40  166  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     T    39_B     T    39_B    149  226  226      8   67  190  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     F    40_B     F    40_B    149  226  226     58  156  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E    41_B     E    41_B    149  226  226     44  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     D    42_B     D    42_B    149  226  226     62  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     H    43_B     H    43_B    149  226  226     60  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     D    44_B     D    44_B    149  226  226     64  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     T    45_B     T    45_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     C    46_B     C    46_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     F    47_B     F    47_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L    48_B     L    48_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     G    49_B     G    49_B    149  226  226     62  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     V    50_B     V    50_B    149  226  226     70  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S    51_B     S    51_B    149  226  226     70  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L    52_B     L    52_B    149  226  226     68  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E    53_B     E    53_B    149  226  226      5   91  191  204  214  218  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     N    54_B     N    54_B    149  226  226     18  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S    55_B     S    55_B    149  226  226     58  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     N    56_B     N    56_B    149  226  226     60  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     F    57_B     F    57_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     K    58_B     K    58_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     P    59_B     P    59_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     A    60_B     A    60_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     K    61_B     K    61_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     V    62_B     V    62_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     D    63_B     D    63_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     A    64_B     A    64_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     M    65_B     M    65_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     A    66_B     A    66_B    149  226  226     69  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     K    67_B     K    67_B    149  226  226     71  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     W    68_B     W    68_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     I    69_B     I    69_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S    70_B     S    70_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     R    71_B     R    71_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     R    72_B     R    72_B    149  226  226     70  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     F    73_B     F    73_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S    74_B     S    74_B    149  226  226     36  159  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     Q    75_B     Q    75_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     C    76_B     C    76_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     T    77_B     T    77_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     V    78_B     V    78_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L    79_B     L    79_B    149  226  226     53  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     I    80_B     I    80_B    149  226  226     64  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     G    81_B     G    81_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     D    82_B     D    82_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S    83_B     S    83_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     I    84_B     I    84_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     H    85_B     H    85_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     R    86_B     R    86_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     I    87_B     I    87_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     T    88_B     T    88_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L    89_B     L    89_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E    90_B     E    90_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S    91_B     S    91_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     T    92_B     T    92_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     R    93_B     R    93_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S    94_B     S    94_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     M    95_B     M    95_B    149  226  226     69  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     P    96_B     P    96_B    149  226  226     57  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     P    97_B     P    97_B    149  226  226     14  135  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     R    98_B     R    98_B    149  226  226     40  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     A    99_B     A    99_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     A   100_B     A   100_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L   101_B     L   101_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     D   102_B     D   102_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     D   103_B     D   103_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     A   104_B     A   104_B    149  226  226     68  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L   105_B     L   105_B    149  226  226     66  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     R   106_B     R   106_B    149  226  226     60  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L   107_B     L   107_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     G   108_B     G   108_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     R   109_B     R   109_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E   110_B     E   110_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     F   111_B     F   111_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     V   112_B     V   112_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E   113_B     E   113_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S   114_B     S   114_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     R   115_B     R   115_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     Q   116_B     Q   116_B    149  226  226     67  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     P   117_B     P   117_B    149  226  226     69  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     V   118_B     V   118_B    149  226  226     66  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     F   119_B     F   119_B    149  226  226     68  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E   120_B     E   120_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S   121_B     S   121_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     F   122_B     F   122_B    149  226  226     66  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     R   123_B     R   123_B    149  226  226     71  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     D   124_B     D   124_B    149  226  226      3   81  185  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     R   125_B     R   125_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     T   126_B     T   126_B    149  226  226     57  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     K   127_B     K   127_B    149  226  226     36  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     F   128_B     F   128_B    149  226  226     44  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     T   129_B     T   129_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     F   130_B     F   130_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     V   131_B     V   131_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     T   132_B     T   132_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     C   133_B     C   133_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S   134_B     S   134_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E   135_B     E   135_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     V   136_B     V   136_B    149  226  226     70  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     Q   137_B     Q   137_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S   138_B     S   138_B    149  226  226     58  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     W   139_B     W   139_B    149  226  226     58  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     G   140_B     G   140_B    149  226  226     39  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L   141_B     L   141_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     Y   142_B     Y   142_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     G   143_B     G   143_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     D   144_B     D   144_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     Y   145_B     Y   145_B    149  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     H   146_B     H   146_B    149  226  226     71  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E   147_B     E   147_B    149  226  226     69  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     R   148_B     R   148_B    149  226  226     63  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L   149_B     L   149_B    149  226  226     66  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     R   150_B     R   150_B    149  226  226     35  150  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     Q   151_B     Q   151_B    149  226  226     24  134  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     H   152_B     H   152_B    149  226  226     63  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     Y   153_B     Y   153_B    149  226  226     42  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     D   154_B     D   154_B    149  226  226     39  152  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     Q   155_B     Q   155_B    149  226  226     33  150  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     D   156_B     D   156_B    149  226  226     24  152  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     A   157_B     A   157_B    149  226  226     24  150  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     A   158_B     A   158_B    149  226  226     51  156  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     F   159_B     F   159_B    149  226  226     64  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     R   160_B     R   160_B    149  226  226     35  154  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     G   161_B     G   161_B    149  226  226     35  153  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S   162_B     S   162_B    149  226  226     24  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     V   163_B     V   163_B    149  226  226     24  158  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E   164_B     E   164_B    149  226  226     24  100  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     A   165_B     A   165_B    149  226  226     24   91  190  204  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     F   166_B     F   166_B    149  226  226     13   85  142  204  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     G   167_B     G   167_B    149  226  226     11   85  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     R   168_B     R   168_B    149  226  226     11  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     D   169_B     D   169_B    149  226  226     13   85  192  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     Y   170_B     Y   170_B    149  226  226     13   25   48  158  212  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     H   171_B     H   171_B    149  226  226     13   25   63  203  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     G   172_B     G   172_B    149  226  226      8   25   60  201  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     K   173_B     K   173_B    137  226  226      7   25   28   46   98  215  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     R   174_B     R   174_B     30  226  226      7   16   28   34   55   90  151  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S   175_B     S   175_B     30  226  226      7   14   27   31   42   82  191  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E   176_B     E   176_B     30  226  226      3    8   27   67  142  218  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     G   177_B     G   177_B     30  226  226      3   13   38   81  193  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     V   178_B     V   178_B     30  226  226     12   25   31   94  193  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S   179_B     S   179_B     30  226  226     13   25   30   99  165  215  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     A   180_B     A   180_B     30  226  226     13   38   77  150  200  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     Q   181_B     Q   181_B     30  226  226     13   47   96  150  200  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E   182_B     E   182_B     30  226  226     12   44   83  181  212  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L   183_B     L   183_B     50  226  226     12   53  157  200  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     D   184_B     D   184_B     65  226  226     12   86  169  203  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     H   185_B     H   185_B     65  226  226     15  112  177  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     R   186_B     R   186_B     65  226  226     13  129  187  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     I   187_B     I   187_B     65  226  226     49  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     R   188_B     R   188_B     65  226  226     48  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     K   189_B     K   189_B     65  226  226     14  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S   190_B     S   190_B     65  226  226     39  156  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S   191_B     S   191_B     65  226  226     35  152  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E   192_B     E   192_B     65  226  226     42  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     Y   193_B     Y   193_B     65  226  226     42  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     F   194_B     F   194_B     65  226  226     35  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L   195_B     L   195_B     65  226  226     35  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E   196_B     E   196_B     65  226  226     69  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E   197_B     E   197_B     65  226  226     35  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     F   198_B     F   198_B     65  226  226     35  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     A   199_B     A   199_B     65  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     I   200_B     I   200_B     65  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     F   201_B     F   201_B     65  226  226     61  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     A   202_B     A   202_B     65  226  226     35  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     C   203_B     C   203_B     65  226  226     71  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L   204_B     L   204_B     65  226  226     68  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     Q   205_B     Q   205_B     65  226  226     69  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     R   206_B     R   206_B     65  226  226     47  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     T   207_B     T   207_B     65  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     G   208_B     G   208_B     65  226  226     63  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S   209_B     S   209_B     65  226  226     68  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     P   210_B     P   210_B     65  226  226     62  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     V   211_B     V   211_B     65  226  226     60  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     M   212_B     M   212_B     65  226  226     60  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     V   213_B     V   213_B     65  226  226     42  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     Y   214_B     Y   214_B     65  226  226     60  157  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     P   215_B     P   215_B     65  226  226     58  157  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     G   216_B     G   216_B     65  226  226     58  157  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S   217_B     S   217_B     65  226  226     63  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     F   218_B     F   218_B     65  226  226     62  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S   219_B     S   219_B     65  226  226     46  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     T   220_B     T   220_B     65  226  226     62  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L   221_B     L   221_B     65  226  226     69  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S   222_B     S   222_B     65  226  226     69  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E   223_B     E   223_B     65  226  226     61  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     I   224_B     I   224_B     65  226  226     45  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     A   225_B     A   225_B     65  226  226     33  158  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     Q   226_B     Q   226_B     65  226  226     13  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     G   227_B     G   227_B     65  226  226     24  153  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     K   228_B     K   228_B     65  226  226     59  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     H   229_B     H   229_B     65  226  226     48  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     P   230_B     P   230_B     65  226  226     19  136  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     G   231_B     G   231_B     65  226  226     18  138  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     A   232_B     A   232_B     65  226  226     22  156  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     P   233_B     P   233_B     65  226  226     18  147  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E   234_B     E   234_B     65  226  226     46  147  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     E   235_B     E   235_B     65  226  226     46  156  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L   236_B     L   236_B     65  226  226     67  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     R   237_B     R   237_B     65  226  226     39  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     D   238_B     D   238_B     65  226  226     39  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L   239_B     L   239_B     65  226  226     74  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     I   240_B     I   240_B     65  226  226     70  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     V   241_B     V   241_B     65  226  226     70  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     V   242_B     V   242_B     65  226  226     60  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     S   243_B     S   243_B     65  226  226     63  157  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L   244_B     L   244_B     65  226  226     63  161  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     H   245_B     H   245_B     65  226  226     46  154  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     L   246_B     L   246_B     65  226  226     45  153  194  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     K   247_B     K   247_B     65  226  226     11  135  189  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_GDT     G   248_B     G   248_B     65  226  226      6  109  186  205  214  220  224  226  226  226  226  226  226  226  226  226  226  226  226  226 
LCS_AVERAGE  LCS_A:  84.31  (  52.92  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     74    161    194    205    214    220    224    226    226    226    226    226    226    226    226    226    226    226    226    226 
GDT PERCENT_AT  32.74  71.24  85.84  90.71  94.69  97.35  99.12 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00
GDT RMS_LOCAL    0.35   0.63   0.77   0.88   1.02   1.26   1.37   1.48   1.48   1.48   1.48   1.48   1.48   1.48   1.48   1.48   1.48   1.48   1.48   1.48
GDT RMS_ALL_AT   1.57   1.55   1.58   1.55   1.53   1.48   1.48   1.48   1.48   1.48   1.48   1.48   1.48   1.48   1.48   1.48   1.48   1.48   1.48   1.48

# Checking swapping
#   possible swapping detected:  E    27_B      E    27_B
#   possible swapping detected:  F    47_B      F    47_B
#   possible swapping detected:  F    73_B      F    73_B
#   possible swapping detected:  E    90_B      E    90_B
#   possible swapping detected:  F   111_B      F   111_B
#   possible swapping detected:  F   119_B      F   119_B
#   possible swapping detected:  F   122_B      F   122_B
#   possible swapping detected:  F   128_B      F   128_B
#   possible swapping detected:  F   130_B      F   130_B
#   possible swapping detected:  E   135_B      E   135_B
#   possible swapping detected:  Y   145_B      Y   145_B
#   possible swapping detected:  Y   153_B      Y   153_B
#   possible swapping detected:  D   156_B      D   156_B
#   possible swapping detected:  E   164_B      E   164_B
#   possible swapping detected:  Y   193_B      Y   193_B
#   possible swapping detected:  F   194_B      F   194_B
#   possible swapping detected:  F   218_B      F   218_B

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    R    23_B      R    23_B     3.714     0    0.590   0.450     6.182   47.619   58.701
LGA    Y    24_B      Y    24_B     2.168     0    0.117   0.171     4.852   66.905   51.429
LGA    K    25_B      K    25_B     0.818     0    0.083   1.071     4.572   85.952   70.476
LGA    A    26_B      A    26_B     0.836     0    0.008   0.019     0.946   90.476   90.476
LGA    E    27_B      E    27_B     0.477     0    0.065   0.772     2.274   97.619   85.079
LGA    I    28_B      I    28_B     0.494     0    0.048   0.112     2.164  100.000   89.762
LGA    G    29_B      G    29_B     0.633     0    0.088   0.088     1.143   88.214   88.214
LGA    S    30_B      S    30_B     0.672     0    0.039   0.558     1.515   90.476   87.540
LGA    V    31_B      V    31_B     0.562     0    0.044   0.051     1.223   90.476   89.184
LGA    S    32_B      S    32_B     0.898     0    0.039   0.062     1.384   90.476   87.460
LGA    P    33_B      P    33_B     1.281     0    0.071   0.083     1.634   81.429   78.980
LGA    T    34_B      T    34_B     0.893     0    0.023   0.130     1.438   83.690   86.599
LGA    T    35_B      T    35_B     2.172     0    0.026   0.081     2.693   64.881   62.653
LGA    S    36_B      S    36_B     2.271     0    0.089   0.534     2.884   64.762   63.492
LGA    R    37_B      R    37_B     2.023     0    0.025   1.417     6.209   70.833   58.355
LGA    D    38_B      D    38_B     2.187     0    0.229   0.419     4.518   68.810   54.643
LGA    T    39_B      T    39_B     1.686     0    0.014   0.110     3.111   75.000   67.415
LGA    F    40_B      F    40_B     1.450     0    0.094   0.886     2.738   81.429   73.853
LGA    E    41_B      E    41_B     0.945     0    0.008   0.620     2.189   90.476   83.651
LGA    D    42_B      D    42_B     0.875     0    0.108   0.180     1.170   85.952   88.274
LGA    H    43_B      H    43_B     1.008     0    0.028   0.127     1.429   85.952   83.238
LGA    D    44_B      D    44_B     0.506     0    0.159   0.974     4.315   92.857   74.643
LGA    T    45_B      T    45_B     0.557     0    0.107   0.128     1.195   90.595   89.252
LGA    C    46_B      C    46_B     0.648     0    0.017   0.079     0.738   90.476   90.476
LGA    F    47_B      F    47_B     0.627     0    0.090   1.043     4.923   90.476   70.563
LGA    L    48_B      L    48_B     0.532     0    0.050   0.068     0.568   92.857   91.667
LGA    G    49_B      G    49_B     0.684     0    0.064   0.064     0.825   90.476   90.476
LGA    V    50_B      V    50_B     0.788     0    0.038   0.141     1.165   90.476   89.184
LGA    S    51_B      S    51_B     0.775     0    0.105   0.116     1.285   88.214   90.556
LGA    L    52_B      L    52_B     0.490     0    0.627   0.591     2.581   84.524   91.071
LGA    E    53_B      E    53_B     2.235     0    0.208   0.875     3.458   72.976   68.677
LGA    N    54_B      N    54_B     1.356     0    0.074   0.154     1.753   79.286   80.357
LGA    S    55_B      S    55_B     1.046     0    0.075   0.122     1.252   83.690   84.444
LGA    N    56_B      N    56_B     1.012     0    0.084   0.103     1.800   88.214   81.607
LGA    F    57_B      F    57_B     0.603     0    0.025   0.111     0.642   90.476   93.939
LGA    K    58_B      K    58_B     0.606     0    0.073   0.849     5.316   90.476   71.958
LGA    P    59_B      P    59_B     0.529     0    0.022   0.050     0.657   92.857   93.197
LGA    A    60_B      A    60_B     0.726     0    0.025   0.031     1.077   90.476   88.667
LGA    K    61_B      K    61_B     0.331     0    0.022   0.124     1.265  100.000   95.820
LGA    V    62_B      V    62_B     0.547     0    0.064   0.195     0.822   92.857   93.197
LGA    D    63_B      D    63_B     0.538     0    0.035   0.096     0.708   90.476   90.476
LGA    A    64_B      A    64_B     0.510     0    0.038   0.044     0.564   95.238   96.190
LGA    M    65_B      M    65_B     0.453     0    0.043   0.179     0.797   97.619   96.429
LGA    A    66_B      A    66_B     0.643     0    0.043   0.053     0.838   90.476   90.476
LGA    K    67_B      K    67_B     0.704     0    0.011   0.864     4.445   90.476   74.762
LGA    W    68_B      W    68_B     0.669     0    0.096   1.572     6.172   90.476   69.558
LGA    I    69_B      I    69_B     0.486     0    0.063   0.120     0.532   97.619   98.810
LGA    S    70_B      S    70_B     0.403     0    0.079   0.618     1.901   95.238   90.714
LGA    R    71_B      R    71_B     0.737     0    0.105   0.851     4.557   86.071   72.381
LGA    R    72_B      R    72_B     0.869     0    0.025   0.994     3.864   90.476   80.563
LGA    F    73_B      F    73_B     0.478     0    0.084   0.177     0.684   95.238   94.805
LGA    S    74_B      S    74_B     0.742     0    0.054   0.076     1.533   92.857   87.619
LGA    Q    75_B      Q    75_B     0.101     0    0.058   0.856     2.743   97.619   83.333
LGA    C    76_B      C    76_B     0.077     0    0.100   0.857     2.962  100.000   92.857
LGA    T    77_B      T    77_B     0.629     0    0.082   0.111     0.837   92.857   91.837
LGA    V    78_B      V    78_B     0.583     0    0.044   0.056     0.743   90.476   90.476
LGA    L    79_B      L    79_B     0.985     0    0.051   0.075     1.212   88.214   84.821
LGA    I    80_B      I    80_B     0.845     0    0.034   0.083     0.967   90.476   90.476
LGA    G    81_B      G    81_B     0.579     0    0.104   0.104     1.251   88.214   88.214
LGA    D    82_B      D    82_B     0.714     0    0.063   0.114     0.779   90.476   90.476
LGA    S    83_B      S    83_B     0.664     0    0.055   0.141     0.681   90.476   90.476
LGA    I    84_B      I    84_B     0.535     0    0.053   0.098     0.622   90.476   91.667
LGA    H    85_B      H    85_B     0.597     0    0.028   0.997     4.467   90.476   73.714
LGA    R    86_B      R    86_B     0.610     0    0.044   1.049     4.194   90.476   82.381
LGA    I    87_B      I    87_B     0.652     0    0.093   0.130     0.758   90.476   90.476
LGA    T    88_B      T    88_B     0.965     0    0.021   0.043     1.211   90.476   86.599
LGA    L    89_B      L    89_B     0.922     0    0.020   0.138     1.079   88.214   88.214
LGA    E    90_B      E    90_B     0.860     0    0.054   0.484     1.120   85.952   85.450
LGA    S    91_B      S    91_B     1.063     0    0.053   0.094     1.453   83.690   84.444
LGA    T    92_B      T    92_B     1.104     0    0.057   0.175     1.392   81.429   81.429
LGA    R    93_B      R    93_B     1.036     0    0.031   0.309     1.496   81.429   82.251
LGA    S    94_B      S    94_B     1.181     0    0.046   0.046     1.253   81.429   81.429
LGA    M    95_B      M    95_B     1.397     0    0.046   0.115     1.515   81.429   80.357
LGA    P    96_B      P    96_B     1.391     0    0.070   0.079     1.451   81.429   81.429
LGA    P    97_B      P    97_B     1.461     0    0.090   0.091     2.015   79.286   75.374
LGA    R    98_B      R    98_B     1.243     0    0.057   1.129     6.138   81.429   62.641
LGA    A    99_B      A    99_B     0.992     0    0.014   0.023     1.085   88.214   86.857
LGA    A   100_B      A   100_B     0.665     0    0.026   0.023     0.805   90.476   90.476
LGA    L   101_B      L   101_B     0.453     0    0.028   0.099     0.701   92.857   94.048
LGA    D   102_B      D   102_B     0.810     0    0.023   0.073     0.942   90.476   90.476
LGA    D   103_B      D   103_B     0.828     0    0.059   0.795     3.380   92.857   78.333
LGA    A   104_B      A   104_B     0.435     0    0.104   0.117     0.540   97.619   96.190
LGA    L   105_B      L   105_B     0.645     0    0.041   0.195     1.146   90.476   89.345
LGA    R   106_B      R   106_B     0.941     0    0.056   0.388     2.249   90.476   80.087
LGA    L   107_B      L   107_B     0.584     0    0.069   0.109     0.700   95.238   94.048
LGA    G   108_B      G   108_B     0.548     0    0.075   0.075     0.801   90.476   90.476
LGA    R   109_B      R   109_B     0.526     0    0.052   1.403     7.580   92.857   63.593
LGA    E   110_B      E   110_B     0.582     0    0.044   0.134     1.175   92.857   90.529
LGA    F   111_B      F   111_B     0.705     0    0.042   0.071     0.751   90.476   95.671
LGA    V   112_B      V   112_B     0.766     0    0.016   0.124     1.063   90.476   89.184
LGA    E   113_B      E   113_B     0.414     0    0.024   0.687     3.209   97.619   83.492
LGA    S   114_B      S   114_B     0.427     0    0.033   0.064     0.540  100.000   98.413
LGA    R   115_B      R   115_B     0.238     0    0.033   0.527     1.247  100.000   93.160
LGA    Q   116_B      Q   116_B     0.634     0    0.086   0.727     3.693   97.619   79.735
LGA    P   117_B      P   117_B     0.524     0    0.110   0.275     1.384   90.476   89.184
LGA    V   118_B      V   118_B     0.554     0    0.068   0.066     0.903   92.857   91.837
LGA    F   119_B      F   119_B     0.502     0    0.037   0.128     0.743   92.857   96.537
LGA    E   120_B      E   120_B     0.728     0    0.089   0.249     3.097   95.238   78.571
LGA    S   121_B      S   121_B     0.311     0    0.050   0.043     0.815   95.238   96.825
LGA    F   122_B      F   122_B     0.769     0    0.028   0.151     0.868   90.476   90.476
LGA    R   123_B      R   123_B     0.483     0    0.714   1.168    10.201   84.524   50.303
LGA    D   124_B      D   124_B     1.733     0    0.148   0.227     4.106   84.048   67.262
LGA    R   125_B      R   125_B     0.329     0    0.151   1.165     6.845   97.619   65.152
LGA    T   126_B      T   126_B     0.441     0    0.048   0.069     0.563   95.238   97.279
LGA    K   127_B      K   127_B     0.622     0    0.094   0.196     1.346   95.238   89.577
LGA    F   128_B      F   128_B     0.564     0    0.056   0.179     0.783   92.857   95.671
LGA    T   129_B      T   129_B     0.366     0    0.025   0.094     0.778   97.619   95.918
LGA    F   130_B      F   130_B     0.540     0    0.056   0.154     1.156   92.857   88.874
LGA    V   131_B      V   131_B     0.694     0    0.083   0.983     2.847   90.476   80.952
LGA    T   132_B      T   132_B     0.549     0    0.006   0.112     0.874   95.238   94.558
LGA    C   133_B      C   133_B     0.326     0    0.025   0.769     2.708  100.000   92.857
LGA    S   134_B      S   134_B     0.346     0    0.040   0.702     2.287   97.619   92.540
LGA    E   135_B      E   135_B     0.443     0    0.052   0.383     1.819   95.238   91.693
LGA    V   136_B      V   136_B     0.680     0    0.019   0.054     1.007   90.476   89.184
LGA    Q   137_B      Q   137_B     0.554     0    0.037   0.059     0.883   90.476   95.767
LGA    S   138_B      S   138_B     0.646     0    0.015   0.023     0.749   90.476   90.476
LGA    W   139_B      W   139_B     0.809     0    0.025   0.063     1.358   90.476   86.599
LGA    G   140_B      G   140_B     1.081     0    0.048   0.048     1.081   83.690   83.690
LGA    L   141_B      L   141_B     0.710     0    0.014   0.523     1.757   92.857   88.333
LGA    Y   142_B      Y   142_B     0.405     0    0.014   0.167     0.587   97.619   99.206
LGA    G   143_B      G   143_B     0.449     0    0.046   0.046     0.618   95.238   95.238
LGA    D   144_B      D   144_B     0.417     0    0.000   0.912     3.354  100.000   83.988
LGA    Y   145_B      Y   145_B     0.414     0    0.033   0.454     1.168  100.000   95.317
LGA    H   146_B      H   146_B     0.634     0    0.067   1.125     3.106   88.214   81.143
LGA    E   147_B      E   147_B     0.931     0    0.011   0.170     2.255   85.952   80.688
LGA    R   148_B      R   148_B     1.120     0    0.023   1.287     5.174   81.429   68.571
LGA    L   149_B      L   149_B     0.998     0    0.018   0.067     1.288   85.952   88.214
LGA    R   150_B      R   150_B     1.624     0    0.053   0.662     2.528   75.000   73.117
LGA    Q   151_B      Q   151_B     1.955     0    0.056   0.201     2.643   72.857   67.513
LGA    H   152_B      H   152_B     1.382     0    0.109   0.504     2.119   79.286   78.095
LGA    Y   153_B      Y   153_B     1.439     0    0.047   0.187     1.993   77.143   75.000
LGA    D   154_B      D   154_B     1.821     0    0.073   0.085     2.000   72.857   72.857
LGA    Q   155_B      Q   155_B     1.966     0    0.093   0.329     2.758   72.857   67.513
LGA    D   156_B      D   156_B     1.853     0    0.059   0.792     2.780   70.833   74.345
LGA    A   157_B      A   157_B     1.984     0    0.098   0.104     2.168   72.857   71.238
LGA    A   158_B      A   158_B     1.673     0    0.013   0.030     1.850   77.143   76.286
LGA    F   159_B      F   159_B     0.880     0    0.030   0.104     1.165   83.690   92.338
LGA    R   160_B      R   160_B     1.608     0    0.016   0.130     2.908   75.000   67.836
LGA    G   161_B      G   161_B     1.775     0    0.046   0.046     1.874   72.857   72.857
LGA    S   162_B      S   162_B     1.261     0    0.013   0.670     2.868   79.286   77.460
LGA    V   163_B      V   163_B     1.370     0    0.066   0.098     1.598   77.143   80.272
LGA    E   164_B      E   164_B     1.957     0    0.158   0.843     3.063   72.857   65.926
LGA    A   165_B      A   165_B     2.286     0    0.094   0.098     2.899   66.786   64.857
LGA    F   166_B      F   166_B     2.624     0    0.010   1.697     9.846   60.952   32.424
LGA    G   167_B      G   167_B     2.023     0    0.085   0.085     2.236   68.810   68.810
LGA    R   168_B      R   168_B     1.005     0    0.013   1.263     4.201   81.429   71.082
LGA    D   169_B      D   169_B     1.964     0    0.114   0.250     3.520   66.905   59.464
LGA    Y   170_B      Y   170_B     3.052     0    0.013   0.131     4.969   51.905   43.810
LGA    H   171_B      H   171_B     2.640     0    0.108   0.128     3.853   55.595   64.381
LGA    G   172_B      G   172_B     2.697     0    0.023   0.023     3.891   53.810   53.810
LGA    K   173_B      K   173_B     4.399     4    0.029   0.029     5.938   32.024   17.725
LGA    R   174_B      R   174_B     5.786     0    0.451   1.169     6.687   22.857   21.212
LGA    S   175_B      S   175_B     5.928     0    0.625   0.616     6.747   19.405   18.016
LGA    E   176_B      E   176_B     4.237     4    0.154   0.175     4.436   37.143   20.635
LGA    G   177_B      G   177_B     4.112     0    0.108   0.108     5.176   34.405   34.405
LGA    V   178_B      V   178_B     4.562     0    0.645   0.696     7.601   24.286   34.354
LGA    S   179_B      S   179_B     5.174     0    0.180   0.222     6.136   31.548   28.254
LGA    A   180_B      A   180_B     4.239     0    0.052   0.053     4.656   37.262   36.095
LGA    Q   181_B      Q   181_B     4.143     0    0.054   1.343     6.320   41.905   34.709
LGA    E   182_B      E   182_B     3.475     0    0.025   0.416     3.947   51.905   49.365
LGA    L   183_B      L   183_B     2.572     0    0.034   0.186     3.032   61.190   60.119
LGA    D   184_B      D   184_B     2.116     0    0.061   0.822     3.963   68.810   61.250
LGA    H   185_B      H   185_B     1.788     0    0.040   1.294     4.161   77.143   63.476
LGA    R   186_B      R   186_B     1.297     0    0.038   0.913     5.845   85.952   62.121
LGA    I   187_B      I   187_B     0.534     0    0.000   0.097     1.131   92.857   90.536
LGA    R   188_B      R   188_B     0.769     0    0.023   1.352     3.557   90.476   76.667
LGA    K   189_B      K   189_B     0.693     0    0.019   1.363     3.045   90.595   79.312
LGA    S   190_B      S   190_B     1.376     0    0.027   0.097     1.990   77.143   78.571
LGA    S   191_B      S   191_B     1.706     0    0.078   0.094     1.883   75.000   74.286
LGA    E   192_B      E   192_B     1.332     0    0.057   0.696     4.215   81.429   67.143
LGA    Y   193_B      Y   193_B     1.244     0    0.019   0.188     2.016   81.429   77.183
LGA    F   194_B      F   194_B     1.052     0    0.016   0.054     1.588   85.952   81.515
LGA    L   195_B      L   195_B     0.881     0    0.020   0.048     1.103   90.476   87.083
LGA    E   196_B      E   196_B     0.878     0    0.045   0.119     1.095   90.476   89.471
LGA    E   197_B      E   197_B     0.910     0    0.024   0.176     1.461   90.476   85.450
LGA    F   198_B      F   198_B     0.844     0    0.061   0.147     1.468   92.857   86.407
LGA    A   199_B      A   199_B     0.476     0    0.016   0.033     0.612   97.619   98.095
LGA    I   200_B      I   200_B     0.588     0    0.046   0.095     0.942   90.476   90.476
LGA    F   201_B      F   201_B     0.701     0    0.036   0.232     1.046   90.476   90.519
LGA    A   202_B      A   202_B     0.706     0    0.029   0.041     0.738   90.476   90.476
LGA    C   203_B      C   203_B     0.522     0    0.034   0.107     0.522   97.619   98.413
LGA    L   204_B      L   204_B     0.647     0    0.039   0.276     1.730   95.238   90.655
LGA    Q   205_B      Q   205_B     0.480     0    0.026   0.144     1.623   92.857   87.566
LGA    R   206_B      R   206_B     0.645     0    0.151   0.897     7.963   97.619   58.831
LGA    T   207_B      T   207_B     0.310     0    0.138   0.144     1.136   97.619   93.265
LGA    G   208_B      G   208_B     0.915     0    0.067   0.067     0.915   90.476   90.476
LGA    S   209_B      S   209_B     0.693     0    0.023   0.074     0.881   90.476   90.476
LGA    P   210_B      P   210_B     0.971     0    0.036   0.123     1.174   90.476   87.891
LGA    V   211_B      V   211_B     0.964     0    0.032   0.090     0.989   90.476   90.476
LGA    M   212_B      M   212_B     0.980     0    0.029   1.385     5.751   88.214   74.345
LGA    V   213_B      V   213_B     1.064     0    0.045   0.098     1.236   81.429   84.014
LGA    Y   214_B      Y   214_B     1.099     0    0.060   0.139     1.099   83.690   85.952
LGA    P   215_B      P   215_B     1.150     0    0.439   0.595     2.092   77.262   79.048
LGA    G   216_B      G   216_B     1.144     0    0.080   0.080     1.453   81.429   81.429
LGA    S   217_B      S   217_B     0.861     0    0.036   0.647     2.047   92.857   86.270
LGA    F   218_B      F   218_B     0.535     0    0.046   0.110     0.691   90.476   91.342
LGA    S   219_B      S   219_B     0.691     0    0.019   0.136     1.706   92.857   87.619
LGA    T   220_B      T   220_B     0.682     0    0.016   0.096     0.769   90.476   90.476
LGA    L   221_B      L   221_B     0.389     0    0.078   0.179     0.464  100.000  100.000
LGA    S   222_B      S   222_B     0.460     0    0.018   0.070     0.761   95.238   93.651
LGA    E   223_B      E   223_B     0.614     0    0.046   0.188     1.038   90.595   89.524
LGA    I   224_B      I   224_B     0.866     0    0.038   0.184     1.163   88.214   88.214
LGA    A   225_B      A   225_B     1.026     0    0.016   0.017     1.270   83.690   85.048
LGA    Q   226_B      Q   226_B     1.070     0    0.041   0.144     1.223   83.690   87.513
LGA    G   227_B      G   227_B     1.171     0    0.056   0.056     1.171   83.690   83.690
LGA    K   228_B      K   228_B     0.765     0    0.029   0.571     1.622   90.476   86.508
LGA    H   229_B      H   229_B     0.868     0    0.055   0.133     0.976   90.476   93.333
LGA    P   230_B      P   230_B     1.355     0    0.048   0.287     2.277   85.952   79.184
LGA    G   231_B      G   231_B     1.271     0    0.059   0.059     1.609   79.286   79.286
LGA    A   232_B      A   232_B     1.398     0    0.051   0.079     1.571   81.429   79.714
LGA    P   233_B      P   233_B     1.489     0    0.018   0.053     1.519   81.429   80.204
LGA    E   234_B      E   234_B     1.552     0    0.032   0.359     1.709   77.143   77.619
LGA    E   235_B      E   235_B     1.284     0    0.101   0.206     2.005   81.429   76.720
LGA    L   236_B      L   236_B     0.614     0    0.037   0.050     0.852   90.476   95.238
LGA    R   237_B      R   237_B     0.767     0    0.035   0.541     1.478   90.476   85.541
LGA    D   238_B      D   238_B     0.957     0    0.065   0.264     2.409   90.476   80.714
LGA    L   239_B      L   239_B     0.609     0    0.046   0.118     0.980   90.476   95.238
LGA    I   240_B      I   240_B     0.760     0    0.041   0.083     1.274   90.476   88.214
LGA    V   241_B      V   241_B     0.680     0    0.018   0.074     0.911   90.476   93.197
LGA    V   242_B      V   242_B     1.049     0    0.051   0.096     1.162   81.429   82.721
LGA    S   243_B      S   243_B     1.034     0    0.014   0.093     1.254   85.952   84.444
LGA    L   244_B      L   244_B     0.903     0    0.037   0.145     1.262   85.952   87.083
LGA    H   245_B      H   245_B     0.999     0    0.044   0.705     2.423   90.476   79.190
LGA    L   246_B      L   246_B     0.931     0    0.034   0.206     1.290   85.952   90.595
LGA    K   247_B      K   247_B     1.485     0    0.099   0.240     1.533   79.286   81.481
LGA    G   248_B      G   248_B     1.567     0    0.604   0.604     1.589   75.000   75.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      226     904    904  100.00    1803   1803  100.00               226
SUMMARY(RMSD_GDC):     1.475          1.496                  1.917           84.317   80.368

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  241  226    4.0    226    1.48    90.487    95.459    14.345

LGA_LOCAL      RMSD:   1.475  Number of atoms:  226  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   1.475  Number of assigned atoms:  226 
Std_ASGN_ATOMS RMSD:   1.475  Standard rmsd on all 226 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.648477 * X  +  -0.526534 * Y  +  -0.549763 * Z  +  38.233669
  Y_new =  -0.284114 * X  +  -0.837421 * Y  +   0.466910 * Z  +  31.813334
  Z_new =  -0.706228 * X  +  -0.146585 * Y  +  -0.692644 * Z  + -31.990454 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ: -0.412935  0.784156 -2.933038   [DEG:  -23.6594   44.9288 -168.0507 ]
ZXZ: -2.274880  2.335944 -1.775451   [DEG: -130.3410  133.8397 -101.7259 ]
 
# END of job
